data_25153 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25153 _Entry.PDB_ID 2MT9 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 25153 _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 ASN N N 2 123.320 123.320 119.746 3.574 25153 2 1 1 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.110 0.098 25153 3 1 1 . 1 1 2 2 ASN C C 2 174.590 174.590 174.512 0.078 25153 4 1 1 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.842 0.158 25153 5 1 1 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.283 -0.313 25153 6 1 1 . 1 1 2 2 ASN H H 2 9.428 9.428 8.693 0.735 25153 7 1 1 . 1 1 3 3 MET N N 3 120.920 120.920 118.662 2.258 25153 8 1 1 . 1 1 3 3 MET HA H 3 5.530 5.530 5.254 0.276 25153 9 1 1 . 1 1 3 3 MET C C 3 174.400 174.400 174.897 -0.497 25153 10 1 1 . 1 1 3 3 MET CA C 3 54.643 54.643 54.325 0.318 25153 11 1 1 . 1 1 3 3 MET CB C 3 34.637 34.637 37.670 -3.033 25153 12 1 1 . 1 1 3 3 MET H H 3 8.751 8.751 9.146 -0.395 25153 13 1 1 . 1 1 4 4 GLY N N 4 115.542 115.542 109.409 6.133 25153 14 1 1 . 1 1 4 4 GLY C C 4 170.413 170.413 172.246 -1.833 25153 15 1 1 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.827 -0.725 25153 16 1 1 . 1 1 4 4 GLY H H 4 8.927 8.927 8.907 0.020 25153 17 1 1 . 1 1 5 5 LEU N N 5 131.030 131.030 128.197 2.833 25153 18 1 1 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.304 1.098 25153 19 1 1 . 1 1 5 5 LEU C C 5 175.952 175.952 174.553 1.399 25153 20 1 1 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.059 0.391 25153 21 1 1 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.954 2.638 25153 22 1 1 . 1 1 5 5 LEU H H 5 8.928 8.928 8.674 0.254 25153 23 1 1 . 1 1 6 6 PHE N N 6 125.790 125.790 126.529 -0.739 25153 24 1 1 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.678 0.062 25153 25 1 1 . 1 1 6 6 PHE C C 6 174.300 174.300 175.722 -1.422 25153 26 1 1 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.481 -1.161 25153 27 1 1 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.473 -0.243 25153 28 1 1 . 1 1 6 6 PHE H H 6 9.237 9.237 9.531 -0.294 25153 29 1 1 . 1 1 7 7 TYR N N 7 117.289 117.289 117.520 -0.231 25153 30 1 1 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.873 0.092 25153 31 1 1 . 1 1 7 7 TYR C C 7 171.262 171.262 173.296 -2.034 25153 32 1 1 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.133 -0.733 25153 33 1 1 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.425 -0.185 25153 34 1 1 . 1 1 7 7 TYR H H 7 8.125 8.125 8.584 -0.459 25153 35 1 1 . 1 1 8 8 GLY N N 8 107.420 107.420 107.032 0.388 25153 36 1 1 . 1 1 8 8 GLY C C 8 172.000 172.000 172.267 -0.267 25153 37 1 1 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.268 -0.324 25153 38 1 1 . 1 1 8 8 GLY H H 8 7.031 7.031 8.444 -1.413 25153 39 1 1 . 1 1 9 9 SER N N 9 118.150 118.150 116.176 1.974 25153 40 1 1 . 1 1 9 9 SER HA H 9 5.200 5.200 5.180 0.020 25153 41 1 1 . 1 1 9 9 SER C C 9 175.000 175.000 174.121 0.879 25153 42 1 1 . 1 1 9 9 SER CA C 9 57.570 57.570 57.256 0.314 25153 43 1 1 . 1 1 9 9 SER CB C 9 66.700 66.700 65.915 0.785 25153 44 1 1 . 1 1 9 9 SER H H 9 9.604 9.604 8.125 1.479 25153 45 1 1 . 1 1 10 10 SER N N 10 131.193 131.193 120.075 11.118 25153 46 1 1 . 1 1 10 10 SER HA H 10 4.775 4.775 4.423 0.352 25153 47 1 1 . 1 1 10 10 SER C C 10 175.730 175.730 175.446 0.284 25153 48 1 1 . 1 1 10 10 SER CA C 10 61.750 61.750 60.567 1.183 25153 49 1 1 . 1 1 10 10 SER CB C 10 64.400 64.400 63.499 0.901 25153 50 1 1 . 1 1 10 10 SER H H 10 11.636 11.636 9.123 2.513 25153 51 1 1 . 1 1 11 11 THR N N 11 115.848 115.848 115.118 0.730 25153 52 1 1 . 1 1 11 11 THR HA H 11 4.770 4.770 4.333 0.437 25153 53 1 1 . 1 1 11 11 THR C C 11 173.700 173.700 174.498 -0.798 25153 54 1 1 . 1 1 11 11 THR CA C 11 60.700 60.700 62.304 -1.604 25153 55 1 1 . 1 1 11 11 THR CB C 11 67.430 67.430 69.636 -2.206 25153 56 1 1 . 1 1 11 11 THR H H 11 9.550 9.550 8.449 1.101 25153 57 1 1 . 1 1 12 12 CYS N N 12 109.780 109.780 117.770 -7.990 25153 58 1 1 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.663 -0.593 25153 59 1 1 . 1 1 12 12 CYS C C 12 176.220 176.220 175.447 0.773 25153 60 1 1 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.939 4.661 25153 61 1 1 . 1 1 12 12 CYS CB C 12 26.400 26.400 29.378 -2.978 25153 62 1 1 . 1 1 12 12 CYS H H 12 7.437 7.437 7.864 -0.427 25153 63 1 1 . 1 1 13 13 TYR N N 13 127.830 127.830 121.643 6.187 25153 64 1 1 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.248 -0.145 25153 65 1 1 . 1 1 13 13 TYR C C 13 180.880 180.880 178.117 2.763 25153 66 1 1 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.780 3.320 25153 67 1 1 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.929 -1.094 25153 68 1 1 . 1 1 13 13 TYR H H 13 10.886 10.886 7.355 3.531 25153 69 1 1 . 1 1 14 14 THR N N 14 124.428 124.428 113.446 10.982 25153 70 1 1 . 1 1 14 14 THR HA H 14 4.160 4.160 4.168 -0.008 25153 71 1 1 . 1 1 14 14 THR C C 14 177.760 177.760 176.429 1.331 25153 72 1 1 . 1 1 14 14 THR CA C 14 67.823 67.823 66.325 1.498 25153 73 1 1 . 1 1 14 14 THR CB C 14 68.040 68.040 68.120 -0.080 25153 74 1 1 . 1 1 14 14 THR H H 14 11.405 11.405 8.708 2.697 25153 75 1 1 . 1 1 15 15 GLU N N 15 123.050 123.050 123.293 -0.243 25153 76 1 1 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.168 -0.278 25153 77 1 1 . 1 1 15 15 GLU C C 15 176.392 176.392 178.287 -1.895 25153 78 1 1 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.709 -0.509 25153 79 1 1 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.294 1.156 25153 80 1 1 . 1 1 16 16 MET N N 16 120.173 120.173 118.295 1.878 25153 81 1 1 . 1 1 16 16 MET HA H 16 4.050 4.050 4.115 -0.065 25153 82 1 1 . 1 1 16 16 MET C C 16 179.940 179.940 178.687 1.253 25153 83 1 1 . 1 1 16 16 MET CA C 16 59.240 59.240 59.324 -0.084 25153 84 1 1 . 1 1 16 16 MET CB C 16 32.970 32.970 32.797 0.173 25153 85 1 1 . 1 1 16 16 MET H H 16 8.469 8.469 8.413 0.056 25153 86 1 1 . 1 1 17 17 ALA N N 17 121.930 121.930 121.734 0.196 25153 87 1 1 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.852 -0.016 25153 88 1 1 . 1 1 17 17 ALA C C 17 177.900 177.900 178.751 -0.851 25153 89 1 1 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.135 0.065 25153 90 1 1 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.102 -0.103 25153 91 1 1 . 1 1 17 17 ALA H H 17 7.880 7.880 7.925 -0.045 25153 92 1 1 . 1 1 18 18 ALA N N 18 121.477 121.477 121.511 -0.034 25153 93 1 1 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.842 -0.105 25153 94 1 1 . 1 1 18 18 ALA C C 18 179.380 179.380 179.589 -0.209 25153 95 1 1 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.181 -0.181 25153 96 1 1 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.801 1.029 25153 97 1 1 . 1 1 18 18 ALA H H 18 7.374 7.374 8.125 -0.751 25153 98 1 1 . 1 1 19 19 GLU N N 19 116.650 116.650 118.040 -1.390 25153 99 1 1 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.846 -0.230 25153 100 1 1 . 1 1 19 19 GLU C C 19 178.479 178.479 179.308 -0.829 25153 101 1 1 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.556 0.174 25153 102 1 1 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.399 -0.099 25153 103 1 1 . 1 1 20 20 LYS N N 20 119.470 119.470 119.883 -0.413 25153 104 1 1 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.017 0.033 25153 105 1 1 . 1 1 20 20 LYS C C 20 179.116 179.116 179.063 0.053 25153 106 1 1 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.457 0.373 25153 107 1 1 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.430 0.420 25153 108 1 1 . 1 1 21 21 ILE N N 21 121.030 121.030 120.749 0.281 25153 109 1 1 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.683 -0.293 25153 110 1 1 . 1 1 21 21 ILE C C 21 177.580 177.580 178.200 -0.620 25153 111 1 1 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.758 0.062 25153 112 1 1 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.916 0.432 25153 113 1 1 . 1 1 21 21 ILE H H 21 8.100 8.100 8.596 -0.496 25153 114 1 1 . 1 1 22 22 ARG N N 22 119.720 119.720 119.486 0.234 25153 115 1 1 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.850 -0.295 25153 116 1 1 . 1 1 22 22 ARG C C 22 177.320 177.320 178.116 -0.796 25153 117 1 1 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.716 0.004 25153 118 1 1 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.730 -0.798 25153 119 1 1 . 1 1 23 23 ASP N N 23 118.730 118.730 119.338 -0.608 25153 120 1 1 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.412 -0.049 25153 121 1 1 . 1 1 23 23 ASP C C 23 178.330 178.330 178.780 -0.450 25153 122 1 1 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.377 -0.427 25153 123 1 1 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.866 -0.626 25153 124 1 1 . 1 1 24 24 ILE N N 24 121.090 121.090 119.443 1.647 25153 125 1 1 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.789 0.007 25153 126 1 1 . 1 1 24 24 ILE C C 24 178.250 178.250 177.917 0.333 25153 127 1 1 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.800 -0.650 25153 128 1 1 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.292 0.188 25153 129 1 1 . 1 1 24 24 ILE H H 24 7.910 7.910 8.190 -0.280 25153 130 1 1 . 1 1 25 25 ILE N N 25 121.406 121.406 116.989 4.417 25153 131 1 1 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.872 -0.226 25153 132 1 1 . 1 1 25 25 ILE C C 25 176.800 176.800 176.833 -0.033 25153 133 1 1 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.121 2.579 25153 134 1 1 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.901 -0.711 25153 135 1 1 . 1 1 25 25 ILE H H 25 8.476 8.476 8.033 0.443 25153 136 1 1 . 1 1 26 26 GLY N N 26 108.900 108.900 105.109 3.791 25153 137 1 1 . 1 1 26 26 GLY C C 26 173.710 173.710 172.271 1.439 25153 138 1 1 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.644 -0.314 25153 139 1 1 . 1 1 26 26 GLY H H 26 8.016 8.016 7.780 0.236 25153 140 1 1 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.679 -0.341 25153 141 1 1 . 1 1 27 27 PRO C C 27 177.200 177.200 177.403 -0.203 25153 142 1 1 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.535 1.151 25153 143 1 1 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.096 0.104 25153 144 1 1 . 1 1 28 28 GLU N N 28 116.295 116.295 118.276 -1.981 25153 145 1 1 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.181 0.089 25153 146 1 1 . 1 1 28 28 GLU C C 28 176.980 176.980 177.337 -0.357 25153 147 1 1 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.613 -0.873 25153 148 1 1 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.452 -0.782 25153 149 1 1 . 1 1 29 29 LEU N N 29 120.250 120.250 111.776 8.474 25153 150 1 1 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.672 -0.036 25153 151 1 1 . 1 1 29 29 LEU C C 29 175.770 175.770 175.590 0.180 25153 152 1 1 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.272 0.528 25153 153 1 1 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.938 1.162 25153 154 1 1 . 1 1 29 29 LEU H H 29 7.940 7.940 7.575 0.365 25153 155 1 1 . 1 1 30 30 VAL N N 30 118.693 118.693 121.780 -3.087 25153 156 1 1 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.930 -0.282 25153 157 1 1 . 1 1 30 30 VAL C C 30 174.347 174.347 175.941 -1.594 25153 158 1 1 . 1 1 30 30 VAL CA C 30 60.868 60.868 62.453 -1.585 25153 159 1 1 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.993 1.587 25153 160 1 1 . 1 1 30 30 VAL H H 30 7.434 7.434 7.996 -0.562 25153 161 1 1 . 1 1 31 31 THR N N 31 123.800 123.800 121.736 2.064 25153 162 1 1 . 1 1 31 31 THR HA H 31 4.362 4.362 4.559 -0.197 25153 163 1 1 . 1 1 31 31 THR C C 31 172.964 172.964 173.325 -0.361 25153 164 1 1 . 1 1 31 31 THR CA C 31 61.720 61.720 60.991 0.729 25153 165 1 1 . 1 1 31 31 THR CB C 31 70.485 70.485 70.984 -0.499 25153 166 1 1 . 1 1 31 31 THR H H 31 7.844 7.844 8.374 -0.530 25153 167 1 1 . 1 1 32 32 LEU N N 32 127.800 127.800 127.017 0.783 25153 168 1 1 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.595 0.089 25153 169 1 1 . 1 1 32 32 LEU C C 32 176.600 176.600 176.380 0.220 25153 170 1 1 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.164 -0.009 25153 171 1 1 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.595 1.255 25153 172 1 1 . 1 1 32 32 LEU H H 32 8.660 8.660 8.569 0.091 25153 173 1 1 . 1 1 33 33 HIS N N 33 119.670 119.670 120.525 -0.855 25153 174 1 1 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.814 -0.414 25153 175 1 1 . 1 1 33 33 HIS C C 33 171.667 171.667 173.177 -1.510 25153 176 1 1 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.086 0.114 25153 177 1 1 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.722 0.478 25153 178 1 1 . 1 1 33 33 HIS H H 33 9.060 9.060 8.771 0.289 25153 179 1 1 . 1 1 34 34 ASN N N 34 124.068 124.068 123.704 0.364 25153 180 1 1 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.117 -0.683 25153 181 1 1 . 1 1 34 34 ASN C C 34 178.000 178.000 176.044 1.956 25153 182 1 1 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.458 -0.029 25153 183 1 1 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.295 -0.735 25153 184 1 1 . 1 1 34 34 ASN H H 34 8.780 8.780 9.237 -0.457 25153 185 1 1 . 1 1 35 35 LEU N N 35 129.040 129.040 125.198 3.842 25153 186 1 1 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.145 0.170 25153 187 1 1 . 1 1 35 35 LEU C C 35 177.700 177.700 177.420 0.280 25153 188 1 1 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.986 -0.506 25153 189 1 1 . 1 1 35 35 LEU CB C 35 42.300 42.300 41.357 0.943 25153 190 1 1 . 1 1 35 35 LEU H H 35 8.821 8.821 8.234 0.587 25153 191 1 1 . 1 1 36 36 LYS N N 36 121.043 121.043 113.880 7.163 25153 192 1 1 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.034 -0.154 25153 193 1 1 . 1 1 36 36 LYS C C 36 176.230 176.230 176.789 -0.559 25153 194 1 1 . 1 1 36 36 LYS CA C 36 59.420 59.420 57.569 1.851 25153 195 1 1 . 1 1 36 36 LYS CB C 36 33.270 33.270 31.880 1.390 25153 196 1 1 . 1 1 37 37 ASP N N 37 114.965 114.965 118.010 -3.045 25153 197 1 1 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.762 0.015 25153 198 1 1 . 1 1 37 37 ASP C C 37 175.440 175.440 175.861 -0.421 25153 199 1 1 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.619 0.092 25153 200 1 1 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.177 1.523 25153 201 1 1 . 1 1 38 38 ASP N N 38 121.650 121.650 121.537 0.113 25153 202 1 1 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.841 0.029 25153 203 1 1 . 1 1 38 38 ASP C C 38 174.852 174.852 176.103 -1.251 25153 204 1 1 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.684 -1.603 25153 205 1 1 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.297 -0.187 25153 206 1 1 . 1 1 39 39 SER N N 39 115.207 115.207 117.457 -2.250 25153 207 1 1 . 1 1 39 39 SER HA H 39 4.585 4.585 4.698 -0.113 25153 208 1 1 . 1 1 39 39 SER C C 39 175.040 175.040 174.371 0.669 25153 209 1 1 . 1 1 39 39 SER CA C 39 54.960 54.960 56.439 -1.479 25153 210 1 1 . 1 1 39 39 SER CB C 39 64.720 64.720 63.672 1.048 25153 211 1 1 . 1 1 39 39 SER H H 39 8.351 8.351 8.550 -0.199 25153 212 1 1 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.330 -0.325 25153 213 1 1 . 1 1 40 40 PRO C C 40 176.730 176.730 178.101 -1.371 25153 214 1 1 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.817 0.083 25153 215 1 1 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.830 -0.430 25153 216 1 1 . 1 1 41 41 LYS N N 41 121.150 121.150 119.751 1.399 25153 217 1 1 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.020 -0.108 25153 218 1 1 . 1 1 41 41 LYS C C 41 179.600 179.600 178.483 1.117 25153 219 1 1 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.357 -1.157 25153 220 1 1 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.719 0.281 25153 221 1 1 . 1 1 42 42 LEU N N 42 118.103 118.103 116.396 1.707 25153 222 1 1 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.171 -0.134 25153 223 1 1 . 1 1 42 42 LEU C C 42 178.760 178.760 178.756 0.004 25153 224 1 1 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.395 -0.215 25153 225 1 1 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.521 1.452 25153 226 1 1 . 1 1 42 42 LEU H H 42 7.600 7.600 7.542 0.058 25153 227 1 1 . 1 1 43 43 MET N N 43 118.917 118.917 116.671 2.246 25153 228 1 1 . 1 1 43 43 MET HA H 43 3.750 3.750 4.378 -0.628 25153 229 1 1 . 1 1 43 43 MET C C 43 177.680 177.680 176.744 0.936 25153 230 1 1 . 1 1 43 43 MET CA C 43 59.730 59.730 57.965 1.765 25153 231 1 1 . 1 1 43 43 MET CB C 43 32.700 32.700 31.801 0.899 25153 232 1 1 . 1 1 43 43 MET H H 43 8.202 8.202 8.076 0.126 25153 233 1 1 . 1 1 44 44 GLU N N 44 110.924 110.924 117.455 -6.531 25153 234 1 1 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.273 -0.533 25153 235 1 1 . 1 1 44 44 GLU C C 44 178.130 178.130 179.030 -0.900 25153 236 1 1 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.090 1.310 25153 237 1 1 . 1 1 44 44 GLU CB C 44 29.550 29.550 30.029 -0.479 25153 238 1 1 . 1 1 45 45 GLN N N 45 115.756 115.756 118.681 -2.925 25153 239 1 1 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.036 0.147 25153 240 1 1 . 1 1 45 45 GLN C C 45 175.414 175.414 177.203 -1.789 25153 241 1 1 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.569 -1.389 25153 242 1 1 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.108 -0.508 25153 243 1 1 . 1 1 45 45 GLN H H 45 7.516 7.516 7.500 0.016 25153 244 1 1 . 1 1 46 46 TYR N N 46 117.860 117.860 118.995 -1.135 25153 245 1 1 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.331 0.332 25153 246 1 1 . 1 1 46 46 TYR C C 46 175.500 175.500 177.159 -1.659 25153 247 1 1 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.665 -1.179 25153 248 1 1 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.160 3.311 25153 249 1 1 . 1 1 46 46 TYR H H 46 6.996 6.996 7.191 -0.195 25153 250 1 1 . 1 1 47 47 ASP N N 47 121.683 121.683 121.863 -0.180 25153 251 1 1 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.564 0.136 25153 252 1 1 . 1 1 47 47 ASP C C 47 175.610 175.610 175.180 0.430 25153 253 1 1 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.609 -0.909 25153 254 1 1 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.942 1.058 25153 255 1 1 . 1 1 48 48 VAL N N 48 118.628 118.628 115.877 2.751 25153 256 1 1 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.673 0.361 25153 257 1 1 . 1 1 48 48 VAL C C 48 174.190 174.190 173.937 0.253 25153 258 1 1 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.304 -1.114 25153 259 1 1 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.884 0.216 25153 260 1 1 . 1 1 48 48 VAL H H 48 7.628 7.628 7.305 0.323 25153 261 1 1 . 1 1 49 49 LEU N N 49 128.190 128.190 123.600 4.590 25153 262 1 1 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.415 0.188 25153 263 1 1 . 1 1 49 49 LEU C C 49 174.880 174.880 175.534 -0.654 25153 264 1 1 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.515 -1.275 25153 265 1 1 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.070 -0.730 25153 266 1 1 . 1 1 49 49 LEU H H 49 9.407 9.407 9.055 0.352 25153 267 1 1 . 1 1 50 50 ILE N N 50 124.550 124.550 120.814 3.736 25153 268 1 1 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.082 0.618 25153 269 1 1 . 1 1 50 50 ILE C C 50 175.300 175.300 174.602 0.698 25153 270 1 1 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.861 -0.997 25153 271 1 1 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.002 -0.752 25153 272 1 1 . 1 1 50 50 ILE H H 50 9.238 9.238 9.226 0.012 25153 273 1 1 . 1 1 51 51 LEU N N 51 127.460 127.460 128.363 -0.903 25153 274 1 1 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.858 0.327 25153 275 1 1 . 1 1 51 51 LEU C C 51 174.544 174.544 175.889 -1.345 25153 276 1 1 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.573 -0.753 25153 277 1 1 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.113 -2.476 25153 278 1 1 . 1 1 51 51 LEU H H 51 9.228 9.228 9.200 0.028 25153 279 1 1 . 1 1 52 52 GLY N N 52 107.760 107.760 111.290 -3.530 25153 280 1 1 . 1 1 52 52 GLY C C 52 174.710 174.710 172.377 2.333 25153 281 1 1 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.768 0.102 25153 282 1 1 . 1 1 52 52 GLY H H 52 8.860 8.860 9.043 -0.183 25153 283 1 1 . 1 1 53 53 ILE N N 53 123.890 123.890 120.375 3.515 25153 284 1 1 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.814 0.456 25153 285 1 1 . 1 1 53 53 ILE C C 53 172.630 172.630 173.071 -0.441 25153 286 1 1 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.454 0.226 25153 287 1 1 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.906 4.254 25153 288 1 1 . 1 1 53 53 ILE H H 53 8.458 8.458 8.108 0.350 25153 289 1 1 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.839 0.549 25153 290 1 1 . 1 1 54 54 PRO C C 54 175.000 175.000 176.239 -1.239 25153 291 1 1 . 1 1 54 54 PRO CA C 54 61.600 61.600 62.280 -0.680 25153 292 1 1 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.657 -0.357 25153 293 1 1 . 1 1 55 55 THR N N 55 112.754 112.754 119.533 -6.779 25153 294 1 1 . 1 1 55 55 THR HA H 55 4.452 4.452 4.759 -0.307 25153 295 1 1 . 1 1 55 55 THR C C 55 172.480 172.480 174.093 -1.613 25153 296 1 1 . 1 1 55 55 THR CA C 55 62.350 62.350 62.874 -0.524 25153 297 1 1 . 1 1 55 55 THR CB C 55 70.230 70.230 69.675 0.555 25153 298 1 1 . 1 1 55 55 THR H H 55 6.523 6.523 8.169 -1.646 25153 299 1 1 . 1 1 56 56 TRP N N 56 130.044 130.044 127.412 2.632 25153 300 1 1 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.611 -1.896 25153 301 1 1 . 1 1 56 56 TRP C C 56 172.890 172.890 175.707 -2.817 25153 302 1 1 . 1 1 56 56 TRP CA C 56 56.650 56.650 57.517 -0.867 25153 303 1 1 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.787 2.213 25153 304 1 1 . 1 1 56 56 TRP H H 56 8.450 8.450 8.671 -0.221 25153 305 1 1 . 1 1 57 57 ASP N N 57 115.275 115.275 120.453 -5.178 25153 306 1 1 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.178 0.174 25153 307 1 1 . 1 1 57 57 ASP C C 57 173.660 173.660 175.091 -1.431 25153 308 1 1 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.047 1.183 25153 309 1 1 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.777 0.393 25153 310 1 1 . 1 1 58 58 PHE N N 58 112.840 112.840 116.144 -3.304 25153 311 1 1 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.861 -0.537 25153 312 1 1 . 1 1 58 58 PHE C C 58 175.730 175.730 175.285 0.445 25153 313 1 1 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.684 0.139 25153 314 1 1 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.074 -2.320 25153 315 1 1 . 1 1 58 58 PHE H H 58 7.640 7.640 7.784 -0.144 25153 316 1 1 . 1 1 59 59 GLY N N 59 104.940 104.940 105.965 -1.025 25153 317 1 1 . 1 1 59 59 GLY C C 59 173.750 173.750 174.850 -1.100 25153 318 1 1 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.491 0.799 25153 319 1 1 . 1 1 59 59 GLY H H 59 8.024 8.024 8.733 -0.709 25153 320 1 1 . 1 1 60 60 GLU N N 60 120.045 120.045 119.111 0.934 25153 321 1 1 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.554 -0.141 25153 322 1 1 . 1 1 60 60 GLU C C 60 176.050 176.050 176.151 -0.101 25153 323 1 1 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.248 -0.628 25153 324 1 1 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.096 -0.486 25153 325 1 1 . 1 1 61 61 ILE N N 61 120.790 120.790 121.384 -0.594 25153 326 1 1 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.059 -0.592 25153 327 1 1 . 1 1 61 61 ILE C C 61 175.130 175.130 176.164 -1.034 25153 328 1 1 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.557 -0.010 25153 329 1 1 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.786 0.064 25153 330 1 1 . 1 1 61 61 ILE H H 61 8.200 8.200 8.492 -0.292 25153 331 1 1 . 1 1 62 62 GLN N N 62 124.520 124.520 123.049 1.471 25153 332 1 1 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.135 -0.179 25153 333 1 1 . 1 1 62 62 GLN C C 62 177.160 177.160 177.111 0.049 25153 334 1 1 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.888 0.722 25153 335 1 1 . 1 1 62 62 GLN CB C 62 27.650 27.650 29.930 -2.280 25153 336 1 1 . 1 1 62 62 GLN H H 62 5.667 5.667 8.266 -2.599 25153 337 1 1 . 1 1 63 63 GLU N N 63 124.570 124.570 126.069 -1.499 25153 338 1 1 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.274 -0.288 25153 339 1 1 . 1 1 63 63 GLU C C 63 177.300 177.300 177.393 -0.093 25153 340 1 1 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.606 2.114 25153 341 1 1 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.304 0.816 25153 342 1 1 . 1 1 64 64 ASP N N 64 119.060 119.060 120.099 -1.039 25153 343 1 1 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.593 0.026 25153 344 1 1 . 1 1 64 64 ASP C C 64 179.180 179.180 177.825 1.355 25153 345 1 1 . 1 1 64 64 ASP CA C 64 57.950 57.950 55.989 1.961 25153 346 1 1 . 1 1 64 64 ASP CB C 64 40.950 40.950 41.210 -0.260 25153 347 1 1 . 1 1 65 65 TRP N N 65 121.070 121.070 121.854 -0.784 25153 348 1 1 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.425 -0.085 25153 349 1 1 . 1 1 65 65 TRP C C 65 178.970 178.970 178.329 0.641 25153 350 1 1 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.941 -0.121 25153 351 1 1 . 1 1 65 65 TRP CB C 65 30.400 30.400 29.941 0.459 25153 352 1 1 . 1 1 65 65 TRP H H 65 7.350 7.350 8.091 -0.741 25153 353 1 1 . 1 1 66 66 GLU N N 66 120.900 120.900 117.706 3.194 25153 354 1 1 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.878 -0.038 25153 355 1 1 . 1 1 66 66 GLU C C 66 178.750 178.750 178.924 -0.174 25153 356 1 1 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.304 0.695 25153 357 1 1 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.156 -0.296 25153 358 1 1 . 1 1 67 67 ALA N N 67 119.130 119.130 119.685 -0.555 25153 359 1 1 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.269 -0.016 25153 360 1 1 . 1 1 67 67 ALA C C 67 179.410 179.410 179.125 0.285 25153 361 1 1 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.631 -0.051 25153 362 1 1 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.848 -0.038 25153 363 1 1 . 1 1 67 67 ALA H H 67 7.640 7.640 7.691 -0.051 25153 364 1 1 . 1 1 68 68 VAL N N 68 106.845 106.845 112.487 -5.642 25153 365 1 1 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.432 0.378 25153 366 1 1 . 1 1 68 68 VAL C C 68 176.750 176.750 176.977 -0.227 25153 367 1 1 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.808 -3.198 25153 368 1 1 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.238 0.382 25153 369 1 1 . 1 1 68 68 VAL H H 68 7.219 7.219 7.492 -0.273 25153 370 1 1 . 1 1 69 69 TRP N N 69 127.630 127.630 123.846 3.784 25153 371 1 1 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.257 -0.019 25153 372 1 1 . 1 1 69 69 TRP C C 69 178.670 178.670 177.028 1.642 25153 373 1 1 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.617 -1.397 25153 374 1 1 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.827 1.803 25153 375 1 1 . 1 1 69 69 TRP H H 69 7.832 7.832 8.334 -0.502 25153 376 1 1 . 1 1 70 70 ASP N N 70 114.544 114.544 118.428 -3.884 25153 377 1 1 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.454 0.068 25153 378 1 1 . 1 1 70 70 ASP C C 70 178.670 178.670 178.986 -0.316 25153 379 1 1 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.300 -1.300 25153 380 1 1 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.954 -1.104 25153 381 1 1 . 1 1 71 71 GLN N N 71 120.040 120.040 119.515 0.525 25153 382 1 1 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.117 0.067 25153 383 1 1 . 1 1 71 71 GLN C C 71 178.910 178.910 178.845 0.065 25153 384 1 1 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.420 -0.810 25153 385 1 1 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.857 0.243 25153 386 1 1 . 1 1 71 71 GLN H H 71 7.995 7.995 7.707 0.288 25153 387 1 1 . 1 1 72 72 LEU N N 72 117.400 117.400 118.055 -0.655 25153 388 1 1 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.976 -0.163 25153 389 1 1 . 1 1 72 72 LEU C C 72 178.650 178.650 178.124 0.526 25153 390 1 1 . 1 1 72 72 LEU CA C 72 57.200 57.200 56.998 0.202 25153 391 1 1 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.367 0.043 25153 392 1 1 . 1 1 72 72 LEU H H 72 7.450 7.450 7.782 -0.332 25153 393 1 1 . 1 1 73 73 ASP N N 73 115.750 115.750 117.466 -1.716 25153 394 1 1 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.397 -0.229 25153 395 1 1 . 1 1 73 73 ASP C C 73 177.560 177.560 177.134 0.426 25153 396 1 1 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.575 0.825 25153 397 1 1 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.660 -1.560 25153 398 1 1 . 1 1 74 74 ASP N N 74 117.223 117.223 119.255 -2.032 25153 399 1 1 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.596 0.107 25153 400 1 1 . 1 1 74 74 ASP C C 74 176.388 176.388 177.066 -0.678 25153 401 1 1 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.879 -0.379 25153 402 1 1 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.596 0.104 25153 403 1 1 . 1 1 75 75 LEU N N 75 118.316 118.316 118.949 -0.633 25153 404 1 1 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.366 -0.081 25153 405 1 1 . 1 1 75 75 LEU C C 75 176.820 176.820 175.908 0.912 25153 406 1 1 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.492 -0.092 25153 407 1 1 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.440 0.840 25153 408 1 1 . 1 1 75 75 LEU H H 75 6.960 6.960 7.416 -0.456 25153 409 1 1 . 1 1 76 76 ASN N N 76 123.045 123.045 118.038 5.007 25153 410 1 1 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.078 -0.188 25153 411 1 1 . 1 1 76 76 ASN C C 76 174.950 174.950 174.861 0.089 25153 412 1 1 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.515 -0.465 25153 413 1 1 . 1 1 76 76 ASN CB C 76 37.500 37.500 39.017 -1.517 25153 414 1 1 . 1 1 76 76 ASN H H 76 9.890 9.890 8.757 1.133 25153 415 1 1 . 1 1 77 77 LEU N N 77 123.494 123.494 123.160 0.334 25153 416 1 1 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.530 -0.160 25153 417 1 1 . 1 1 77 77 LEU C C 77 175.040 175.040 176.165 -1.125 25153 418 1 1 . 1 1 77 77 LEU CA C 77 52.250 52.250 54.081 -1.831 25153 419 1 1 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.711 0.189 25153 420 1 1 . 1 1 77 77 LEU H H 77 8.730 8.730 8.184 0.546 25153 421 1 1 . 1 1 78 78 GLU N N 78 120.870 120.870 121.798 -0.928 25153 422 1 1 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.530 -0.630 25153 423 1 1 . 1 1 78 78 GLU C C 78 178.660 178.660 177.922 0.738 25153 424 1 1 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.207 1.553 25153 425 1 1 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.381 1.019 25153 426 1 1 . 1 1 79 79 GLY N N 79 113.240 113.240 113.982 -0.742 25153 427 1 1 . 1 1 79 79 GLY C C 79 174.460 174.460 174.455 0.005 25153 428 1 1 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.134 0.296 25153 429 1 1 . 1 1 79 79 GLY H H 79 8.474 8.474 8.715 -0.241 25153 430 1 1 . 1 1 80 80 LYS N N 80 120.295 120.295 119.759 0.536 25153 431 1 1 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.407 -0.049 25153 432 1 1 . 1 1 80 80 LYS C C 80 175.360 175.360 176.125 -0.765 25153 433 1 1 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.194 0.776 25153 434 1 1 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.750 -0.550 25153 435 1 1 . 1 1 81 81 ILE N N 81 122.400 122.400 122.286 0.114 25153 436 1 1 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.638 0.155 25153 437 1 1 . 1 1 81 81 ILE C C 81 174.760 174.760 175.458 -0.698 25153 438 1 1 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.490 -1.660 25153 439 1 1 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.813 -0.113 25153 440 1 1 . 1 1 81 81 ILE H H 81 7.400 7.400 7.848 -0.448 25153 441 1 1 . 1 1 82 82 VAL N N 82 127.840 127.840 125.708 2.132 25153 442 1 1 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.053 0.209 25153 443 1 1 . 1 1 82 82 VAL C C 82 172.724 172.724 174.330 -1.606 25153 444 1 1 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.205 0.206 25153 445 1 1 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.159 0.241 25153 446 1 1 . 1 1 82 82 VAL H H 82 8.790 8.790 8.811 -0.021 25153 447 1 1 . 1 1 83 83 ALA N N 83 131.347 131.347 130.248 1.099 25153 448 1 1 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.298 0.084 25153 449 1 1 . 1 1 83 83 ALA C C 83 175.750 175.750 176.371 -0.621 25153 450 1 1 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.124 -0.254 25153 451 1 1 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.153 2.297 25153 452 1 1 . 1 1 83 83 ALA H H 83 9.300 9.300 8.896 0.404 25153 453 1 1 . 1 1 84 84 LEU N N 84 124.200 124.200 126.461 -2.261 25153 454 1 1 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.690 -0.170 25153 455 1 1 . 1 1 84 84 LEU C C 84 175.760 175.760 176.864 -1.104 25153 456 1 1 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.783 -0.283 25153 457 1 1 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.517 1.383 25153 458 1 1 . 1 1 84 84 LEU H H 84 10.287 10.287 9.033 1.254 25153 459 1 1 . 1 1 85 85 TYR N N 85 115.912 115.912 118.997 -3.085 25153 460 1 1 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.377 -0.417 25153 461 1 1 . 1 1 85 85 TYR C C 85 172.372 172.372 173.859 -1.487 25153 462 1 1 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.073 1.027 25153 463 1 1 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.551 1.479 25153 464 1 1 . 1 1 85 85 TYR H H 85 9.257 9.257 8.888 0.369 25153 465 1 1 . 1 1 86 86 GLY N N 86 107.800 107.800 106.305 1.495 25153 466 1 1 . 1 1 86 86 GLY C C 86 170.330 170.330 171.566 -1.236 25153 467 1 1 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.564 -0.194 25153 468 1 1 . 1 1 86 86 GLY H H 86 9.027 9.027 8.805 0.222 25153 469 1 1 . 1 1 87 87 LEU N N 87 123.458 123.458 119.113 4.345 25153 470 1 1 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.483 -0.018 25153 471 1 1 . 1 1 87 87 LEU C C 87 178.100 178.100 176.314 1.786 25153 472 1 1 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.857 0.733 25153 473 1 1 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.442 -0.102 25153 474 1 1 . 1 1 87 87 LEU H H 87 6.580 6.580 7.959 -1.379 25153 475 1 1 . 1 1 88 88 GLY N N 88 108.966 108.966 107.348 1.618 25153 476 1 1 . 1 1 88 88 GLY C C 88 172.820 172.820 171.339 1.481 25153 477 1 1 . 1 1 88 88 GLY CA C 88 46.660 46.660 46.251 0.409 25153 478 1 1 . 1 1 88 88 GLY H H 88 8.070 8.070 8.265 -0.195 25153 479 1 1 . 1 1 89 89 ASP N N 89 121.150 121.150 117.916 3.234 25153 480 1 1 . 1 1 89 89 ASP HA H 89 5.246 5.246 4.654 0.592 25153 481 1 1 . 1 1 89 89 ASP C C 89 176.220 176.220 174.501 1.719 25153 482 1 1 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.470 0.000 25153 483 1 1 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.335 -0.855 25153 484 1 1 . 1 1 90 90 GLN N N 90 123.970 123.970 121.245 2.725 25153 485 1 1 . 1 1 90 90 GLN HA H 90 3.488 3.488 3.795 -0.307 25153 486 1 1 . 1 1 90 90 GLN C C 90 173.646 173.646 176.060 -2.414 25153 487 1 1 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.491 0.819 25153 488 1 1 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.700 -0.490 25153 489 1 1 . 1 1 90 90 GLN H H 90 8.623 8.623 8.212 0.411 25153 490 1 1 . 1 1 91 91 LEU N N 91 118.017 118.017 118.714 -0.697 25153 491 1 1 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.122 0.253 25153 492 1 1 . 1 1 91 91 LEU C C 91 180.160 180.160 178.714 1.446 25153 493 1 1 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.140 -0.080 25153 494 1 1 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.044 -0.494 25153 495 1 1 . 1 1 91 91 LEU H H 91 7.046 7.046 8.428 -1.382 25153 496 1 1 . 1 1 92 92 GLY N N 92 110.028 110.028 104.930 5.098 25153 497 1 1 . 1 1 92 92 GLY C C 92 174.912 174.912 173.955 0.957 25153 498 1 1 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.907 0.273 25153 499 1 1 . 1 1 92 92 GLY H H 92 9.238 9.238 8.659 0.579 25153 500 1 1 . 1 1 93 93 TYR N N 93 115.910 115.910 119.219 -3.309 25153 501 1 1 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.160 -0.151 25153 502 1 1 . 1 1 93 93 TYR C C 93 176.850 176.850 178.016 -1.166 25153 503 1 1 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.334 -1.603 25153 504 1 1 . 1 1 93 93 TYR CB C 93 38.130 38.130 39.962 -1.832 25153 505 1 1 . 1 1 93 93 TYR H H 93 6.962 6.962 7.489 -0.527 25153 506 1 1 . 1 1 94 94 GLY N N 94 111.630 111.630 107.174 4.456 25153 507 1 1 . 1 1 94 94 GLY C C 94 177.777 177.777 175.514 2.263 25153 508 1 1 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.043 2.987 25153 509 1 1 . 1 1 94 94 GLY H H 94 7.835 7.835 8.351 -0.516 25153 510 1 1 . 1 1 95 95 GLU N N 95 122.450 122.450 120.958 1.492 25153 511 1 1 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.957 -0.039 25153 512 1 1 . 1 1 95 95 GLU C C 95 175.300 175.300 176.515 -1.215 25153 513 1 1 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.553 -0.453 25153 514 1 1 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.107 -1.596 25153 515 1 1 . 1 1 96 96 TRP N N 96 118.790 118.790 114.000 4.790 25153 516 1 1 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.979 0.465 25153 517 1 1 . 1 1 96 96 TRP C C 96 179.280 179.280 175.893 3.387 25153 518 1 1 . 1 1 96 96 TRP CA C 96 57.015 57.015 56.090 0.925 25153 519 1 1 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.055 -0.035 25153 520 1 1 . 1 1 96 96 TRP H H 96 8.070 8.070 8.230 -0.160 25153 521 1 1 . 1 1 97 97 PHE N N 97 128.067 128.067 123.395 4.672 25153 522 1 1 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.255 1.050 25153 523 1 1 . 1 1 97 97 PHE C C 97 173.227 173.227 175.871 -2.644 25153 524 1 1 . 1 1 97 97 PHE CA C 97 56.720 56.720 58.699 -1.979 25153 525 1 1 . 1 1 97 97 PHE CB C 97 39.940 39.940 38.908 1.032 25153 526 1 1 . 1 1 97 97 PHE H H 97 7.165 7.165 7.500 -0.335 25153 527 1 1 . 1 1 98 98 LEU N N 98 114.306 114.306 122.932 -8.626 25153 528 1 1 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.835 -0.345 25153 529 1 1 . 1 1 98 98 LEU C C 98 179.365 179.365 177.297 2.068 25153 530 1 1 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.247 0.213 25153 531 1 1 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.498 -0.268 25153 532 1 1 . 1 1 98 98 LEU H H 98 7.453 7.453 8.906 -1.453 25153 533 1 1 . 1 1 99 99 ASP N N 99 122.354 122.354 120.565 1.789 25153 534 1 1 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.293 -0.360 25153 535 1 1 . 1 1 99 99 ASP C C 99 178.800 178.800 177.187 1.613 25153 536 1 1 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.825 1.355 25153 537 1 1 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.451 -1.021 25153 538 1 1 . 1 1 100 100 ALA N N 100 118.568 118.568 122.008 -3.440 25153 539 1 1 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.074 -0.234 25153 540 1 1 . 1 1 100 100 ALA C C 100 178.500 178.500 179.281 -0.781 25153 541 1 1 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.152 -0.236 25153 542 1 1 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.340 1.320 25153 543 1 1 . 1 1 100 100 ALA H H 100 8.682 8.682 7.888 0.794 25153 544 1 1 . 1 1 101 101 LEU N N 101 118.815 118.815 120.421 -1.606 25153 545 1 1 . 1 1 101 101 LEU HA H 101 3.680 3.680 4.019 -0.339 25153 546 1 1 . 1 1 101 101 LEU C C 101 178.930 178.930 178.962 -0.032 25153 547 1 1 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.665 0.035 25153 548 1 1 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.565 0.836 25153 549 1 1 . 1 1 101 101 LEU H H 101 6.637 6.637 7.278 -0.641 25153 550 1 1 . 1 1 102 102 GLY N N 102 103.700 103.700 106.307 -2.607 25153 551 1 1 . 1 1 102 102 GLY C C 102 175.530 175.530 176.121 -0.591 25153 552 1 1 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.311 0.689 25153 553 1 1 . 1 1 102 102 GLY H H 102 7.330 7.330 7.918 -0.588 25153 554 1 1 . 1 1 103 103 MET N N 103 120.330 120.330 121.496 -1.166 25153 555 1 1 . 1 1 103 103 MET HA H 103 4.254 4.254 4.278 -0.024 25153 556 1 1 . 1 1 103 103 MET C C 103 179.688 179.688 178.665 1.023 25153 557 1 1 . 1 1 103 103 MET CA C 103 59.615 59.615 59.484 0.131 25153 558 1 1 . 1 1 103 103 MET CB C 103 33.290 33.290 32.626 0.664 25153 559 1 1 . 1 1 103 103 MET H H 103 8.407 8.407 7.743 0.664 25153 560 1 1 . 1 1 104 104 LEU N N 104 123.450 123.450 119.890 3.560 25153 561 1 1 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.704 0.492 25153 562 1 1 . 1 1 104 104 LEU C C 104 177.620 177.620 178.768 -1.148 25153 563 1 1 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.955 0.015 25153 564 1 1 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.257 0.043 25153 565 1 1 . 1 1 104 104 LEU H H 104 8.330 8.330 8.682 -0.352 25153 566 1 1 . 1 1 105 105 HIS N N 105 119.040 119.040 119.336 -0.296 25153 567 1 1 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.107 -0.230 25153 568 1 1 . 1 1 105 105 HIS C C 105 177.100 177.100 176.962 0.138 25153 569 1 1 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.824 0.146 25153 570 1 1 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.884 -1.291 25153 571 1 1 . 1 1 105 105 HIS H H 105 8.050 8.050 8.304 -0.254 25153 572 1 1 . 1 1 106 106 ASP N N 106 119.950 119.950 119.381 0.569 25153 573 1 1 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.527 -0.197 25153 574 1 1 . 1 1 106 106 ASP C C 106 179.300 179.300 178.365 0.935 25153 575 1 1 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.596 1.214 25153 576 1 1 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.230 -0.829 25153 577 1 1 . 1 1 107 107 LYS N N 107 122.060 122.060 120.486 1.574 25153 578 1 1 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.101 0.032 25153 579 1 1 . 1 1 107 107 LYS C C 107 178.100 178.100 179.261 -1.161 25153 580 1 1 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.609 -0.409 25153 581 1 1 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.208 0.152 25153 582 1 1 . 1 1 108 108 LEU N N 108 115.610 115.610 117.767 -2.157 25153 583 1 1 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.125 -0.057 25153 584 1 1 . 1 1 108 108 LEU C C 108 178.866 178.866 178.218 0.648 25153 585 1 1 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.702 -0.748 25153 586 1 1 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.583 0.577 25153 587 1 1 . 1 1 108 108 LEU H H 108 7.828 7.828 8.388 -0.560 25153 588 1 1 . 1 1 109 109 SER N N 109 116.362 116.362 115.187 1.175 25153 589 1 1 . 1 1 109 109 SER HA H 109 4.299 4.299 4.344 -0.045 25153 590 1 1 . 1 1 109 109 SER C C 109 175.660 175.660 176.785 -1.125 25153 591 1 1 . 1 1 109 109 SER CA C 109 62.350 62.350 61.097 1.253 25153 592 1 1 . 1 1 109 109 SER CB C 109 62.815 62.815 62.951 -0.136 25153 593 1 1 . 1 1 109 109 SER H H 109 8.278 8.278 8.620 -0.342 25153 594 1 1 . 1 1 110 110 THR N N 110 110.230 110.230 117.120 -6.890 25153 595 1 1 . 1 1 110 110 THR HA H 110 4.615 4.615 4.236 0.379 25153 596 1 1 . 1 1 110 110 THR C C 110 175.990 175.990 175.448 0.542 25153 597 1 1 . 1 1 110 110 THR CA C 110 62.090 62.090 64.736 -2.646 25153 598 1 1 . 1 1 110 110 THR CB C 110 68.800 68.800 69.064 -0.264 25153 599 1 1 . 1 1 110 110 THR H H 110 7.211 7.211 7.636 -0.425 25153 600 1 1 . 1 1 111 111 LYS N N 111 119.900 119.900 119.584 0.316 25153 601 1 1 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.508 0.004 25153 602 1 1 . 1 1 111 111 LYS C C 111 176.916 176.916 176.526 0.390 25153 603 1 1 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.330 0.324 25153 604 1 1 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.980 -1.137 25153 605 1 1 . 1 1 112 112 GLY N N 112 107.910 107.910 107.981 -0.071 25153 606 1 1 . 1 1 112 112 GLY C C 112 176.250 176.250 174.234 2.016 25153 607 1 1 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.759 1.281 25153 608 1 1 . 1 1 112 112 GLY H H 112 8.366 8.366 7.621 0.745 25153 609 1 1 . 1 1 113 113 VAL N N 113 113.530 113.530 116.235 -2.705 25153 610 1 1 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.483 -0.009 25153 611 1 1 . 1 1 113 113 VAL C C 113 174.630 174.630 174.788 -0.158 25153 612 1 1 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.849 -1.399 25153 613 1 1 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.037 -0.487 25153 614 1 1 . 1 1 113 113 VAL H H 113 6.903 6.903 6.962 -0.059 25153 615 1 1 . 1 1 114 114 LYS N N 114 123.020 123.020 119.305 3.715 25153 616 1 1 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.537 -0.032 25153 617 1 1 . 1 1 114 114 LYS C C 114 175.000 175.000 174.818 0.182 25153 618 1 1 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.389 -0.189 25153 619 1 1 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.640 -1.300 25153 620 1 1 . 1 1 115 115 PHE N N 115 123.290 123.290 120.425 2.865 25153 621 1 1 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.750 -0.037 25153 622 1 1 . 1 1 115 115 PHE C C 115 177.605 177.605 175.829 1.776 25153 623 1 1 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.737 1.873 25153 624 1 1 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.858 -0.858 25153 625 1 1 . 1 1 115 115 PHE H H 115 8.494 8.494 8.586 -0.092 25153 626 1 1 . 1 1 116 116 VAL N N 116 115.790 115.790 113.970 1.820 25153 627 1 1 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.450 0.042 25153 628 1 1 . 1 1 116 116 VAL C C 116 175.414 175.414 176.145 -0.731 25153 629 1 1 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.138 -0.152 25153 630 1 1 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.714 -0.614 25153 631 1 1 . 1 1 116 116 VAL H H 116 8.889 8.889 8.332 0.557 25153 632 1 1 . 1 1 117 117 GLY N N 117 108.300 108.300 107.980 0.320 25153 633 1 1 . 1 1 117 117 GLY C C 117 176.180 176.180 174.820 1.360 25153 634 1 1 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.490 2.309 25153 635 1 1 . 1 1 117 117 GLY H H 117 9.810 9.810 8.648 1.162 25153 636 1 1 . 1 1 118 118 TYR N N 118 120.050 120.050 119.571 0.479 25153 637 1 1 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.766 0.188 25153 638 1 1 . 1 1 118 118 TYR C C 118 177.450 177.450 175.900 1.550 25153 639 1 1 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.542 -1.302 25153 640 1 1 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.087 -2.977 25153 641 1 1 . 1 1 118 118 TYR H H 118 8.592 8.592 7.433 1.159 25153 642 1 1 . 1 1 119 119 TRP N N 119 125.500 125.500 120.835 4.665 25153 643 1 1 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.098 0.930 25153 644 1 1 . 1 1 119 119 TRP C C 119 173.090 173.090 174.082 -0.992 25153 645 1 1 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.369 -0.469 25153 646 1 1 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.240 3.010 25153 647 1 1 . 1 1 119 119 TRP H H 119 7.926 7.926 8.117 -0.191 25153 648 1 1 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.741 0.069 25153 649 1 1 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.772 0.908 25153 650 1 1 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.643 -0.393 25153 651 1 1 . 1 1 121 121 THR N N 121 109.114 109.114 111.434 -2.320 25153 652 1 1 . 1 1 121 121 THR HA H 121 4.142 4.142 3.372 0.770 25153 653 1 1 . 1 1 121 121 THR C C 121 176.300 176.300 175.144 1.156 25153 654 1 1 . 1 1 121 121 THR CA C 121 61.230 61.230 62.717 -1.487 25153 655 1 1 . 1 1 121 121 THR CB C 121 69.890 69.890 68.370 1.520 25153 656 1 1 . 1 1 121 121 THR H H 121 7.356 7.356 8.259 -0.903 25153 657 1 1 . 1 1 122 122 GLU N N 122 123.980 123.980 121.754 2.226 25153 658 1 1 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.045 0.193 25153 659 1 1 . 1 1 122 122 GLU C C 122 177.830 177.830 177.664 0.166 25153 660 1 1 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.285 0.945 25153 661 1 1 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.867 -0.097 25153 662 1 1 . 1 1 123 123 GLY N N 123 114.570 114.570 112.459 2.111 25153 663 1 1 . 1 1 123 123 GLY C C 123 173.700 173.700 173.571 0.129 25153 664 1 1 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.584 -0.184 25153 665 1 1 . 1 1 123 123 GLY H H 123 9.181 9.181 8.927 0.254 25153 666 1 1 . 1 1 124 124 TYR N N 124 118.923 118.923 119.036 -0.113 25153 667 1 1 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.923 0.387 25153 668 1 1 . 1 1 124 124 TYR C C 124 175.680 175.680 174.228 1.452 25153 669 1 1 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.175 -0.705 25153 670 1 1 . 1 1 124 124 TYR CB C 124 41.000 41.000 41.924 -0.924 25153 671 1 1 . 1 1 124 124 TYR H H 124 7.877 7.877 7.718 0.159 25153 672 1 1 . 1 1 125 125 GLU N N 125 124.890 124.890 122.404 2.486 25153 673 1 1 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.815 -0.115 25153 674 1 1 . 1 1 125 125 GLU C C 125 172.880 172.880 175.531 -2.651 25153 675 1 1 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.681 -0.251 25153 676 1 1 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.808 -0.388 25153 677 1 1 . 1 1 126 126 PHE N N 126 119.166 119.166 120.571 -1.405 25153 678 1 1 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.822 -0.013 25153 679 1 1 . 1 1 126 126 PHE C C 126 173.750 173.750 175.032 -1.282 25153 680 1 1 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.730 -1.940 25153 681 1 1 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.295 0.755 25153 682 1 1 . 1 1 126 126 PHE H H 126 7.716 7.716 8.197 -0.481 25153 683 1 1 . 1 1 127 127 THR N N 127 106.800 106.800 114.719 -7.919 25153 684 1 1 . 1 1 127 127 THR HA H 127 4.400 4.400 3.198 1.202 25153 685 1 1 . 1 1 127 127 THR C C 127 175.300 175.300 173.932 1.368 25153 686 1 1 . 1 1 127 127 THR CA C 127 61.100 61.100 63.113 -2.013 25153 687 1 1 . 1 1 127 127 THR CB C 127 70.600 70.600 68.082 2.518 25153 688 1 1 . 1 1 127 127 THR H H 127 7.220 7.220 6.366 0.854 25153 689 1 1 . 1 1 128 128 SER N N 128 118.360 118.360 114.977 3.383 25153 690 1 1 . 1 1 128 128 SER HA H 128 4.680 4.680 4.556 0.124 25153 691 1 1 . 1 1 128 128 SER C C 128 175.720 175.720 173.959 1.761 25153 692 1 1 . 1 1 128 128 SER CA C 128 56.250 56.250 56.558 -0.308 25153 693 1 1 . 1 1 128 128 SER CB C 128 65.635 65.635 64.436 1.199 25153 694 1 1 . 1 1 128 128 SER H H 128 7.411 7.411 7.852 -0.441 25153 695 1 1 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.552 0.223 25153 696 1 1 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.261 -1.762 25153 697 1 1 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.279 0.121 25153 698 1 1 . 1 1 130 130 LYS N N 130 122.014 122.014 119.039 2.975 25153 699 1 1 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.424 -0.191 25153 700 1 1 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.655 3.045 25153 701 1 1 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.573 -0.003 25153 702 1 1 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.552 -0.034 25153 703 1 1 . 1 1 131 131 PRO C C 131 174.000 174.000 174.988 -0.988 25153 704 1 1 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.326 2.374 25153 705 1 1 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.271 0.929 25153 706 1 1 . 1 1 132 132 VAL N N 132 113.260 113.260 116.622 -3.362 25153 707 1 1 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.820 0.380 25153 708 1 1 . 1 1 132 132 VAL C C 132 175.210 175.210 174.880 0.330 25153 709 1 1 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.774 -0.154 25153 710 1 1 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.830 -0.849 25153 711 1 1 . 1 1 132 132 VAL H H 132 6.697 6.697 7.481 -0.784 25153 712 1 1 . 1 1 133 133 ILE N N 133 119.940 119.940 116.697 3.243 25153 713 1 1 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.454 -0.074 25153 714 1 1 . 1 1 133 133 ILE C C 133 175.440 175.440 175.759 -0.319 25153 715 1 1 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.279 2.171 25153 716 1 1 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.592 1.508 25153 717 1 1 . 1 1 133 133 ILE H H 133 8.756 8.756 8.524 0.232 25153 718 1 1 . 1 1 134 134 ALA N N 134 122.632 122.632 123.524 -0.892 25153 719 1 1 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.759 0.201 25153 720 1 1 . 1 1 134 134 ALA C C 134 178.312 178.312 177.463 0.849 25153 721 1 1 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.616 -1.536 25153 722 1 1 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.424 -0.588 25153 723 1 1 . 1 1 134 134 ALA H H 134 8.523 8.523 8.322 0.201 25153 724 1 1 . 1 1 135 135 ASP N N 135 117.366 117.366 122.659 -5.293 25153 725 1 1 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.655 -0.403 25153 726 1 1 . 1 1 135 135 ASP C C 135 176.387 176.387 176.634 -0.247 25153 727 1 1 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.349 1.861 25153 728 1 1 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.205 -1.505 25153 729 1 1 . 1 1 136 136 GLY N N 136 104.310 104.310 108.050 -3.740 25153 730 1 1 . 1 1 136 136 GLY C C 136 174.922 174.922 174.911 0.011 25153 731 1 1 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.376 -0.276 25153 732 1 1 . 1 1 136 136 GLY H H 136 7.610 7.610 8.317 -0.707 25153 733 1 1 . 1 1 137 137 GLN N N 137 118.784 118.784 117.681 1.103 25153 734 1 1 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.409 -0.354 25153 735 1 1 . 1 1 137 137 GLN C C 137 176.390 176.390 175.387 1.003 25153 736 1 1 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.800 1.840 25153 737 1 1 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.225 0.005 25153 738 1 1 . 1 1 137 137 GLN H H 137 7.870 7.870 7.878 -0.008 25153 739 1 1 . 1 1 138 138 LEU N N 138 118.040 118.040 115.766 2.274 25153 740 1 1 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.010 -0.023 25153 741 1 1 . 1 1 138 138 LEU C C 138 175.913 175.913 175.019 0.894 25153 742 1 1 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.176 0.424 25153 743 1 1 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.916 1.484 25153 744 1 1 . 1 1 138 138 LEU H H 138 7.356 7.356 7.154 0.202 25153 745 1 1 . 1 1 139 139 PHE N N 139 119.060 119.060 119.582 -0.522 25153 746 1 1 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.881 0.429 25153 747 1 1 . 1 1 139 139 PHE C C 139 178.780 178.780 177.580 1.200 25153 748 1 1 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.959 -0.110 25153 749 1 1 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.876 3.584 25153 750 1 1 . 1 1 139 139 PHE H H 139 10.094 10.094 8.859 1.235 25153 751 1 1 . 1 1 140 140 VAL N N 140 109.690 109.690 116.350 -6.660 25153 752 1 1 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.531 -0.050 25153 753 1 1 . 1 1 140 140 VAL C C 140 172.790 172.790 175.718 -2.928 25153 754 1 1 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.931 -1.931 25153 755 1 1 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.204 -0.655 25153 756 1 1 . 1 1 140 140 VAL H H 140 7.470 7.470 8.100 -0.630 25153 757 1 1 . 1 1 141 141 GLY N N 141 107.060 107.060 105.386 1.674 25153 758 1 1 . 1 1 141 141 GLY C C 141 171.513 171.513 172.609 -1.096 25153 759 1 1 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.450 0.980 25153 760 1 1 . 1 1 141 141 GLY H H 141 7.137 7.137 7.355 -0.218 25153 761 1 1 . 1 1 142 142 LEU N N 142 117.863 117.863 120.338 -2.475 25153 762 1 1 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.046 -1.071 25153 763 1 1 . 1 1 142 142 LEU C C 142 173.640 173.640 175.072 -1.432 25153 764 1 1 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.608 1.312 25153 765 1 1 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.295 -4.745 25153 766 1 1 . 1 1 142 142 LEU H H 142 7.517 7.517 7.825 -0.308 25153 767 1 1 . 1 1 143 143 ALA N N 143 126.990 126.990 128.267 -1.277 25153 768 1 1 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.777 -0.500 25153 769 1 1 . 1 1 143 143 ALA C C 143 175.730 175.730 175.797 -0.067 25153 770 1 1 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.149 -0.709 25153 771 1 1 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.840 3.470 25153 772 1 1 . 1 1 143 143 ALA H H 143 5.186 5.186 7.991 -2.805 25153 773 1 1 . 1 1 144 144 LEU N N 144 125.477 125.477 123.583 1.894 25153 774 1 1 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.865 -0.085 25153 775 1 1 . 1 1 144 144 LEU C C 144 174.473 174.473 175.423 -0.950 25153 776 1 1 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.588 -0.348 25153 777 1 1 . 1 1 144 144 LEU CB C 144 45.300 45.300 46.231 -0.931 25153 778 1 1 . 1 1 144 144 LEU H H 144 8.758 8.758 8.327 0.431 25153 779 1 1 . 1 1 145 145 ASP N N 145 118.915 118.915 118.588 0.327 25153 780 1 1 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.191 0.341 25153 781 1 1 . 1 1 145 145 ASP C C 145 176.470 176.470 175.534 0.936 25153 782 1 1 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.918 -0.288 25153 783 1 1 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.187 -1.187 25153 784 1 1 . 1 1 146 146 GLU N N 146 124.813 124.813 122.085 2.728 25153 785 1 1 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.625 -0.249 25153 786 1 1 . 1 1 146 146 GLU C C 146 177.290 177.290 176.192 1.098 25153 787 1 1 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.702 0.418 25153 788 1 1 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.811 0.338 25153 789 1 1 . 1 1 147 147 THR N N 147 118.328 118.328 113.562 4.766 25153 790 1 1 . 1 1 147 147 THR HA H 147 4.200 4.200 4.337 -0.137 25153 791 1 1 . 1 1 147 147 THR C C 147 175.683 175.683 174.282 1.401 25153 792 1 1 . 1 1 147 147 THR CA C 147 66.250 66.250 63.850 2.400 25153 793 1 1 . 1 1 147 147 THR CB C 147 69.600 69.600 69.822 -0.222 25153 794 1 1 . 1 1 147 147 THR H H 147 8.562 8.562 8.789 -0.227 25153 795 1 1 . 1 1 148 148 ASN N N 148 115.550 115.550 116.165 -0.615 25153 796 1 1 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.531 0.456 25153 797 1 1 . 1 1 148 148 ASN C C 148 175.870 175.870 176.728 -0.858 25153 798 1 1 . 1 1 148 148 ASN CA C 148 53.700 53.700 53.642 0.058 25153 799 1 1 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.752 2.128 25153 800 1 1 . 1 1 148 148 ASN H H 148 9.118 9.118 8.515 0.603 25153 801 1 1 . 1 1 149 149 GLN N N 149 117.400 117.400 120.316 -2.916 25153 802 1 1 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.167 0.676 25153 803 1 1 . 1 1 149 149 GLN C C 149 177.780 177.780 176.745 1.035 25153 804 1 1 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.298 -2.398 25153 805 1 1 . 1 1 149 149 GLN CB C 149 29.300 29.300 27.859 1.441 25153 806 1 1 . 1 1 149 149 GLN H H 149 7.555 7.555 9.231 -1.676 25153 807 1 1 . 1 1 150 150 TYR N N 150 120.674 120.674 117.347 3.327 25153 808 1 1 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.550 -0.022 25153 809 1 1 . 1 1 150 150 TYR C C 150 177.830 177.830 176.573 1.257 25153 810 1 1 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.046 0.441 25153 811 1 1 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.700 -0.100 25153 812 1 1 . 1 1 150 150 TYR H H 150 6.983 6.983 7.695 -0.712 25153 813 1 1 . 1 1 151 151 ASP N N 151 120.810 120.810 119.978 0.832 25153 814 1 1 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.673 -0.158 25153 815 1 1 . 1 1 151 151 ASP C C 151 176.400 176.400 177.278 -0.878 25153 816 1 1 . 1 1 151 151 ASP CA C 151 55.400 55.400 56.156 -0.756 25153 817 1 1 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.527 -2.447 25153 818 1 1 . 1 1 152 152 LEU N N 152 118.083 118.083 112.946 5.137 25153 819 1 1 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.830 -0.154 25153 820 1 1 . 1 1 152 152 LEU C C 152 178.470 178.470 177.787 0.683 25153 821 1 1 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.537 -0.937 25153 822 1 1 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.594 -0.994 25153 823 1 1 . 1 1 152 152 LEU H H 152 7.453 7.453 7.614 -0.161 25153 824 1 1 . 1 1 153 153 SER N N 153 116.407 116.407 117.677 -1.270 25153 825 1 1 . 1 1 153 153 SER HA H 153 3.960 3.960 4.009 -0.049 25153 826 1 1 . 1 1 153 153 SER C C 153 174.590 174.590 176.005 -1.415 25153 827 1 1 . 1 1 153 153 SER CA C 153 63.400 63.400 62.115 1.285 25153 828 1 1 . 1 1 153 153 SER CB C 153 63.100 63.100 62.736 0.364 25153 829 1 1 . 1 1 153 153 SER H H 153 7.360 7.360 8.457 -1.097 25153 830 1 1 . 1 1 154 154 ASP N N 154 121.960 121.960 121.428 0.532 25153 831 1 1 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.355 -0.045 25153 832 1 1 . 1 1 154 154 ASP C C 154 178.640 178.640 177.811 0.829 25153 833 1 1 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.235 1.765 25153 834 1 1 . 1 1 154 154 ASP CB C 154 39.570 39.570 41.019 -1.449 25153 835 1 1 . 1 1 155 155 GLU N N 155 121.310 121.310 118.897 2.413 25153 836 1 1 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.115 0.070 25153 837 1 1 . 1 1 155 155 GLU C C 155 179.600 179.600 178.853 0.747 25153 838 1 1 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.855 0.595 25153 839 1 1 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.621 -0.221 25153 840 1 1 . 1 1 156 156 ARG N N 156 121.394 121.394 120.007 1.387 25153 841 1 1 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.233 0.067 25153 842 1 1 . 1 1 156 156 ARG C C 156 177.330 177.330 178.931 -1.601 25153 843 1 1 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.936 1.524 25153 844 1 1 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.292 0.468 25153 845 1 1 . 1 1 157 157 ILE N N 157 118.390 118.390 120.761 -2.371 25153 846 1 1 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.705 -0.271 25153 847 1 1 . 1 1 157 157 ILE C C 157 178.814 178.814 177.591 1.223 25153 848 1 1 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.140 0.554 25153 849 1 1 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.921 0.932 25153 850 1 1 . 1 1 157 157 ILE H H 157 8.966 8.966 7.977 0.989 25153 851 1 1 . 1 1 158 158 GLN N N 158 120.060 120.060 118.920 1.140 25153 852 1 1 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.967 -0.011 25153 853 1 1 . 1 1 158 158 GLN C C 158 178.843 178.843 178.497 0.346 25153 854 1 1 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.379 1.222 25153 855 1 1 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.137 0.253 25153 856 1 1 . 1 1 158 158 GLN H H 158 8.394 8.394 7.859 0.535 25153 857 1 1 . 1 1 159 159 SER N N 159 115.613 115.613 116.912 -1.299 25153 858 1 1 . 1 1 159 159 SER HA H 159 4.455 4.455 4.281 0.174 25153 859 1 1 . 1 1 159 159 SER C C 159 177.330 177.330 176.885 0.445 25153 860 1 1 . 1 1 159 159 SER CA C 159 62.400 62.400 61.035 1.365 25153 861 1 1 . 1 1 159 159 SER CB C 159 63.760 63.760 63.103 0.657 25153 862 1 1 . 1 1 159 159 SER H H 159 8.460 8.460 7.996 0.464 25153 863 1 1 . 1 1 160 160 TRP N N 160 126.820 126.820 124.840 1.980 25153 864 1 1 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.068 0.397 25153 865 1 1 . 1 1 160 160 TRP C C 160 178.050 178.050 177.502 0.548 25153 866 1 1 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.708 0.992 25153 867 1 1 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.317 0.043 25153 868 1 1 . 1 1 160 160 TRP H H 160 9.318 9.318 8.303 1.015 25153 869 1 1 . 1 1 161 161 CYS N N 161 116.750 116.750 117.957 -1.207 25153 870 1 1 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.714 0.169 25153 871 1 1 . 1 1 161 161 CYS C C 161 176.270 176.270 176.830 -0.560 25153 872 1 1 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.287 1.073 25153 873 1 1 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.797 1.083 25153 874 1 1 . 1 1 161 161 CYS H H 161 8.950 8.950 9.147 -0.197 25153 875 1 1 . 1 1 162 162 GLU N N 162 118.096 118.096 118.975 -0.879 25153 876 1 1 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.118 -0.188 25153 877 1 1 . 1 1 162 162 GLU C C 162 178.680 178.680 177.958 0.722 25153 878 1 1 . 1 1 162 162 GLU CA C 162 59.730 59.730 58.890 0.840 25153 879 1 1 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.218 0.212 25153 880 1 1 . 1 1 163 163 GLN N N 163 120.790 120.790 117.713 3.077 25153 881 1 1 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.173 0.004 25153 882 1 1 . 1 1 163 163 GLN C C 163 179.690 179.690 177.990 1.700 25153 883 1 1 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.922 1.618 25153 884 1 1 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.039 -0.039 25153 885 1 1 . 1 1 163 163 GLN H H 163 8.205 8.205 7.536 0.669 25153 886 1 1 . 1 1 164 164 ILE N N 164 114.860 114.860 118.999 -4.139 25153 887 1 1 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.855 0.188 25153 888 1 1 . 1 1 164 164 ILE C C 164 178.680 178.680 177.240 1.440 25153 889 1 1 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.034 2.176 25153 890 1 1 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.550 0.150 25153 891 1 1 . 1 1 164 164 ILE H H 164 9.005 9.005 8.036 0.969 25153 892 1 1 . 1 1 165 165 LEU N N 165 123.900 123.900 116.116 7.784 25153 893 1 1 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.190 -0.040 25153 894 1 1 . 1 1 165 165 LEU C C 165 180.520 180.520 177.502 3.018 25153 895 1 1 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.194 1.106 25153 896 1 1 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.160 -0.110 25153 897 1 1 . 1 1 165 165 LEU H H 165 7.825 7.825 7.883 -0.058 25153 898 1 1 . 1 1 166 166 ASN N N 166 120.112 120.112 118.224 1.888 25153 899 1 1 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.669 -0.086 25153 900 1 1 . 1 1 166 166 ASN C C 166 178.440 178.440 176.987 1.453 25153 901 1 1 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.838 0.582 25153 902 1 1 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.561 -1.141 25153 903 1 1 . 1 1 166 166 ASN H H 166 7.760 7.760 7.905 -0.145 25153 904 1 1 . 1 1 167 167 GLU N N 167 121.370 121.370 121.823 -0.453 25153 905 1 1 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.012 0.091 25153 906 1 1 . 1 1 167 167 GLU C C 167 180.332 180.332 179.395 0.937 25153 907 1 1 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.735 0.415 25153 908 1 1 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.665 1.355 25153 909 1 1 . 1 1 168 168 MET N N 168 118.532 118.532 117.615 0.917 25153 910 1 1 . 1 1 168 168 MET HA H 168 4.015 4.015 4.213 -0.198 25153 911 1 1 . 1 1 168 168 MET C C 168 176.600 176.600 178.069 -1.469 25153 912 1 1 . 1 1 168 168 MET CA C 168 59.300 59.300 59.447 -0.147 25153 913 1 1 . 1 1 168 168 MET CB C 168 33.400 33.400 32.699 0.701 25153 914 1 1 . 1 1 168 168 MET H H 168 8.718 8.718 8.454 0.264 25153 915 1 1 . 1 1 169 169 ALA N N 169 121.922 121.922 121.386 0.536 25153 916 1 1 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.134 0.040 25153 917 1 1 . 1 1 169 169 ALA C C 169 179.410 179.410 179.289 0.121 25153 918 1 1 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.663 -0.263 25153 919 1 1 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.447 -0.037 25153 920 1 1 . 1 1 169 169 ALA H H 169 7.448 7.448 7.814 -0.366 25153 921 1 1 . 1 1 170 170 GLU N N 170 117.300 117.300 116.152 1.148 25153 922 1 1 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.104 -0.009 25153 923 1 1 . 1 1 170 170 GLU C C 170 177.470 177.470 179.623 -2.153 25153 924 1 1 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.798 -0.848 25153 925 1 1 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.451 0.324 25153 926 1 1 . 1 1 171 171 HIS N N 171 117.944 117.944 120.454 -2.510 25153 927 1 1 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.367 0.133 25153 928 1 1 . 1 1 171 171 HIS C C 171 175.120 175.120 176.870 -1.750 25153 929 1 1 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.354 -2.154 25153 930 1 1 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.124 0.476 25153 931 1 1 . 1 1 171 171 HIS H H 171 7.788 7.788 7.751 0.037 25153 932 1 1 . 1 1 172 172 TYR N N 172 120.040 120.040 116.914 3.126 25153 933 1 1 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.506 0.087 25153 934 1 1 . 1 1 172 172 TYR C C 172 174.612 174.612 174.906 -0.294 25153 935 1 1 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.390 -0.410 25153 936 1 1 . 1 1 172 172 TYR CB C 172 38.980 38.980 39.076 -0.096 25153 937 1 1 . 1 1 172 172 TYR H H 172 7.820 7.820 7.814 0.006 25153 938 1 2 . 1 1 2 2 ASN N N 2 123.320 123.320 120.685 2.635 25153 939 1 2 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.400 -0.192 25153 940 1 2 . 1 1 2 2 ASN C C 2 174.590 174.590 173.575 1.015 25153 941 1 2 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.448 0.552 25153 942 1 2 . 1 1 2 2 ASN CB C 2 39.970 39.970 42.599 -2.629 25153 943 1 2 . 1 1 2 2 ASN H H 2 9.428 9.428 9.332 0.096 25153 944 1 2 . 1 1 3 3 MET N N 3 120.920 120.920 118.135 2.785 25153 945 1 2 . 1 1 3 3 MET HA H 3 5.530 5.530 5.421 0.109 25153 946 1 2 . 1 1 3 3 MET C C 3 174.400 174.400 174.793 -0.393 25153 947 1 2 . 1 1 3 3 MET CA C 3 54.643 54.643 54.105 0.538 25153 948 1 2 . 1 1 3 3 MET CB C 3 34.637 34.637 37.810 -3.173 25153 949 1 2 . 1 1 3 3 MET H H 3 8.751 8.751 9.306 -0.555 25153 950 1 2 . 1 1 4 4 GLY N N 4 115.542 115.542 109.082 6.460 25153 951 1 2 . 1 1 4 4 GLY C C 4 170.413 170.413 172.157 -1.744 25153 952 1 2 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.691 -0.589 25153 953 1 2 . 1 1 4 4 GLY H H 4 8.927 8.927 8.660 0.267 25153 954 1 2 . 1 1 5 5 LEU N N 5 131.030 131.030 128.212 2.818 25153 955 1 2 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.308 1.094 25153 956 1 2 . 1 1 5 5 LEU C C 5 175.952 175.952 174.542 1.410 25153 957 1 2 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.926 0.524 25153 958 1 2 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.716 2.876 25153 959 1 2 . 1 1 5 5 LEU H H 5 8.928 8.928 8.649 0.279 25153 960 1 2 . 1 1 6 6 PHE N N 6 125.790 125.790 126.501 -0.711 25153 961 1 2 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.709 0.031 25153 962 1 2 . 1 1 6 6 PHE C C 6 174.300 174.300 175.898 -1.598 25153 963 1 2 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.523 -1.203 25153 964 1 2 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.235 -0.005 25153 965 1 2 . 1 1 6 6 PHE H H 6 9.237 9.237 9.383 -0.146 25153 966 1 2 . 1 1 7 7 TYR N N 7 117.289 117.289 117.366 -0.077 25153 967 1 2 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.966 -0.001 25153 968 1 2 . 1 1 7 7 TYR C C 7 171.262 171.262 173.420 -2.158 25153 969 1 2 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.266 -0.866 25153 970 1 2 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.313 -0.073 25153 971 1 2 . 1 1 7 7 TYR H H 7 8.125 8.125 8.453 -0.328 25153 972 1 2 . 1 1 8 8 GLY N N 8 107.420 107.420 105.570 1.850 25153 973 1 2 . 1 1 8 8 GLY C C 8 172.000 172.000 172.260 -0.260 25153 974 1 2 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.511 -0.567 25153 975 1 2 . 1 1 8 8 GLY H H 8 7.031 7.031 8.406 -1.375 25153 976 1 2 . 1 1 9 9 SER N N 9 118.150 118.150 116.187 1.963 25153 977 1 2 . 1 1 9 9 SER HA H 9 5.200 5.200 5.123 0.077 25153 978 1 2 . 1 1 9 9 SER C C 9 175.000 175.000 175.087 -0.087 25153 979 1 2 . 1 1 9 9 SER CA C 9 57.570 57.570 56.938 0.632 25153 980 1 2 . 1 1 9 9 SER CB C 9 66.700 66.700 65.423 1.277 25153 981 1 2 . 1 1 9 9 SER H H 9 9.604 9.604 8.482 1.122 25153 982 1 2 . 1 1 10 10 SER N N 10 131.193 131.193 123.115 8.078 25153 983 1 2 . 1 1 10 10 SER HA H 10 4.775 4.775 4.560 0.215 25153 984 1 2 . 1 1 10 10 SER C C 10 175.730 175.730 175.070 0.660 25153 985 1 2 . 1 1 10 10 SER CA C 10 61.750 61.750 60.670 1.080 25153 986 1 2 . 1 1 10 10 SER CB C 10 64.400 64.400 63.504 0.896 25153 987 1 2 . 1 1 10 10 SER H H 10 11.636 11.636 9.184 2.452 25153 988 1 2 . 1 1 11 11 THR N N 11 115.848 115.848 114.538 1.310 25153 989 1 2 . 1 1 11 11 THR HA H 11 4.770 4.770 4.350 0.420 25153 990 1 2 . 1 1 11 11 THR C C 11 173.700 173.700 174.749 -1.049 25153 991 1 2 . 1 1 11 11 THR CA C 11 60.700 60.700 62.604 -1.904 25153 992 1 2 . 1 1 11 11 THR CB C 11 67.430 67.430 69.684 -2.254 25153 993 1 2 . 1 1 11 11 THR H H 11 9.550 9.550 7.897 1.653 25153 994 1 2 . 1 1 12 12 CYS N N 12 109.780 109.780 113.283 -3.503 25153 995 1 2 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.649 -0.579 25153 996 1 2 . 1 1 12 12 CYS C C 12 176.220 176.220 175.046 1.174 25153 997 1 2 . 1 1 12 12 CYS CA C 12 63.600 63.600 59.156 4.444 25153 998 1 2 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.750 -1.350 25153 999 1 2 . 1 1 12 12 CYS H H 12 7.437 7.437 7.413 0.024 25153 1000 1 2 . 1 1 13 13 TYR N N 13 127.830 127.830 122.809 5.021 25153 1001 1 2 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.359 -0.256 25153 1002 1 2 . 1 1 13 13 TYR C C 13 180.880 180.880 177.623 3.257 25153 1003 1 2 . 1 1 13 13 TYR CA C 13 65.100 65.100 59.757 5.343 25153 1004 1 2 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.294 -0.459 25153 1005 1 2 . 1 1 13 13 TYR H H 13 10.886 10.886 7.504 3.382 25153 1006 1 2 . 1 1 14 14 THR N N 14 124.428 124.428 114.026 10.402 25153 1007 1 2 . 1 1 14 14 THR HA H 14 4.160 4.160 4.166 -0.006 25153 1008 1 2 . 1 1 14 14 THR C C 14 177.760 177.760 176.382 1.378 25153 1009 1 2 . 1 1 14 14 THR CA C 14 67.823 67.823 66.408 1.415 25153 1010 1 2 . 1 1 14 14 THR CB C 14 68.040 68.040 68.643 -0.603 25153 1011 1 2 . 1 1 14 14 THR H H 14 11.405 11.405 7.868 3.537 25153 1012 1 2 . 1 1 15 15 GLU N N 15 123.050 123.050 123.166 -0.116 25153 1013 1 2 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.235 -0.345 25153 1014 1 2 . 1 1 15 15 GLU C C 15 176.392 176.392 178.124 -1.732 25153 1015 1 2 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.469 -0.269 25153 1016 1 2 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.384 1.066 25153 1017 1 2 . 1 1 16 16 MET N N 16 120.173 120.173 118.279 1.894 25153 1018 1 2 . 1 1 16 16 MET HA H 16 4.050 4.050 4.145 -0.095 25153 1019 1 2 . 1 1 16 16 MET C C 16 179.940 179.940 178.679 1.261 25153 1020 1 2 . 1 1 16 16 MET CA C 16 59.240 59.240 59.242 -0.002 25153 1021 1 2 . 1 1 16 16 MET CB C 16 32.970 32.970 32.805 0.165 25153 1022 1 2 . 1 1 16 16 MET H H 16 8.469 8.469 8.489 -0.020 25153 1023 1 2 . 1 1 17 17 ALA N N 17 121.930 121.930 121.551 0.379 25153 1024 1 2 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.839 -0.003 25153 1025 1 2 . 1 1 17 17 ALA C C 17 177.900 177.900 178.710 -0.810 25153 1026 1 2 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.100 0.100 25153 1027 1 2 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.075 -0.075 25153 1028 1 2 . 1 1 17 17 ALA H H 17 7.880 7.880 7.742 0.138 25153 1029 1 2 . 1 1 18 18 ALA N N 18 121.477 121.477 121.434 0.043 25153 1030 1 2 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.797 -0.060 25153 1031 1 2 . 1 1 18 18 ALA C C 18 179.380 179.380 179.589 -0.209 25153 1032 1 2 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.209 -0.209 25153 1033 1 2 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.733 1.097 25153 1034 1 2 . 1 1 18 18 ALA H H 18 7.374 7.374 7.850 -0.476 25153 1035 1 2 . 1 1 19 19 GLU N N 19 116.650 116.650 117.964 -1.314 25153 1036 1 2 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.847 -0.231 25153 1037 1 2 . 1 1 19 19 GLU C C 19 178.479 178.479 179.307 -0.828 25153 1038 1 2 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.493 0.237 25153 1039 1 2 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.390 -0.090 25153 1040 1 2 . 1 1 20 20 LYS N N 20 119.470 119.470 119.907 -0.437 25153 1041 1 2 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.020 0.030 25153 1042 1 2 . 1 1 20 20 LYS C C 20 179.116 179.116 179.038 0.078 25153 1043 1 2 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.431 0.400 25153 1044 1 2 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.428 0.422 25153 1045 1 2 . 1 1 21 21 ILE N N 21 121.030 121.030 120.829 0.201 25153 1046 1 2 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.671 -0.281 25153 1047 1 2 . 1 1 21 21 ILE C C 21 177.580 177.580 178.206 -0.626 25153 1048 1 2 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.769 0.051 25153 1049 1 2 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.897 0.451 25153 1050 1 2 . 1 1 21 21 ILE H H 21 8.100 8.100 8.573 -0.473 25153 1051 1 2 . 1 1 22 22 ARG N N 22 119.720 119.720 119.407 0.313 25153 1052 1 2 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.851 -0.296 25153 1053 1 2 . 1 1 22 22 ARG C C 22 177.320 177.320 178.095 -0.775 25153 1054 1 2 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.745 -0.025 25153 1055 1 2 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.759 -0.827 25153 1056 1 2 . 1 1 23 23 ASP N N 23 118.730 118.730 119.350 -0.620 25153 1057 1 2 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.418 -0.055 25153 1058 1 2 . 1 1 23 23 ASP C C 23 178.330 178.330 178.799 -0.469 25153 1059 1 2 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.315 -0.365 25153 1060 1 2 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.870 -0.630 25153 1061 1 2 . 1 1 24 24 ILE N N 24 121.090 121.090 119.568 1.522 25153 1062 1 2 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.770 0.026 25153 1063 1 2 . 1 1 24 24 ILE C C 24 178.250 178.250 177.915 0.335 25153 1064 1 2 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.822 -0.672 25153 1065 1 2 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.264 0.215 25153 1066 1 2 . 1 1 24 24 ILE H H 24 7.910 7.910 8.233 -0.323 25153 1067 1 2 . 1 1 25 25 ILE N N 25 121.406 121.406 117.243 4.163 25153 1068 1 2 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.870 -0.224 25153 1069 1 2 . 1 1 25 25 ILE C C 25 176.800 176.800 176.751 0.049 25153 1070 1 2 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.006 2.694 25153 1071 1 2 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.971 -0.781 25153 1072 1 2 . 1 1 25 25 ILE H H 25 8.476 8.476 8.046 0.430 25153 1073 1 2 . 1 1 26 26 GLY N N 26 108.900 108.900 105.229 3.671 25153 1074 1 2 . 1 1 26 26 GLY C C 26 173.710 173.710 172.271 1.439 25153 1075 1 2 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.661 -0.331 25153 1076 1 2 . 1 1 26 26 GLY H H 26 8.016 8.016 7.794 0.222 25153 1077 1 2 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.701 -0.363 25153 1078 1 2 . 1 1 27 27 PRO C C 27 177.200 177.200 177.113 0.087 25153 1079 1 2 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.517 1.169 25153 1080 1 2 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.015 0.185 25153 1081 1 2 . 1 1 28 28 GLU N N 28 116.295 116.295 118.257 -1.962 25153 1082 1 2 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.193 0.077 25153 1083 1 2 . 1 1 28 28 GLU C C 28 176.980 176.980 177.230 -0.250 25153 1084 1 2 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.445 -0.705 25153 1085 1 2 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.494 -0.824 25153 1086 1 2 . 1 1 29 29 LEU N N 29 120.250 120.250 111.764 8.486 25153 1087 1 2 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.689 -0.053 25153 1088 1 2 . 1 1 29 29 LEU C C 29 175.770 175.770 175.920 -0.150 25153 1089 1 2 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.497 0.303 25153 1090 1 2 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.823 1.277 25153 1091 1 2 . 1 1 29 29 LEU H H 29 7.940 7.940 7.556 0.384 25153 1092 1 2 . 1 1 30 30 VAL N N 30 118.693 118.693 121.048 -2.355 25153 1093 1 2 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.904 -0.256 25153 1094 1 2 . 1 1 30 30 VAL C C 30 174.347 174.347 176.036 -1.689 25153 1095 1 2 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.383 -0.515 25153 1096 1 2 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.454 2.126 25153 1097 1 2 . 1 1 30 30 VAL H H 30 7.434 7.434 7.988 -0.554 25153 1098 1 2 . 1 1 31 31 THR N N 31 123.800 123.800 122.039 1.761 25153 1099 1 2 . 1 1 31 31 THR HA H 31 4.362 4.362 4.553 -0.191 25153 1100 1 2 . 1 1 31 31 THR C C 31 172.964 172.964 173.443 -0.479 25153 1101 1 2 . 1 1 31 31 THR CA C 31 61.720 61.720 60.917 0.803 25153 1102 1 2 . 1 1 31 31 THR CB C 31 70.485 70.485 70.983 -0.498 25153 1103 1 2 . 1 1 31 31 THR H H 31 7.844 7.844 8.262 -0.418 25153 1104 1 2 . 1 1 32 32 LEU N N 32 127.800 127.800 127.101 0.699 25153 1105 1 2 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.673 0.011 25153 1106 1 2 . 1 1 32 32 LEU C C 32 176.600 176.600 176.525 0.075 25153 1107 1 2 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.191 -0.036 25153 1108 1 2 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.709 1.141 25153 1109 1 2 . 1 1 32 32 LEU H H 32 8.660 8.660 8.583 0.077 25153 1110 1 2 . 1 1 33 33 HIS N N 33 119.670 119.670 120.003 -0.333 25153 1111 1 2 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.811 -0.411 25153 1112 1 2 . 1 1 33 33 HIS C C 33 171.667 171.667 173.240 -1.573 25153 1113 1 2 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.167 0.033 25153 1114 1 2 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.807 0.393 25153 1115 1 2 . 1 1 33 33 HIS H H 33 9.060 9.060 8.715 0.345 25153 1116 1 2 . 1 1 34 34 ASN N N 34 124.068 124.068 123.306 0.762 25153 1117 1 2 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.170 -0.736 25153 1118 1 2 . 1 1 34 34 ASN C C 34 178.000 178.000 175.936 2.064 25153 1119 1 2 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.035 -0.606 25153 1120 1 2 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.205 -0.645 25153 1121 1 2 . 1 1 34 34 ASN H H 34 8.780 8.780 8.758 0.022 25153 1122 1 2 . 1 1 35 35 LEU N N 35 129.040 129.040 126.490 2.550 25153 1123 1 2 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.207 0.108 25153 1124 1 2 . 1 1 35 35 LEU C C 35 177.700 177.700 177.845 -0.145 25153 1125 1 2 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.346 0.134 25153 1126 1 2 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.801 1.499 25153 1127 1 2 . 1 1 35 35 LEU H H 35 8.821 8.821 8.333 0.488 25153 1128 1 2 . 1 1 36 36 LYS N N 36 121.043 121.043 116.723 4.320 25153 1129 1 2 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.994 -0.114 25153 1130 1 2 . 1 1 36 36 LYS C C 36 176.230 176.230 177.233 -1.003 25153 1131 1 2 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.574 0.846 25153 1132 1 2 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.545 0.725 25153 1133 1 2 . 1 1 37 37 ASP N N 37 114.965 114.965 118.062 -3.097 25153 1134 1 2 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.793 -0.016 25153 1135 1 2 . 1 1 37 37 ASP C C 37 175.440 175.440 175.961 -0.521 25153 1136 1 2 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.487 0.224 25153 1137 1 2 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.553 1.147 25153 1138 1 2 . 1 1 38 38 ASP N N 38 121.650 121.650 121.756 -0.106 25153 1139 1 2 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.880 -0.010 25153 1140 1 2 . 1 1 38 38 ASP C C 38 174.852 174.852 176.016 -1.164 25153 1141 1 2 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.624 -1.544 25153 1142 1 2 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.289 -0.179 25153 1143 1 2 . 1 1 39 39 SER N N 39 115.207 115.207 118.024 -2.817 25153 1144 1 2 . 1 1 39 39 SER HA H 39 4.585 4.585 4.680 -0.095 25153 1145 1 2 . 1 1 39 39 SER C C 39 175.040 175.040 174.387 0.653 25153 1146 1 2 . 1 1 39 39 SER CA C 39 54.960 54.960 56.398 -1.438 25153 1147 1 2 . 1 1 39 39 SER CB C 39 64.720 64.720 63.606 1.114 25153 1148 1 2 . 1 1 39 39 SER H H 39 8.351 8.351 8.591 -0.240 25153 1149 1 2 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.249 -0.244 25153 1150 1 2 . 1 1 40 40 PRO C C 40 176.730 176.730 177.867 -1.137 25153 1151 1 2 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.171 -0.271 25153 1152 1 2 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.816 -0.416 25153 1153 1 2 . 1 1 41 41 LYS N N 41 121.150 121.150 119.711 1.439 25153 1154 1 2 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.994 -0.082 25153 1155 1 2 . 1 1 41 41 LYS C C 41 179.600 179.600 178.489 1.111 25153 1156 1 2 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.473 -1.273 25153 1157 1 2 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.617 0.383 25153 1158 1 2 . 1 1 42 42 LEU N N 42 118.103 118.103 116.076 2.027 25153 1159 1 2 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.208 -0.171 25153 1160 1 2 . 1 1 42 42 LEU C C 42 178.760 178.760 178.756 0.004 25153 1161 1 2 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.229 -0.049 25153 1162 1 2 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.495 1.478 25153 1163 1 2 . 1 1 42 42 LEU H H 42 7.600 7.600 7.527 0.073 25153 1164 1 2 . 1 1 43 43 MET N N 43 118.917 118.917 117.168 1.749 25153 1165 1 2 . 1 1 43 43 MET HA H 43 3.750 3.750 4.437 -0.687 25153 1166 1 2 . 1 1 43 43 MET C C 43 177.680 177.680 177.031 0.649 25153 1167 1 2 . 1 1 43 43 MET CA C 43 59.730 59.730 58.039 1.691 25153 1168 1 2 . 1 1 43 43 MET CB C 43 32.700 32.700 31.789 0.911 25153 1169 1 2 . 1 1 43 43 MET H H 43 8.202 8.202 8.007 0.195 25153 1170 1 2 . 1 1 44 44 GLU N N 44 110.924 110.924 118.321 -7.397 25153 1171 1 2 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.321 -0.581 25153 1172 1 2 . 1 1 44 44 GLU C C 44 178.130 178.130 178.872 -0.742 25153 1173 1 2 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.316 1.084 25153 1174 1 2 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.987 -0.437 25153 1175 1 2 . 1 1 45 45 GLN N N 45 115.756 115.756 118.477 -2.721 25153 1176 1 2 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.044 0.139 25153 1177 1 2 . 1 1 45 45 GLN C C 45 175.414 175.414 177.294 -1.880 25153 1178 1 2 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.591 -1.411 25153 1179 1 2 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.083 -0.483 25153 1180 1 2 . 1 1 45 45 GLN H H 45 7.516 7.516 7.528 -0.012 25153 1181 1 2 . 1 1 46 46 TYR N N 46 117.860 117.860 118.910 -1.050 25153 1182 1 2 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.292 0.371 25153 1183 1 2 . 1 1 46 46 TYR C C 46 175.500 175.500 176.649 -1.149 25153 1184 1 2 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.387 -0.901 25153 1185 1 2 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.489 2.981 25153 1186 1 2 . 1 1 46 46 TYR H H 46 6.996 6.996 7.278 -0.282 25153 1187 1 2 . 1 1 47 47 ASP N N 47 121.683 121.683 120.581 1.102 25153 1188 1 2 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.588 0.112 25153 1189 1 2 . 1 1 47 47 ASP C C 47 175.610 175.610 175.468 0.142 25153 1190 1 2 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.120 -0.420 25153 1191 1 2 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.712 1.288 25153 1192 1 2 . 1 1 48 48 VAL N N 48 118.628 118.628 115.795 2.833 25153 1193 1 2 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.696 0.338 25153 1194 1 2 . 1 1 48 48 VAL C C 48 174.190 174.190 173.977 0.213 25153 1195 1 2 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.445 -1.255 25153 1196 1 2 . 1 1 48 48 VAL CB C 48 36.100 36.100 36.320 -0.220 25153 1197 1 2 . 1 1 48 48 VAL H H 48 7.628 7.628 7.311 0.317 25153 1198 1 2 . 1 1 49 49 LEU N N 49 128.190 128.190 122.136 6.054 25153 1199 1 2 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.367 0.236 25153 1200 1 2 . 1 1 49 49 LEU C C 49 174.880 174.880 175.491 -0.611 25153 1201 1 2 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.574 -1.334 25153 1202 1 2 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.243 -0.903 25153 1203 1 2 . 1 1 49 49 LEU H H 49 9.407 9.407 8.943 0.464 25153 1204 1 2 . 1 1 50 50 ILE N N 50 124.550 124.550 120.461 4.089 25153 1205 1 2 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.134 0.566 25153 1206 1 2 . 1 1 50 50 ILE C C 50 175.300 175.300 174.611 0.689 25153 1207 1 2 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.869 -1.005 25153 1208 1 2 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.095 -0.845 25153 1209 1 2 . 1 1 50 50 ILE H H 50 9.238 9.238 9.166 0.072 25153 1210 1 2 . 1 1 51 51 LEU N N 51 127.460 127.460 128.228 -0.768 25153 1211 1 2 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.889 0.296 25153 1212 1 2 . 1 1 51 51 LEU C C 51 174.544 174.544 175.912 -1.368 25153 1213 1 2 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.479 -0.659 25153 1214 1 2 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.198 -2.561 25153 1215 1 2 . 1 1 51 51 LEU H H 51 9.228 9.228 9.157 0.071 25153 1216 1 2 . 1 1 52 52 GLY N N 52 107.760 107.760 111.055 -3.295 25153 1217 1 2 . 1 1 52 52 GLY C C 52 174.710 174.710 172.371 2.339 25153 1218 1 2 . 1 1 52 52 GLY CA C 52 43.870 43.870 44.045 -0.175 25153 1219 1 2 . 1 1 52 52 GLY H H 52 8.860 8.860 8.970 -0.110 25153 1220 1 2 . 1 1 53 53 ILE N N 53 123.890 123.890 120.084 3.806 25153 1221 1 2 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.843 0.427 25153 1222 1 2 . 1 1 53 53 ILE C C 53 172.630 172.630 173.245 -0.615 25153 1223 1 2 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.595 0.085 25153 1224 1 2 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.348 3.812 25153 1225 1 2 . 1 1 53 53 ILE H H 53 8.458 8.458 7.890 0.568 25153 1226 1 2 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.537 0.851 25153 1227 1 2 . 1 1 54 54 PRO C C 54 175.000 175.000 176.216 -1.216 25153 1228 1 2 . 1 1 54 54 PRO CA C 54 61.600 61.600 62.222 -0.622 25153 1229 1 2 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.961 -0.660 25153 1230 1 2 . 1 1 55 55 THR N N 55 112.754 112.754 116.923 -4.169 25153 1231 1 2 . 1 1 55 55 THR HA H 55 4.452 4.452 4.906 -0.454 25153 1232 1 2 . 1 1 55 55 THR C C 55 172.480 172.480 174.244 -1.764 25153 1233 1 2 . 1 1 55 55 THR CA C 55 62.350 62.350 61.923 0.427 25153 1234 1 2 . 1 1 55 55 THR CB C 55 70.230 70.230 68.913 1.317 25153 1235 1 2 . 1 1 55 55 THR H H 55 6.523 6.523 7.720 -1.197 25153 1236 1 2 . 1 1 56 56 TRP N N 56 130.044 130.044 127.062 2.982 25153 1237 1 2 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.432 -1.717 25153 1238 1 2 . 1 1 56 56 TRP C C 56 172.890 172.890 176.138 -3.248 25153 1239 1 2 . 1 1 56 56 TRP CA C 56 56.650 56.650 57.142 -0.492 25153 1240 1 2 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.153 2.847 25153 1241 1 2 . 1 1 56 56 TRP H H 56 8.450 8.450 8.471 -0.021 25153 1242 1 2 . 1 1 57 57 ASP N N 57 115.275 115.275 121.513 -6.238 25153 1243 1 2 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.840 0.512 25153 1244 1 2 . 1 1 57 57 ASP C C 57 173.660 173.660 174.890 -1.230 25153 1245 1 2 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.211 1.019 25153 1246 1 2 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.735 0.435 25153 1247 1 2 . 1 1 58 58 PHE N N 58 112.840 112.840 118.178 -5.338 25153 1248 1 2 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.788 -0.464 25153 1249 1 2 . 1 1 58 58 PHE C C 58 175.730 175.730 176.141 -0.411 25153 1250 1 2 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.565 1.258 25153 1251 1 2 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.483 -1.729 25153 1252 1 2 . 1 1 58 58 PHE H H 58 7.640 7.640 7.955 -0.315 25153 1253 1 2 . 1 1 59 59 GLY N N 59 104.940 104.940 105.981 -1.041 25153 1254 1 2 . 1 1 59 59 GLY C C 59 173.750 173.750 174.479 -0.729 25153 1255 1 2 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.124 1.166 25153 1256 1 2 . 1 1 59 59 GLY H H 59 8.024 8.024 8.829 -0.805 25153 1257 1 2 . 1 1 60 60 GLU N N 60 120.045 120.045 119.515 0.530 25153 1258 1 2 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.474 -0.061 25153 1259 1 2 . 1 1 60 60 GLU C C 60 176.050 176.050 175.903 0.147 25153 1260 1 2 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.716 -1.096 25153 1261 1 2 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.216 -0.606 25153 1262 1 2 . 1 1 61 61 ILE N N 61 120.790 120.790 120.447 0.343 25153 1263 1 2 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.213 -0.746 25153 1264 1 2 . 1 1 61 61 ILE C C 61 175.130 175.130 176.144 -1.014 25153 1265 1 2 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.749 0.798 25153 1266 1 2 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.241 -0.391 25153 1267 1 2 . 1 1 61 61 ILE H H 61 8.200 8.200 8.345 -0.145 25153 1268 1 2 . 1 1 62 62 GLN N N 62 124.520 124.520 124.782 -0.262 25153 1269 1 2 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.148 -0.192 25153 1270 1 2 . 1 1 62 62 GLN C C 62 177.160 177.160 176.999 0.161 25153 1271 1 2 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.696 1.914 25153 1272 1 2 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.208 -2.558 25153 1273 1 2 . 1 1 62 62 GLN H H 62 5.667 5.667 8.860 -3.193 25153 1274 1 2 . 1 1 63 63 GLU N N 63 124.570 124.570 126.237 -1.667 25153 1275 1 2 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.137 -0.151 25153 1276 1 2 . 1 1 63 63 GLU C C 63 177.300 177.300 177.219 0.081 25153 1277 1 2 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.092 1.628 25153 1278 1 2 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.104 1.016 25153 1279 1 2 . 1 1 64 64 ASP N N 64 119.060 119.060 119.595 -0.535 25153 1280 1 2 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.381 0.239 25153 1281 1 2 . 1 1 64 64 ASP C C 64 179.180 179.180 177.047 2.133 25153 1282 1 2 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.183 1.767 25153 1283 1 2 . 1 1 64 64 ASP CB C 64 40.950 40.950 39.880 1.070 25153 1284 1 2 . 1 1 65 65 TRP N N 65 121.070 121.070 121.382 -0.312 25153 1285 1 2 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.612 -0.272 25153 1286 1 2 . 1 1 65 65 TRP C C 65 178.970 178.970 178.703 0.267 25153 1287 1 2 . 1 1 65 65 TRP CA C 65 60.820 60.820 59.876 0.944 25153 1288 1 2 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.585 -0.185 25153 1289 1 2 . 1 1 65 65 TRP H H 65 7.350 7.350 7.864 -0.514 25153 1290 1 2 . 1 1 66 66 GLU N N 66 120.900 120.900 118.969 1.931 25153 1291 1 2 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.885 -0.045 25153 1292 1 2 . 1 1 66 66 GLU C C 66 178.750 178.750 179.113 -0.363 25153 1293 1 2 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.489 0.511 25153 1294 1 2 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.272 -0.412 25153 1295 1 2 . 1 1 67 67 ALA N N 67 119.130 119.130 119.940 -0.810 25153 1296 1 2 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.241 0.012 25153 1297 1 2 . 1 1 67 67 ALA C C 67 179.410 179.410 179.227 0.183 25153 1298 1 2 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.813 -0.233 25153 1299 1 2 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.906 -0.096 25153 1300 1 2 . 1 1 67 67 ALA H H 67 7.640 7.640 8.141 -0.501 25153 1301 1 2 . 1 1 68 68 VAL N N 68 106.845 106.845 112.271 -5.426 25153 1302 1 2 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.441 0.369 25153 1303 1 2 . 1 1 68 68 VAL C C 68 176.750 176.750 176.942 -0.192 25153 1304 1 2 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.839 -3.229 25153 1305 1 2 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.320 0.300 25153 1306 1 2 . 1 1 68 68 VAL H H 68 7.219 7.219 7.531 -0.312 25153 1307 1 2 . 1 1 69 69 TRP N N 69 127.630 127.630 124.076 3.554 25153 1308 1 2 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.253 -0.015 25153 1309 1 2 . 1 1 69 69 TRP C C 69 178.670 178.670 177.032 1.638 25153 1310 1 2 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.768 -1.548 25153 1311 1 2 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.837 1.792 25153 1312 1 2 . 1 1 69 69 TRP H H 69 7.832 7.832 8.557 -0.725 25153 1313 1 2 . 1 1 70 70 ASP N N 70 114.544 114.544 118.336 -3.792 25153 1314 1 2 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.466 0.056 25153 1315 1 2 . 1 1 70 70 ASP C C 70 178.670 178.670 178.994 -0.324 25153 1316 1 2 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.286 -1.286 25153 1317 1 2 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.977 -1.127 25153 1318 1 2 . 1 1 71 71 GLN N N 71 120.040 120.040 119.555 0.485 25153 1319 1 2 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.121 0.063 25153 1320 1 2 . 1 1 71 71 GLN C C 71 178.910 178.910 178.816 0.094 25153 1321 1 2 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.356 -0.746 25153 1322 1 2 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.840 0.261 25153 1323 1 2 . 1 1 71 71 GLN H H 71 7.995 7.995 7.696 0.299 25153 1324 1 2 . 1 1 72 72 LEU N N 72 117.400 117.400 118.315 -0.915 25153 1325 1 2 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.975 -0.162 25153 1326 1 2 . 1 1 72 72 LEU C C 72 178.650 178.650 178.163 0.487 25153 1327 1 2 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.032 0.168 25153 1328 1 2 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.341 0.069 25153 1329 1 2 . 1 1 72 72 LEU H H 72 7.450 7.450 7.934 -0.484 25153 1330 1 2 . 1 1 73 73 ASP N N 73 115.750 115.750 117.770 -2.020 25153 1331 1 2 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.400 -0.232 25153 1332 1 2 . 1 1 73 73 ASP C C 73 177.560 177.560 177.349 0.211 25153 1333 1 2 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.431 0.969 25153 1334 1 2 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.512 -1.412 25153 1335 1 2 . 1 1 74 74 ASP N N 74 117.223 117.223 119.700 -2.477 25153 1336 1 2 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.554 0.149 25153 1337 1 2 . 1 1 74 74 ASP C C 74 176.388 176.388 177.171 -0.783 25153 1338 1 2 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.291 -0.791 25153 1339 1 2 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.531 0.169 25153 1340 1 2 . 1 1 75 75 LEU N N 75 118.316 118.316 119.443 -1.127 25153 1341 1 2 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.410 -0.125 25153 1342 1 2 . 1 1 75 75 LEU C C 75 176.820 176.820 175.863 0.957 25153 1343 1 2 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.463 -0.063 25153 1344 1 2 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.379 0.901 25153 1345 1 2 . 1 1 75 75 LEU H H 75 6.960 6.960 7.364 -0.404 25153 1346 1 2 . 1 1 76 76 ASN N N 76 123.045 123.045 118.285 4.760 25153 1347 1 2 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.063 -0.173 25153 1348 1 2 . 1 1 76 76 ASN C C 76 174.950 174.950 174.999 -0.049 25153 1349 1 2 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.526 -0.477 25153 1350 1 2 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.824 -1.324 25153 1351 1 2 . 1 1 76 76 ASN H H 76 9.890 9.890 8.744 1.146 25153 1352 1 2 . 1 1 77 77 LEU N N 77 123.494 123.494 122.575 0.919 25153 1353 1 2 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.530 -0.160 25153 1354 1 2 . 1 1 77 77 LEU C C 77 175.040 175.040 175.933 -0.893 25153 1355 1 2 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.526 -1.276 25153 1356 1 2 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.567 0.333 25153 1357 1 2 . 1 1 77 77 LEU H H 77 8.730 8.730 7.749 0.981 25153 1358 1 2 . 1 1 78 78 GLU N N 78 120.870 120.870 120.969 -0.099 25153 1359 1 2 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.461 -0.561 25153 1360 1 2 . 1 1 78 78 GLU C C 78 178.660 178.660 177.802 0.858 25153 1361 1 2 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.110 1.650 25153 1362 1 2 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.231 1.169 25153 1363 1 2 . 1 1 79 79 GLY N N 79 113.240 113.240 114.038 -0.798 25153 1364 1 2 . 1 1 79 79 GLY C C 79 174.460 174.460 173.698 0.762 25153 1365 1 2 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.405 0.025 25153 1366 1 2 . 1 1 79 79 GLY H H 79 8.474 8.474 8.652 -0.178 25153 1367 1 2 . 1 1 80 80 LYS N N 80 120.295 120.295 117.407 2.888 25153 1368 1 2 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.754 -0.396 25153 1369 1 2 . 1 1 80 80 LYS C C 80 175.360 175.360 175.215 0.145 25153 1370 1 2 . 1 1 80 80 LYS CA C 80 56.970 56.970 54.090 2.880 25153 1371 1 2 . 1 1 80 80 LYS CB C 80 33.200 33.200 35.783 -2.583 25153 1372 1 2 . 1 1 81 81 ILE N N 81 122.400 122.400 121.056 1.344 25153 1373 1 2 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.733 0.060 25153 1374 1 2 . 1 1 81 81 ILE C C 81 174.760 174.760 175.401 -0.641 25153 1375 1 2 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.322 -1.492 25153 1376 1 2 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.207 -0.507 25153 1377 1 2 . 1 1 81 81 ILE H H 81 7.400 7.400 7.908 -0.508 25153 1378 1 2 . 1 1 82 82 VAL N N 82 127.840 127.840 125.177 2.663 25153 1379 1 2 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.986 0.276 25153 1380 1 2 . 1 1 82 82 VAL C C 82 172.724 172.724 174.367 -1.643 25153 1381 1 2 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.674 -0.264 25153 1382 1 2 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.317 0.083 25153 1383 1 2 . 1 1 82 82 VAL H H 82 8.790 8.790 8.773 0.017 25153 1384 1 2 . 1 1 83 83 ALA N N 83 131.347 131.347 129.899 1.448 25153 1385 1 2 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.355 0.027 25153 1386 1 2 . 1 1 83 83 ALA C C 83 175.750 175.750 176.300 -0.550 25153 1387 1 2 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.068 -0.198 25153 1388 1 2 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.939 2.511 25153 1389 1 2 . 1 1 83 83 ALA H H 83 9.300 9.300 8.957 0.343 25153 1390 1 2 . 1 1 84 84 LEU N N 84 124.200 124.200 126.431 -2.231 25153 1391 1 2 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.652 -0.132 25153 1392 1 2 . 1 1 84 84 LEU C C 84 175.760 175.760 176.860 -1.100 25153 1393 1 2 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.864 -0.364 25153 1394 1 2 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.448 1.452 25153 1395 1 2 . 1 1 84 84 LEU H H 84 10.287 10.287 9.053 1.234 25153 1396 1 2 . 1 1 85 85 TYR N N 85 115.912 115.912 119.338 -3.426 25153 1397 1 2 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.345 -0.385 25153 1398 1 2 . 1 1 85 85 TYR C C 85 172.372 172.372 173.875 -1.503 25153 1399 1 2 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.130 0.970 25153 1400 1 2 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.640 1.390 25153 1401 1 2 . 1 1 85 85 TYR H H 85 9.257 9.257 8.947 0.310 25153 1402 1 2 . 1 1 86 86 GLY N N 86 107.800 107.800 105.941 1.859 25153 1403 1 2 . 1 1 86 86 GLY C C 86 170.330 170.330 171.490 -1.160 25153 1404 1 2 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.982 -0.612 25153 1405 1 2 . 1 1 86 86 GLY H H 86 9.027 9.027 8.714 0.313 25153 1406 1 2 . 1 1 87 87 LEU N N 87 123.458 123.458 118.836 4.622 25153 1407 1 2 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.234 0.231 25153 1408 1 2 . 1 1 87 87 LEU C C 87 178.100 178.100 175.896 2.204 25153 1409 1 2 . 1 1 87 87 LEU CA C 87 53.590 53.590 53.081 0.509 25153 1410 1 2 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.556 -0.216 25153 1411 1 2 . 1 1 87 87 LEU H H 87 6.580 6.580 7.774 -1.194 25153 1412 1 2 . 1 1 88 88 GLY N N 88 108.966 108.966 108.093 0.873 25153 1413 1 2 . 1 1 88 88 GLY C C 88 172.820 172.820 171.712 1.108 25153 1414 1 2 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.278 1.382 25153 1415 1 2 . 1 1 88 88 GLY H H 88 8.070 8.070 8.497 -0.427 25153 1416 1 2 . 1 1 89 89 ASP N N 89 121.150 121.150 117.610 3.540 25153 1417 1 2 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.337 -0.091 25153 1418 1 2 . 1 1 89 89 ASP C C 89 176.220 176.220 176.552 -0.332 25153 1419 1 2 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.241 -0.771 25153 1420 1 2 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.951 -1.471 25153 1421 1 2 . 1 1 90 90 GLN N N 90 123.970 123.970 124.626 -0.656 25153 1422 1 2 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.116 -0.628 25153 1423 1 2 . 1 1 90 90 GLN C C 90 173.646 173.646 176.484 -2.838 25153 1424 1 2 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.046 1.264 25153 1425 1 2 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.499 -0.289 25153 1426 1 2 . 1 1 90 90 GLN H H 90 8.623 8.623 8.626 -0.003 25153 1427 1 2 . 1 1 91 91 LEU N N 91 118.017 118.017 120.259 -2.242 25153 1428 1 2 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.027 0.348 25153 1429 1 2 . 1 1 91 91 LEU C C 91 180.160 180.160 178.507 1.653 25153 1430 1 2 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.908 -0.848 25153 1431 1 2 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.919 -0.369 25153 1432 1 2 . 1 1 91 91 LEU H H 91 7.046 7.046 8.642 -1.596 25153 1433 1 2 . 1 1 92 92 GLY N N 92 110.028 110.028 103.343 6.685 25153 1434 1 2 . 1 1 92 92 GLY C C 92 174.912 174.912 174.656 0.256 25153 1435 1 2 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.067 1.113 25153 1436 1 2 . 1 1 92 92 GLY H H 92 9.238 9.238 8.767 0.471 25153 1437 1 2 . 1 1 93 93 TYR N N 93 115.910 115.910 119.437 -3.527 25153 1438 1 2 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.383 -0.374 25153 1439 1 2 . 1 1 93 93 TYR C C 93 176.850 176.850 176.924 -0.074 25153 1440 1 2 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.358 0.372 25153 1441 1 2 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.578 -0.448 25153 1442 1 2 . 1 1 93 93 TYR H H 93 6.962 6.962 7.711 -0.749 25153 1443 1 2 . 1 1 94 94 GLY N N 94 111.630 111.630 110.394 1.236 25153 1444 1 2 . 1 1 94 94 GLY C C 94 177.777 177.777 175.336 2.441 25153 1445 1 2 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.781 2.249 25153 1446 1 2 . 1 1 94 94 GLY H H 94 7.835 7.835 8.238 -0.403 25153 1447 1 2 . 1 1 95 95 GLU N N 95 122.450 122.450 119.027 3.423 25153 1448 1 2 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.910 0.008 25153 1449 1 2 . 1 1 95 95 GLU C C 95 175.300 175.300 176.476 -1.176 25153 1450 1 2 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.165 -0.065 25153 1451 1 2 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.178 -0.667 25153 1452 1 2 . 1 1 96 96 TRP N N 96 118.790 118.790 116.315 2.475 25153 1453 1 2 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.894 0.550 25153 1454 1 2 . 1 1 96 96 TRP C C 96 179.280 179.280 176.030 3.250 25153 1455 1 2 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.879 1.136 25153 1456 1 2 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.264 -0.244 25153 1457 1 2 . 1 1 96 96 TRP H H 96 8.070 8.070 7.886 0.184 25153 1458 1 2 . 1 1 97 97 PHE N N 97 128.067 128.067 124.001 4.066 25153 1459 1 2 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.315 0.990 25153 1460 1 2 . 1 1 97 97 PHE C C 97 173.227 173.227 176.032 -2.805 25153 1461 1 2 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.937 -3.217 25153 1462 1 2 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.460 0.480 25153 1463 1 2 . 1 1 97 97 PHE H H 97 7.165 7.165 8.275 -1.110 25153 1464 1 2 . 1 1 98 98 LEU N N 98 114.306 114.306 122.998 -8.692 25153 1465 1 2 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.688 -0.198 25153 1466 1 2 . 1 1 98 98 LEU C C 98 179.365 179.365 177.767 1.598 25153 1467 1 2 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.739 -0.279 25153 1468 1 2 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.995 -0.765 25153 1469 1 2 . 1 1 98 98 LEU H H 98 7.453 7.453 8.485 -1.032 25153 1470 1 2 . 1 1 99 99 ASP N N 99 122.354 122.354 120.469 1.885 25153 1471 1 2 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.343 -0.410 25153 1472 1 2 . 1 1 99 99 ASP C C 99 178.800 178.800 177.167 1.633 25153 1473 1 2 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.747 1.433 25153 1474 1 2 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.390 -0.960 25153 1475 1 2 . 1 1 100 100 ALA N N 100 118.568 118.568 121.971 -3.403 25153 1476 1 2 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.088 -0.248 25153 1477 1 2 . 1 1 100 100 ALA C C 100 178.500 178.500 179.327 -0.827 25153 1478 1 2 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.955 -0.039 25153 1479 1 2 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.361 1.299 25153 1480 1 2 . 1 1 100 100 ALA H H 100 8.682 8.682 7.656 1.026 25153 1481 1 2 . 1 1 101 101 LEU N N 101 118.815 118.815 120.757 -1.942 25153 1482 1 2 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.994 -0.314 25153 1483 1 2 . 1 1 101 101 LEU C C 101 178.930 178.930 178.881 0.049 25153 1484 1 2 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.800 -0.100 25153 1485 1 2 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.562 0.838 25153 1486 1 2 . 1 1 101 101 LEU H H 101 6.637 6.637 7.471 -0.834 25153 1487 1 2 . 1 1 102 102 GLY N N 102 103.700 103.700 106.555 -2.855 25153 1488 1 2 . 1 1 102 102 GLY C C 102 175.530 175.530 176.123 -0.593 25153 1489 1 2 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.303 0.697 25153 1490 1 2 . 1 1 102 102 GLY H H 102 7.330 7.330 8.027 -0.697 25153 1491 1 2 . 1 1 103 103 MET N N 103 120.330 120.330 121.748 -1.418 25153 1492 1 2 . 1 1 103 103 MET HA H 103 4.254 4.254 4.245 0.009 25153 1493 1 2 . 1 1 103 103 MET C C 103 179.688 179.688 178.638 1.050 25153 1494 1 2 . 1 1 103 103 MET CA C 103 59.615 59.615 59.641 -0.026 25153 1495 1 2 . 1 1 103 103 MET CB C 103 33.290 33.290 32.640 0.650 25153 1496 1 2 . 1 1 103 103 MET H H 103 8.407 8.407 8.184 0.223 25153 1497 1 2 . 1 1 104 104 LEU N N 104 123.450 123.450 119.856 3.594 25153 1498 1 2 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.693 0.503 25153 1499 1 2 . 1 1 104 104 LEU C C 104 177.620 177.620 178.759 -1.139 25153 1500 1 2 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.968 0.002 25153 1501 1 2 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.292 0.008 25153 1502 1 2 . 1 1 104 104 LEU H H 104 8.330 8.330 8.736 -0.406 25153 1503 1 2 . 1 1 105 105 HIS N N 105 119.040 119.040 119.276 -0.236 25153 1504 1 2 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.105 -0.228 25153 1505 1 2 . 1 1 105 105 HIS C C 105 177.100 177.100 177.042 0.058 25153 1506 1 2 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.826 0.144 25153 1507 1 2 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.878 -1.285 25153 1508 1 2 . 1 1 105 105 HIS H H 105 8.050 8.050 8.525 -0.475 25153 1509 1 2 . 1 1 106 106 ASP N N 106 119.950 119.950 119.207 0.743 25153 1510 1 2 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.390 -0.060 25153 1511 1 2 . 1 1 106 106 ASP C C 106 179.300 179.300 178.416 0.884 25153 1512 1 2 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.307 0.503 25153 1513 1 2 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.162 -0.762 25153 1514 1 2 . 1 1 107 107 LYS N N 107 122.060 122.060 120.035 2.025 25153 1515 1 2 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.057 0.076 25153 1516 1 2 . 1 1 107 107 LYS C C 107 178.100 178.100 179.441 -1.341 25153 1517 1 2 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.707 -0.507 25153 1518 1 2 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.158 0.202 25153 1519 1 2 . 1 1 108 108 LEU N N 108 115.610 115.610 117.906 -2.296 25153 1520 1 2 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.125 -0.057 25153 1521 1 2 . 1 1 108 108 LEU C C 108 178.866 178.866 178.232 0.634 25153 1522 1 2 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.839 -0.885 25153 1523 1 2 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.520 0.640 25153 1524 1 2 . 1 1 108 108 LEU H H 108 7.828 7.828 8.465 -0.637 25153 1525 1 2 . 1 1 109 109 SER N N 109 116.362 116.362 114.954 1.408 25153 1526 1 2 . 1 1 109 109 SER HA H 109 4.299 4.299 4.305 -0.006 25153 1527 1 2 . 1 1 109 109 SER C C 109 175.660 175.660 176.852 -1.192 25153 1528 1 2 . 1 1 109 109 SER CA C 109 62.350 62.350 61.444 0.906 25153 1529 1 2 . 1 1 109 109 SER CB C 109 62.815 62.815 63.126 -0.311 25153 1530 1 2 . 1 1 109 109 SER H H 109 8.278 8.278 8.582 -0.304 25153 1531 1 2 . 1 1 110 110 THR N N 110 110.230 110.230 115.770 -5.540 25153 1532 1 2 . 1 1 110 110 THR HA H 110 4.615 4.615 4.248 0.367 25153 1533 1 2 . 1 1 110 110 THR C C 110 175.990 175.990 175.189 0.801 25153 1534 1 2 . 1 1 110 110 THR CA C 110 62.090 62.090 63.942 -1.852 25153 1535 1 2 . 1 1 110 110 THR CB C 110 68.800 68.800 68.903 -0.103 25153 1536 1 2 . 1 1 110 110 THR H H 110 7.211 7.211 7.839 -0.628 25153 1537 1 2 . 1 1 111 111 LYS N N 111 119.900 119.900 118.402 1.498 25153 1538 1 2 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.405 0.107 25153 1539 1 2 . 1 1 111 111 LYS C C 111 176.916 176.916 176.775 0.141 25153 1540 1 2 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.400 0.254 25153 1541 1 2 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.723 -0.880 25153 1542 1 2 . 1 1 112 112 GLY N N 112 107.910 107.910 108.081 -0.171 25153 1543 1 2 . 1 1 112 112 GLY C C 112 176.250 176.250 174.082 2.168 25153 1544 1 2 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.690 1.350 25153 1545 1 2 . 1 1 112 112 GLY H H 112 8.366 8.366 7.566 0.800 25153 1546 1 2 . 1 1 113 113 VAL N N 113 113.530 113.530 114.352 -0.822 25153 1547 1 2 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.424 0.050 25153 1548 1 2 . 1 1 113 113 VAL C C 113 174.630 174.630 174.791 -0.161 25153 1549 1 2 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.597 -1.147 25153 1550 1 2 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.843 -0.293 25153 1551 1 2 . 1 1 113 113 VAL H H 113 6.903 6.903 6.929 -0.026 25153 1552 1 2 . 1 1 114 114 LYS N N 114 123.020 123.020 119.597 3.423 25153 1553 1 2 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.577 -0.072 25153 1554 1 2 . 1 1 114 114 LYS C C 114 175.000 175.000 174.722 0.278 25153 1555 1 2 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.695 -0.495 25153 1556 1 2 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.591 -1.251 25153 1557 1 2 . 1 1 115 115 PHE N N 115 123.290 123.290 120.733 2.557 25153 1558 1 2 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.756 -0.043 25153 1559 1 2 . 1 1 115 115 PHE C C 115 177.605 177.605 176.412 1.193 25153 1560 1 2 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.802 1.808 25153 1561 1 2 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.886 -0.886 25153 1562 1 2 . 1 1 115 115 PHE H H 115 8.494 8.494 8.539 -0.045 25153 1563 1 2 . 1 1 116 116 VAL N N 116 115.790 115.790 115.452 0.338 25153 1564 1 2 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.238 0.254 25153 1565 1 2 . 1 1 116 116 VAL C C 116 175.414 175.414 175.855 -0.441 25153 1566 1 2 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.488 -0.502 25153 1567 1 2 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.515 -0.415 25153 1568 1 2 . 1 1 116 116 VAL H H 116 8.889 8.889 8.500 0.389 25153 1569 1 2 . 1 1 117 117 GLY N N 117 108.300 108.300 107.964 0.336 25153 1570 1 2 . 1 1 117 117 GLY C C 117 176.180 176.180 174.670 1.510 25153 1571 1 2 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.494 2.306 25153 1572 1 2 . 1 1 117 117 GLY H H 117 9.810 9.810 8.585 1.225 25153 1573 1 2 . 1 1 118 118 TYR N N 118 120.050 120.050 119.397 0.653 25153 1574 1 2 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.825 0.129 25153 1575 1 2 . 1 1 118 118 TYR C C 118 177.450 177.450 175.937 1.513 25153 1576 1 2 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.304 -1.064 25153 1577 1 2 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.341 -3.231 25153 1578 1 2 . 1 1 118 118 TYR H H 118 8.592 8.592 7.442 1.150 25153 1579 1 2 . 1 1 119 119 TRP N N 119 125.500 125.500 121.259 4.241 25153 1580 1 2 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.128 0.900 25153 1581 1 2 . 1 1 119 119 TRP C C 119 173.090 173.090 174.178 -1.088 25153 1582 1 2 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.366 -0.466 25153 1583 1 2 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.019 3.231 25153 1584 1 2 . 1 1 119 119 TRP H H 119 7.926 7.926 8.213 -0.287 25153 1585 1 2 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.679 0.131 25153 1586 1 2 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.729 0.951 25153 1587 1 2 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.180 0.070 25153 1588 1 2 . 1 1 121 121 THR N N 121 109.114 109.114 112.414 -3.300 25153 1589 1 2 . 1 1 121 121 THR HA H 121 4.142 4.142 3.468 0.674 25153 1590 1 2 . 1 1 121 121 THR C C 121 176.300 176.300 175.085 1.215 25153 1591 1 2 . 1 1 121 121 THR CA C 121 61.230 61.230 62.910 -1.680 25153 1592 1 2 . 1 1 121 121 THR CB C 121 69.890 69.890 68.577 1.313 25153 1593 1 2 . 1 1 121 121 THR H H 121 7.356 7.356 8.273 -0.917 25153 1594 1 2 . 1 1 122 122 GLU N N 122 123.980 123.980 122.776 1.204 25153 1595 1 2 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.149 0.089 25153 1596 1 2 . 1 1 122 122 GLU C C 122 177.830 177.830 177.932 -0.102 25153 1597 1 2 . 1 1 122 122 GLU CA C 122 58.230 58.230 58.384 -0.154 25153 1598 1 2 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.840 -0.070 25153 1599 1 2 . 1 1 123 123 GLY N N 123 114.570 114.570 112.012 2.558 25153 1600 1 2 . 1 1 123 123 GLY C C 123 173.700 173.700 174.258 -0.558 25153 1601 1 2 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.482 -0.082 25153 1602 1 2 . 1 1 123 123 GLY H H 123 9.181 9.181 8.711 0.470 25153 1603 1 2 . 1 1 124 124 TYR N N 124 118.923 118.923 121.608 -2.685 25153 1604 1 2 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.707 0.603 25153 1605 1 2 . 1 1 124 124 TYR C C 124 175.680 175.680 175.105 0.575 25153 1606 1 2 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.231 -0.761 25153 1607 1 2 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.723 0.277 25153 1608 1 2 . 1 1 124 124 TYR H H 124 7.877 7.877 7.854 0.023 25153 1609 1 2 . 1 1 125 125 GLU N N 125 124.890 124.890 121.369 3.521 25153 1610 1 2 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.697 0.003 25153 1611 1 2 . 1 1 125 125 GLU C C 125 172.880 172.880 174.971 -2.091 25153 1612 1 2 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.343 0.087 25153 1613 1 2 . 1 1 125 125 GLU CB C 125 31.420 31.420 30.976 0.444 25153 1614 1 2 . 1 1 126 126 PHE N N 126 119.166 119.166 119.427 -0.261 25153 1615 1 2 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.617 0.192 25153 1616 1 2 . 1 1 126 126 PHE C C 126 173.750 173.750 174.930 -1.180 25153 1617 1 2 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.681 -1.891 25153 1618 1 2 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.537 0.513 25153 1619 1 2 . 1 1 126 126 PHE H H 126 7.716 7.716 8.314 -0.598 25153 1620 1 2 . 1 1 127 127 THR N N 127 106.800 106.800 112.919 -6.119 25153 1621 1 2 . 1 1 127 127 THR HA H 127 4.400 4.400 3.336 1.064 25153 1622 1 2 . 1 1 127 127 THR C C 127 175.300 175.300 174.013 1.287 25153 1623 1 2 . 1 1 127 127 THR CA C 127 61.100 61.100 62.956 -1.857 25153 1624 1 2 . 1 1 127 127 THR CB C 127 70.600 70.600 67.939 2.661 25153 1625 1 2 . 1 1 127 127 THR H H 127 7.220 7.220 6.575 0.645 25153 1626 1 2 . 1 1 128 128 SER N N 128 118.360 118.360 115.560 2.800 25153 1627 1 2 . 1 1 128 128 SER HA H 128 4.680 4.680 4.679 0.001 25153 1628 1 2 . 1 1 128 128 SER C C 128 175.720 175.720 173.612 2.108 25153 1629 1 2 . 1 1 128 128 SER CA C 128 56.250 56.250 56.624 -0.374 25153 1630 1 2 . 1 1 128 128 SER CB C 128 65.635 65.635 64.519 1.117 25153 1631 1 2 . 1 1 128 128 SER H H 128 7.411 7.411 7.897 -0.486 25153 1632 1 2 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.601 0.174 25153 1633 1 2 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.154 -1.654 25153 1634 1 2 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.337 0.063 25153 1635 1 2 . 1 1 130 130 LYS N N 130 122.014 122.014 119.127 2.887 25153 1636 1 2 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.466 -0.233 25153 1637 1 2 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.050 3.650 25153 1638 1 2 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.361 0.209 25153 1639 1 2 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.546 -0.028 25153 1640 1 2 . 1 1 131 131 PRO C C 131 174.000 174.000 175.100 -1.100 25153 1641 1 2 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.755 1.945 25153 1642 1 2 . 1 1 131 131 PRO CB C 131 31.200 31.200 29.977 1.223 25153 1643 1 2 . 1 1 132 132 VAL N N 132 113.260 113.260 116.109 -2.849 25153 1644 1 2 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.894 0.306 25153 1645 1 2 . 1 1 132 132 VAL C C 132 175.210 175.210 174.816 0.394 25153 1646 1 2 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.117 -0.497 25153 1647 1 2 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.091 -1.111 25153 1648 1 2 . 1 1 132 132 VAL H H 132 6.697 6.697 7.539 -0.842 25153 1649 1 2 . 1 1 133 133 ILE N N 133 119.940 119.940 117.832 2.108 25153 1650 1 2 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.462 -0.082 25153 1651 1 2 . 1 1 133 133 ILE C C 133 175.440 175.440 175.207 0.233 25153 1652 1 2 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.956 1.494 25153 1653 1 2 . 1 1 133 133 ILE CB C 133 42.100 42.100 39.922 2.178 25153 1654 1 2 . 1 1 133 133 ILE H H 133 8.756 8.756 8.608 0.148 25153 1655 1 2 . 1 1 134 134 ALA N N 134 122.632 122.632 123.903 -1.271 25153 1656 1 2 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.903 0.057 25153 1657 1 2 . 1 1 134 134 ALA C C 134 178.312 178.312 177.226 1.086 25153 1658 1 2 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.594 -1.514 25153 1659 1 2 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.212 -0.376 25153 1660 1 2 . 1 1 134 134 ALA H H 134 8.523 8.523 8.456 0.067 25153 1661 1 2 . 1 1 135 135 ASP N N 135 117.366 117.366 122.677 -5.311 25153 1662 1 2 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.666 -0.414 25153 1663 1 2 . 1 1 135 135 ASP C C 135 176.387 176.387 176.645 -0.258 25153 1664 1 2 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.360 1.850 25153 1665 1 2 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.216 -1.516 25153 1666 1 2 . 1 1 136 136 GLY N N 136 104.310 104.310 108.062 -3.752 25153 1667 1 2 . 1 1 136 136 GLY C C 136 174.922 174.922 174.961 -0.039 25153 1668 1 2 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.400 -0.300 25153 1669 1 2 . 1 1 136 136 GLY H H 136 7.610 7.610 8.334 -0.724 25153 1670 1 2 . 1 1 137 137 GLN N N 137 118.784 118.784 117.786 0.998 25153 1671 1 2 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.446 -0.391 25153 1672 1 2 . 1 1 137 137 GLN C C 137 176.390 176.390 175.441 0.949 25153 1673 1 2 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.797 1.843 25153 1674 1 2 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.241 -0.011 25153 1675 1 2 . 1 1 137 137 GLN H H 137 7.870 7.870 7.908 -0.038 25153 1676 1 2 . 1 1 138 138 LEU N N 138 118.040 118.040 115.826 2.214 25153 1677 1 2 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.034 -0.047 25153 1678 1 2 . 1 1 138 138 LEU C C 138 175.913 175.913 175.044 0.869 25153 1679 1 2 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.191 0.409 25153 1680 1 2 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.956 1.444 25153 1681 1 2 . 1 1 138 138 LEU H H 138 7.356 7.356 7.173 0.183 25153 1682 1 2 . 1 1 139 139 PHE N N 139 119.060 119.060 119.533 -0.473 25153 1683 1 2 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.948 0.362 25153 1684 1 2 . 1 1 139 139 PHE C C 139 178.780 178.780 177.555 1.225 25153 1685 1 2 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.939 -0.089 25153 1686 1 2 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.986 3.474 25153 1687 1 2 . 1 1 139 139 PHE H H 139 10.094 10.094 8.902 1.192 25153 1688 1 2 . 1 1 140 140 VAL N N 140 109.690 109.690 116.150 -6.460 25153 1689 1 2 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.483 -0.002 25153 1690 1 2 . 1 1 140 140 VAL C C 140 172.790 172.790 175.703 -2.913 25153 1691 1 2 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.745 -1.745 25153 1692 1 2 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.186 -0.636 25153 1693 1 2 . 1 1 140 140 VAL H H 140 7.470 7.470 8.167 -0.697 25153 1694 1 2 . 1 1 141 141 GLY N N 141 107.060 107.060 105.359 1.701 25153 1695 1 2 . 1 1 141 141 GLY C C 141 171.513 171.513 172.575 -1.062 25153 1696 1 2 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.576 0.854 25153 1697 1 2 . 1 1 141 141 GLY H H 141 7.137 7.137 7.378 -0.241 25153 1698 1 2 . 1 1 142 142 LEU N N 142 117.863 117.863 120.583 -2.720 25153 1699 1 2 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.105 -1.130 25153 1700 1 2 . 1 1 142 142 LEU C C 142 173.640 173.640 175.131 -1.491 25153 1701 1 2 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.536 1.384 25153 1702 1 2 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.331 -4.781 25153 1703 1 2 . 1 1 142 142 LEU H H 142 7.517 7.517 7.730 -0.213 25153 1704 1 2 . 1 1 143 143 ALA N N 143 126.990 126.990 128.369 -1.379 25153 1705 1 2 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.827 -0.550 25153 1706 1 2 . 1 1 143 143 ALA C C 143 175.730 175.730 176.213 -0.483 25153 1707 1 2 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.139 -0.699 25153 1708 1 2 . 1 1 143 143 ALA CB C 143 23.310 23.310 20.134 3.176 25153 1709 1 2 . 1 1 143 143 ALA H H 143 5.186 5.186 8.199 -3.013 25153 1710 1 2 . 1 1 144 144 LEU N N 144 125.477 125.477 124.123 1.354 25153 1711 1 2 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.600 0.180 25153 1712 1 2 . 1 1 144 144 LEU C C 144 174.473 174.473 175.199 -0.726 25153 1713 1 2 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.849 -0.609 25153 1714 1 2 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.254 0.046 25153 1715 1 2 . 1 1 144 144 LEU H H 144 8.758 8.758 8.317 0.441 25153 1716 1 2 . 1 1 145 145 ASP N N 145 118.915 118.915 119.773 -0.858 25153 1717 1 2 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.498 0.034 25153 1718 1 2 . 1 1 145 145 ASP C C 145 176.470 176.470 176.344 0.126 25153 1719 1 2 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.676 -1.046 25153 1720 1 2 . 1 1 145 145 ASP CB C 145 43.000 43.000 42.996 0.004 25153 1721 1 2 . 1 1 146 146 GLU N N 146 124.813 124.813 123.228 1.585 25153 1722 1 2 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.365 0.011 25153 1723 1 2 . 1 1 146 146 GLU C C 146 177.290 177.290 176.827 0.463 25153 1724 1 2 . 1 1 146 146 GLU CA C 146 56.120 56.120 57.238 -1.118 25153 1725 1 2 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.027 1.123 25153 1726 1 2 . 1 1 147 147 THR N N 147 118.328 118.328 113.361 4.967 25153 1727 1 2 . 1 1 147 147 THR HA H 147 4.200 4.200 4.442 -0.242 25153 1728 1 2 . 1 1 147 147 THR C C 147 175.683 175.683 174.555 1.128 25153 1729 1 2 . 1 1 147 147 THR CA C 147 66.250 66.250 63.737 2.513 25153 1730 1 2 . 1 1 147 147 THR CB C 147 69.600 69.600 69.073 0.527 25153 1731 1 2 . 1 1 147 147 THR H H 147 8.562 8.562 8.353 0.209 25153 1732 1 2 . 1 1 148 148 ASN N N 148 115.550 115.550 115.072 0.478 25153 1733 1 2 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.655 0.332 25153 1734 1 2 . 1 1 148 148 ASN C C 148 175.870 175.870 176.557 -0.687 25153 1735 1 2 . 1 1 148 148 ASN CA C 148 53.700 53.700 53.447 0.253 25153 1736 1 2 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.370 2.510 25153 1737 1 2 . 1 1 148 148 ASN H H 148 9.118 9.118 7.552 1.566 25153 1738 1 2 . 1 1 149 149 GLN N N 149 117.400 117.400 119.602 -2.202 25153 1739 1 2 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.258 0.586 25153 1740 1 2 . 1 1 149 149 GLN C C 149 177.780 177.780 176.846 0.934 25153 1741 1 2 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.013 -2.113 25153 1742 1 2 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.049 1.251 25153 1743 1 2 . 1 1 149 149 GLN H H 149 7.555 7.555 8.163 -0.608 25153 1744 1 2 . 1 1 150 150 TYR N N 150 120.674 120.674 118.182 2.492 25153 1745 1 2 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.158 0.370 25153 1746 1 2 . 1 1 150 150 TYR C C 150 177.830 177.830 176.511 1.319 25153 1747 1 2 . 1 1 150 150 TYR CA C 150 58.487 58.487 59.141 -0.654 25153 1748 1 2 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.838 -0.238 25153 1749 1 2 . 1 1 150 150 TYR H H 150 6.983 6.983 7.439 -0.456 25153 1750 1 2 . 1 1 151 151 ASP N N 151 120.810 120.810 119.696 1.114 25153 1751 1 2 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.663 -0.148 25153 1752 1 2 . 1 1 151 151 ASP C C 151 176.400 176.400 177.192 -0.792 25153 1753 1 2 . 1 1 151 151 ASP CA C 151 55.400 55.400 56.021 -0.621 25153 1754 1 2 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.391 -2.311 25153 1755 1 2 . 1 1 152 152 LEU N N 152 118.083 118.083 111.940 6.143 25153 1756 1 2 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.708 -0.032 25153 1757 1 2 . 1 1 152 152 LEU C C 152 178.470 178.470 178.284 0.186 25153 1758 1 2 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.633 -1.033 25153 1759 1 2 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.110 -0.510 25153 1760 1 2 . 1 1 152 152 LEU H H 152 7.453 7.453 7.483 -0.030 25153 1761 1 2 . 1 1 153 153 SER N N 153 116.407 116.407 119.024 -2.617 25153 1762 1 2 . 1 1 153 153 SER HA H 153 3.960 3.960 4.032 -0.072 25153 1763 1 2 . 1 1 153 153 SER C C 153 174.590 174.590 175.728 -1.138 25153 1764 1 2 . 1 1 153 153 SER CA C 153 63.400 63.400 63.789 -0.389 25153 1765 1 2 . 1 1 153 153 SER CB C 153 63.100 63.100 62.706 0.394 25153 1766 1 2 . 1 1 153 153 SER H H 153 7.360 7.360 8.686 -1.326 25153 1767 1 2 . 1 1 154 154 ASP N N 154 121.960 121.960 120.398 1.562 25153 1768 1 2 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.342 -0.032 25153 1769 1 2 . 1 1 154 154 ASP C C 154 178.640 178.640 177.698 0.942 25153 1770 1 2 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.452 1.548 25153 1771 1 2 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.936 -1.366 25153 1772 1 2 . 1 1 155 155 GLU N N 155 121.310 121.310 118.824 2.486 25153 1773 1 2 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.115 0.070 25153 1774 1 2 . 1 1 155 155 GLU C C 155 179.600 179.600 178.845 0.755 25153 1775 1 2 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.904 0.546 25153 1776 1 2 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.618 -0.218 25153 1777 1 2 . 1 1 156 156 ARG N N 156 121.394 121.394 120.429 0.965 25153 1778 1 2 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.239 0.061 25153 1779 1 2 . 1 1 156 156 ARG C C 156 177.330 177.330 178.940 -1.610 25153 1780 1 2 . 1 1 156 156 ARG CA C 156 60.460 60.460 59.073 1.387 25153 1781 1 2 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.254 0.506 25153 1782 1 2 . 1 1 157 157 ILE N N 157 118.390 118.390 120.872 -2.482 25153 1783 1 2 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.679 -0.245 25153 1784 1 2 . 1 1 157 157 ILE C C 157 178.814 178.814 177.710 1.104 25153 1785 1 2 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.715 0.979 25153 1786 1 2 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.914 0.938 25153 1787 1 2 . 1 1 157 157 ILE H H 157 8.966 8.966 8.227 0.739 25153 1788 1 2 . 1 1 158 158 GLN N N 158 120.060 120.060 118.920 1.140 25153 1789 1 2 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.986 -0.030 25153 1790 1 2 . 1 1 158 158 GLN C C 158 178.843 178.843 178.521 0.322 25153 1791 1 2 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.324 1.276 25153 1792 1 2 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.240 0.150 25153 1793 1 2 . 1 1 158 158 GLN H H 158 8.394 8.394 7.964 0.430 25153 1794 1 2 . 1 1 159 159 SER N N 159 115.613 115.613 117.263 -1.650 25153 1795 1 2 . 1 1 159 159 SER HA H 159 4.455 4.455 4.490 -0.035 25153 1796 1 2 . 1 1 159 159 SER C C 159 177.330 177.330 176.461 0.869 25153 1797 1 2 . 1 1 159 159 SER CA C 159 62.400 62.400 62.400 0.000 25153 1798 1 2 . 1 1 159 159 SER CB C 159 63.760 63.760 63.110 0.650 25153 1799 1 2 . 1 1 159 159 SER H H 159 8.460 8.460 8.327 0.133 25153 1800 1 2 . 1 1 160 160 TRP N N 160 126.820 126.820 124.582 2.238 25153 1801 1 2 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.144 0.321 25153 1802 1 2 . 1 1 160 160 TRP C C 160 178.050 178.050 177.423 0.627 25153 1803 1 2 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.598 1.102 25153 1804 1 2 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.314 0.046 25153 1805 1 2 . 1 1 160 160 TRP H H 160 9.318 9.318 8.277 1.041 25153 1806 1 2 . 1 1 161 161 CYS N N 161 116.750 116.750 118.061 -1.311 25153 1807 1 2 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.744 0.139 25153 1808 1 2 . 1 1 161 161 CYS C C 161 176.270 176.270 176.741 -0.471 25153 1809 1 2 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.109 1.251 25153 1810 1 2 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.993 0.887 25153 1811 1 2 . 1 1 161 161 CYS H H 161 8.950 8.950 8.974 -0.024 25153 1812 1 2 . 1 1 162 162 GLU N N 162 118.096 118.096 120.380 -2.284 25153 1813 1 2 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.035 -0.104 25153 1814 1 2 . 1 1 162 162 GLU C C 162 178.680 178.680 177.478 1.202 25153 1815 1 2 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.320 0.410 25153 1816 1 2 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.439 -0.009 25153 1817 1 2 . 1 1 163 163 GLN N N 163 120.790 120.790 117.725 3.065 25153 1818 1 2 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.121 0.056 25153 1819 1 2 . 1 1 163 163 GLN C C 163 179.690 179.690 178.257 1.433 25153 1820 1 2 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.739 1.802 25153 1821 1 2 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.166 -0.166 25153 1822 1 2 . 1 1 163 163 GLN H H 163 8.205 8.205 7.513 0.692 25153 1823 1 2 . 1 1 164 164 ILE N N 164 114.860 114.860 118.966 -4.106 25153 1824 1 2 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.851 0.192 25153 1825 1 2 . 1 1 164 164 ILE C C 164 178.680 178.680 177.256 1.424 25153 1826 1 2 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.003 2.207 25153 1827 1 2 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.623 0.077 25153 1828 1 2 . 1 1 164 164 ILE H H 164 9.005 9.005 7.942 1.063 25153 1829 1 2 . 1 1 165 165 LEU N N 165 123.900 123.900 116.914 6.986 25153 1830 1 2 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.199 -0.049 25153 1831 1 2 . 1 1 165 165 LEU C C 165 180.520 180.520 177.583 2.937 25153 1832 1 2 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.090 1.210 25153 1833 1 2 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.081 -0.031 25153 1834 1 2 . 1 1 165 165 LEU H H 165 7.825 7.825 8.019 -0.194 25153 1835 1 2 . 1 1 166 166 ASN N N 166 120.112 120.112 118.147 1.965 25153 1836 1 2 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.651 -0.068 25153 1837 1 2 . 1 1 166 166 ASN C C 166 178.440 178.440 177.193 1.247 25153 1838 1 2 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.392 1.028 25153 1839 1 2 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.657 -1.237 25153 1840 1 2 . 1 1 166 166 ASN H H 166 7.760 7.760 7.994 -0.234 25153 1841 1 2 . 1 1 167 167 GLU N N 167 121.370 121.370 120.178 1.192 25153 1842 1 2 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.053 0.050 25153 1843 1 2 . 1 1 167 167 GLU C C 167 180.332 180.332 178.508 1.824 25153 1844 1 2 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.127 1.023 25153 1845 1 2 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.608 1.412 25153 1846 1 2 . 1 1 168 168 MET N N 168 118.532 118.532 116.762 1.770 25153 1847 1 2 . 1 1 168 168 MET HA H 168 4.015 4.015 4.460 -0.445 25153 1848 1 2 . 1 1 168 168 MET C C 168 176.600 176.600 177.647 -1.047 25153 1849 1 2 . 1 1 168 168 MET CA C 168 59.300 59.300 58.534 0.766 25153 1850 1 2 . 1 1 168 168 MET CB C 168 33.400 33.400 33.306 0.094 25153 1851 1 2 . 1 1 168 168 MET H H 168 8.718 8.718 8.329 0.389 25153 1852 1 2 . 1 1 169 169 ALA N N 169 121.922 121.922 122.526 -0.604 25153 1853 1 2 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.210 -0.036 25153 1854 1 2 . 1 1 169 169 ALA C C 169 179.410 179.410 179.779 -0.369 25153 1855 1 2 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.883 -0.483 25153 1856 1 2 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.507 -0.097 25153 1857 1 2 . 1 1 169 169 ALA H H 169 7.448 7.448 7.912 -0.464 25153 1858 1 2 . 1 1 170 170 GLU N N 170 117.300 117.300 117.476 -0.176 25153 1859 1 2 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.091 0.004 25153 1860 1 2 . 1 1 170 170 GLU C C 170 177.470 177.470 178.368 -0.898 25153 1861 1 2 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.641 -0.691 25153 1862 1 2 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.383 0.392 25153 1863 1 2 . 1 1 171 171 HIS N N 171 117.944 117.944 117.944 0.000 25153 1864 1 2 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.415 0.085 25153 1865 1 2 . 1 1 171 171 HIS C C 171 175.120 175.120 176.718 -1.598 25153 1866 1 2 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.106 -0.906 25153 1867 1 2 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.007 0.593 25153 1868 1 2 . 1 1 171 171 HIS H H 171 7.788 7.788 7.914 -0.126 25153 1869 1 2 . 1 1 172 172 TYR N N 172 120.040 120.040 118.908 1.132 25153 1870 1 2 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.379 0.214 25153 1871 1 2 . 1 1 172 172 TYR C C 172 174.612 174.612 175.957 -1.345 25153 1872 1 2 . 1 1 172 172 TYR CA C 172 57.980 57.980 59.011 -1.031 25153 1873 1 2 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.923 0.057 25153 1874 1 2 . 1 1 172 172 TYR H H 172 7.820 7.820 8.039 -0.219 25153 1875 1 3 . 1 1 2 2 ASN N N 2 123.320 123.320 119.637 3.683 25153 1876 1 3 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.086 0.122 25153 1877 1 3 . 1 1 2 2 ASN C C 2 174.590 174.590 174.425 0.165 25153 1878 1 3 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.718 0.282 25153 1879 1 3 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.239 -0.269 25153 1880 1 3 . 1 1 2 2 ASN H H 2 9.428 9.428 8.638 0.790 25153 1881 1 3 . 1 1 3 3 MET N N 3 120.920 120.920 118.791 2.129 25153 1882 1 3 . 1 1 3 3 MET HA H 3 5.530 5.530 5.305 0.225 25153 1883 1 3 . 1 1 3 3 MET C C 3 174.400 174.400 174.881 -0.481 25153 1884 1 3 . 1 1 3 3 MET CA C 3 54.643 54.643 54.249 0.394 25153 1885 1 3 . 1 1 3 3 MET CB C 3 34.637 34.637 37.663 -3.026 25153 1886 1 3 . 1 1 3 3 MET H H 3 8.751 8.751 9.142 -0.391 25153 1887 1 3 . 1 1 4 4 GLY N N 4 115.542 115.542 109.059 6.483 25153 1888 1 3 . 1 1 4 4 GLY C C 4 170.413 170.413 172.125 -1.712 25153 1889 1 3 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.810 -0.708 25153 1890 1 3 . 1 1 4 4 GLY H H 4 8.927 8.927 8.802 0.125 25153 1891 1 3 . 1 1 5 5 LEU N N 5 131.030 131.030 128.158 2.872 25153 1892 1 3 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.255 1.147 25153 1893 1 3 . 1 1 5 5 LEU C C 5 175.952 175.952 174.563 1.389 25153 1894 1 3 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.489 0.961 25153 1895 1 3 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.739 2.853 25153 1896 1 3 . 1 1 5 5 LEU H H 5 8.928 8.928 8.639 0.289 25153 1897 1 3 . 1 1 6 6 PHE N N 6 125.790 125.790 126.568 -0.778 25153 1898 1 3 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.759 -0.019 25153 1899 1 3 . 1 1 6 6 PHE C C 6 174.300 174.300 175.904 -1.604 25153 1900 1 3 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.432 -1.112 25153 1901 1 3 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.531 -0.301 25153 1902 1 3 . 1 1 6 6 PHE H H 6 9.237 9.237 9.538 -0.301 25153 1903 1 3 . 1 1 7 7 TYR N N 7 117.289 117.289 116.936 0.353 25153 1904 1 3 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.948 0.017 25153 1905 1 3 . 1 1 7 7 TYR C C 7 171.262 171.262 173.399 -2.137 25153 1906 1 3 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.393 -0.993 25153 1907 1 3 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.116 0.124 25153 1908 1 3 . 1 1 7 7 TYR H H 7 8.125 8.125 8.222 -0.097 25153 1909 1 3 . 1 1 8 8 GLY N N 8 107.420 107.420 105.673 1.747 25153 1910 1 3 . 1 1 8 8 GLY C C 8 172.000 172.000 172.263 -0.263 25153 1911 1 3 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.566 -0.622 25153 1912 1 3 . 1 1 8 8 GLY H H 8 7.031 7.031 8.440 -1.409 25153 1913 1 3 . 1 1 9 9 SER N N 9 118.150 118.150 116.391 1.759 25153 1914 1 3 . 1 1 9 9 SER HA H 9 5.200 5.200 5.128 0.072 25153 1915 1 3 . 1 1 9 9 SER C C 9 175.000 175.000 174.485 0.515 25153 1916 1 3 . 1 1 9 9 SER CA C 9 57.570 57.570 57.262 0.308 25153 1917 1 3 . 1 1 9 9 SER CB C 9 66.700 66.700 65.117 1.583 25153 1918 1 3 . 1 1 9 9 SER H H 9 9.604 9.604 8.566 1.038 25153 1919 1 3 . 1 1 10 10 SER N N 10 131.193 131.193 120.710 10.483 25153 1920 1 3 . 1 1 10 10 SER HA H 10 4.775 4.775 4.683 0.092 25153 1921 1 3 . 1 1 10 10 SER C C 10 175.730 175.730 176.222 -0.492 25153 1922 1 3 . 1 1 10 10 SER CA C 10 61.750 61.750 59.697 2.053 25153 1923 1 3 . 1 1 10 10 SER CB C 10 64.400 64.400 63.781 0.619 25153 1924 1 3 . 1 1 10 10 SER H H 10 11.636 11.636 9.071 2.565 25153 1925 1 3 . 1 1 11 11 THR N N 11 115.848 115.848 113.824 2.024 25153 1926 1 3 . 1 1 11 11 THR HA H 11 4.770 4.770 4.267 0.503 25153 1927 1 3 . 1 1 11 11 THR C C 11 173.700 173.700 174.383 -0.683 25153 1928 1 3 . 1 1 11 11 THR CA C 11 60.700 60.700 62.184 -1.484 25153 1929 1 3 . 1 1 11 11 THR CB C 11 67.430 67.430 68.355 -0.925 25153 1930 1 3 . 1 1 11 11 THR H H 11 9.550 9.550 8.191 1.359 25153 1931 1 3 . 1 1 12 12 CYS N N 12 109.780 109.780 116.849 -7.069 25153 1932 1 3 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.067 0.003 25153 1933 1 3 . 1 1 12 12 CYS C C 12 176.220 176.220 175.025 1.195 25153 1934 1 3 . 1 1 12 12 CYS CA C 12 63.600 63.600 61.317 2.283 25153 1935 1 3 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.523 0.877 25153 1936 1 3 . 1 1 12 12 CYS H H 12 7.437 7.437 8.045 -0.608 25153 1937 1 3 . 1 1 13 13 TYR N N 13 127.830 127.830 120.062 7.768 25153 1938 1 3 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.267 -0.164 25153 1939 1 3 . 1 1 13 13 TYR C C 13 180.880 180.880 177.734 3.146 25153 1940 1 3 . 1 1 13 13 TYR CA C 13 65.100 65.100 59.319 5.781 25153 1941 1 3 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.362 -0.527 25153 1942 1 3 . 1 1 13 13 TYR H H 13 10.886 10.886 7.490 3.396 25153 1943 1 3 . 1 1 14 14 THR N N 14 124.428 124.428 112.650 11.778 25153 1944 1 3 . 1 1 14 14 THR HA H 14 4.160 4.160 4.185 -0.025 25153 1945 1 3 . 1 1 14 14 THR C C 14 177.760 177.760 176.276 1.484 25153 1946 1 3 . 1 1 14 14 THR CA C 14 67.823 67.823 66.336 1.487 25153 1947 1 3 . 1 1 14 14 THR CB C 14 68.040 68.040 68.397 -0.357 25153 1948 1 3 . 1 1 14 14 THR H H 14 11.405 11.405 8.057 3.348 25153 1949 1 3 . 1 1 15 15 GLU N N 15 123.050 123.050 123.223 -0.173 25153 1950 1 3 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.161 -0.271 25153 1951 1 3 . 1 1 15 15 GLU C C 15 176.392 176.392 178.474 -2.082 25153 1952 1 3 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.441 -0.240 25153 1953 1 3 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.279 1.171 25153 1954 1 3 . 1 1 16 16 MET N N 16 120.173 120.173 118.445 1.728 25153 1955 1 3 . 1 1 16 16 MET HA H 16 4.050 4.050 4.145 -0.095 25153 1956 1 3 . 1 1 16 16 MET C C 16 179.940 179.940 178.691 1.249 25153 1957 1 3 . 1 1 16 16 MET CA C 16 59.240 59.240 59.216 0.024 25153 1958 1 3 . 1 1 16 16 MET CB C 16 32.970 32.970 32.825 0.145 25153 1959 1 3 . 1 1 16 16 MET H H 16 8.469 8.469 8.437 0.032 25153 1960 1 3 . 1 1 17 17 ALA N N 17 121.930 121.930 121.728 0.202 25153 1961 1 3 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.852 -0.016 25153 1962 1 3 . 1 1 17 17 ALA C C 17 177.900 177.900 178.704 -0.804 25153 1963 1 3 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.141 0.059 25153 1964 1 3 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.069 -0.069 25153 1965 1 3 . 1 1 17 17 ALA H H 17 7.880 7.880 8.054 -0.174 25153 1966 1 3 . 1 1 18 18 ALA N N 18 121.477 121.477 121.468 0.009 25153 1967 1 3 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.789 -0.052 25153 1968 1 3 . 1 1 18 18 ALA C C 18 179.380 179.380 179.433 -0.053 25153 1969 1 3 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.188 -0.188 25153 1970 1 3 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.868 0.962 25153 1971 1 3 . 1 1 18 18 ALA H H 18 7.374 7.374 7.976 -0.602 25153 1972 1 3 . 1 1 19 19 GLU N N 19 116.650 116.650 118.096 -1.446 25153 1973 1 3 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.843 -0.227 25153 1974 1 3 . 1 1 19 19 GLU C C 19 178.479 178.479 179.298 -0.819 25153 1975 1 3 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.515 0.215 25153 1976 1 3 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.397 -0.097 25153 1977 1 3 . 1 1 20 20 LYS N N 20 119.470 119.470 119.587 -0.117 25153 1978 1 3 . 1 1 20 20 LYS HA H 20 4.050 4.050 3.989 0.061 25153 1979 1 3 . 1 1 20 20 LYS C C 20 179.116 179.116 179.069 0.047 25153 1980 1 3 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.772 0.058 25153 1981 1 3 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.457 0.393 25153 1982 1 3 . 1 1 21 21 ILE N N 21 121.030 121.030 120.654 0.376 25153 1983 1 3 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.687 -0.297 25153 1984 1 3 . 1 1 21 21 ILE C C 21 177.580 177.580 178.176 -0.596 25153 1985 1 3 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.750 0.070 25153 1986 1 3 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.910 0.438 25153 1987 1 3 . 1 1 21 21 ILE H H 21 8.100 8.100 8.630 -0.530 25153 1988 1 3 . 1 1 22 22 ARG N N 22 119.720 119.720 119.512 0.208 25153 1989 1 3 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.845 -0.290 25153 1990 1 3 . 1 1 22 22 ARG C C 22 177.320 177.320 178.132 -0.812 25153 1991 1 3 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.724 -0.004 25153 1992 1 3 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.710 -0.778 25153 1993 1 3 . 1 1 23 23 ASP N N 23 118.730 118.730 119.265 -0.535 25153 1994 1 3 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.410 -0.047 25153 1995 1 3 . 1 1 23 23 ASP C C 23 178.330 178.330 178.778 -0.448 25153 1996 1 3 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.363 -0.413 25153 1997 1 3 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.856 -0.616 25153 1998 1 3 . 1 1 24 24 ILE N N 24 121.090 121.090 119.209 1.881 25153 1999 1 3 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.785 0.011 25153 2000 1 3 . 1 1 24 24 ILE C C 24 178.250 178.250 177.888 0.362 25153 2001 1 3 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.948 -0.798 25153 2002 1 3 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.369 0.111 25153 2003 1 3 . 1 1 24 24 ILE H H 24 7.910 7.910 8.118 -0.208 25153 2004 1 3 . 1 1 25 25 ILE N N 25 121.406 121.406 117.298 4.108 25153 2005 1 3 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.868 -0.222 25153 2006 1 3 . 1 1 25 25 ILE C C 25 176.800 176.800 176.768 0.032 25153 2007 1 3 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.023 2.677 25153 2008 1 3 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.927 -0.737 25153 2009 1 3 . 1 1 25 25 ILE H H 25 8.476 8.476 8.107 0.369 25153 2010 1 3 . 1 1 26 26 GLY N N 26 108.900 108.900 105.178 3.722 25153 2011 1 3 . 1 1 26 26 GLY C C 26 173.710 173.710 172.259 1.451 25153 2012 1 3 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.667 -0.337 25153 2013 1 3 . 1 1 26 26 GLY H H 26 8.016 8.016 7.788 0.228 25153 2014 1 3 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.717 -0.379 25153 2015 1 3 . 1 1 27 27 PRO C C 27 177.200 177.200 177.173 0.027 25153 2016 1 3 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.508 1.178 25153 2017 1 3 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.037 0.163 25153 2018 1 3 . 1 1 28 28 GLU N N 28 116.295 116.295 117.974 -1.679 25153 2019 1 3 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.209 0.061 25153 2020 1 3 . 1 1 28 28 GLU C C 28 176.980 176.980 177.299 -0.319 25153 2021 1 3 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.191 -0.451 25153 2022 1 3 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.590 -0.919 25153 2023 1 3 . 1 1 29 29 LEU N N 29 120.250 120.250 112.083 8.167 25153 2024 1 3 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.703 -0.067 25153 2025 1 3 . 1 1 29 29 LEU C C 29 175.770 175.770 175.639 0.131 25153 2026 1 3 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.061 0.739 25153 2027 1 3 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.022 1.078 25153 2028 1 3 . 1 1 29 29 LEU H H 29 7.940 7.940 7.595 0.345 25153 2029 1 3 . 1 1 30 30 VAL N N 30 118.693 118.693 120.709 -2.016 25153 2030 1 3 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.809 -0.161 25153 2031 1 3 . 1 1 30 30 VAL C C 30 174.347 174.347 175.777 -1.430 25153 2032 1 3 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.502 -0.634 25153 2033 1 3 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.121 1.459 25153 2034 1 3 . 1 1 30 30 VAL H H 30 7.434 7.434 8.032 -0.598 25153 2035 1 3 . 1 1 31 31 THR N N 31 123.800 123.800 121.553 2.247 25153 2036 1 3 . 1 1 31 31 THR HA H 31 4.362 4.362 4.575 -0.213 25153 2037 1 3 . 1 1 31 31 THR C C 31 172.964 172.964 173.406 -0.442 25153 2038 1 3 . 1 1 31 31 THR CA C 31 61.720 61.720 60.939 0.781 25153 2039 1 3 . 1 1 31 31 THR CB C 31 70.485 70.485 70.870 -0.385 25153 2040 1 3 . 1 1 31 31 THR H H 31 7.844 7.844 8.245 -0.401 25153 2041 1 3 . 1 1 32 32 LEU N N 32 127.800 127.800 126.888 0.912 25153 2042 1 3 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.598 0.086 25153 2043 1 3 . 1 1 32 32 LEU C C 32 176.600 176.600 176.566 0.034 25153 2044 1 3 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.097 0.058 25153 2045 1 3 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.720 1.130 25153 2046 1 3 . 1 1 32 32 LEU H H 32 8.660 8.660 8.602 0.058 25153 2047 1 3 . 1 1 33 33 HIS N N 33 119.670 119.670 119.937 -0.267 25153 2048 1 3 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.805 -0.405 25153 2049 1 3 . 1 1 33 33 HIS C C 33 171.667 171.667 173.458 -1.791 25153 2050 1 3 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.112 0.088 25153 2051 1 3 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.673 0.527 25153 2052 1 3 . 1 1 33 33 HIS H H 33 9.060 9.060 8.739 0.321 25153 2053 1 3 . 1 1 34 34 ASN N N 34 124.068 124.068 123.619 0.449 25153 2054 1 3 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.054 -0.620 25153 2055 1 3 . 1 1 34 34 ASN C C 34 178.000 178.000 175.725 2.275 25153 2056 1 3 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.018 -0.589 25153 2057 1 3 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.227 -0.666 25153 2058 1 3 . 1 1 34 34 ASN H H 34 8.780 8.780 8.535 0.245 25153 2059 1 3 . 1 1 35 35 LEU N N 35 129.040 129.040 126.506 2.534 25153 2060 1 3 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.220 0.095 25153 2061 1 3 . 1 1 35 35 LEU C C 35 177.700 177.700 177.858 -0.158 25153 2062 1 3 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.260 0.220 25153 2063 1 3 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.810 1.490 25153 2064 1 3 . 1 1 35 35 LEU H H 35 8.821 8.821 8.290 0.531 25153 2065 1 3 . 1 1 36 36 LYS N N 36 121.043 121.043 116.900 4.143 25153 2066 1 3 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.990 -0.110 25153 2067 1 3 . 1 1 36 36 LYS C C 36 176.230 176.230 177.128 -0.898 25153 2068 1 3 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.539 0.881 25153 2069 1 3 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.526 0.744 25153 2070 1 3 . 1 1 37 37 ASP N N 37 114.965 114.965 118.165 -3.200 25153 2071 1 3 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.819 -0.042 25153 2072 1 3 . 1 1 37 37 ASP C C 37 175.440 175.440 175.583 -0.143 25153 2073 1 3 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.636 0.075 25153 2074 1 3 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.678 1.022 25153 2075 1 3 . 1 1 38 38 ASP N N 38 121.650 121.650 121.067 0.583 25153 2076 1 3 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.851 0.019 25153 2077 1 3 . 1 1 38 38 ASP C C 38 174.852 174.852 176.017 -1.165 25153 2078 1 3 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.767 -1.687 25153 2079 1 3 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.425 -0.315 25153 2080 1 3 . 1 1 39 39 SER N N 39 115.207 115.207 117.863 -2.656 25153 2081 1 3 . 1 1 39 39 SER HA H 39 4.585 4.585 4.643 -0.058 25153 2082 1 3 . 1 1 39 39 SER C C 39 175.040 175.040 174.229 0.811 25153 2083 1 3 . 1 1 39 39 SER CA C 39 54.960 54.960 56.766 -1.806 25153 2084 1 3 . 1 1 39 39 SER CB C 39 64.720 64.720 63.538 1.181 25153 2085 1 3 . 1 1 39 39 SER H H 39 8.351 8.351 8.576 -0.225 25153 2086 1 3 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.239 -0.234 25153 2087 1 3 . 1 1 40 40 PRO C C 40 176.730 176.730 177.809 -1.079 25153 2088 1 3 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.061 -0.161 25153 2089 1 3 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.776 -0.376 25153 2090 1 3 . 1 1 41 41 LYS N N 41 121.150 121.150 120.166 0.984 25153 2091 1 3 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.044 -0.132 25153 2092 1 3 . 1 1 41 41 LYS C C 41 179.600 179.600 178.591 1.009 25153 2093 1 3 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.291 -1.091 25153 2094 1 3 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.748 0.251 25153 2095 1 3 . 1 1 42 42 LEU N N 42 118.103 118.103 116.228 1.875 25153 2096 1 3 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.207 -0.170 25153 2097 1 3 . 1 1 42 42 LEU C C 42 178.760 178.760 178.690 0.070 25153 2098 1 3 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.269 -0.089 25153 2099 1 3 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.408 1.565 25153 2100 1 3 . 1 1 42 42 LEU H H 42 7.600 7.600 7.468 0.132 25153 2101 1 3 . 1 1 43 43 MET N N 43 118.917 118.917 116.881 2.036 25153 2102 1 3 . 1 1 43 43 MET HA H 43 3.750 3.750 4.457 -0.707 25153 2103 1 3 . 1 1 43 43 MET C C 43 177.680 177.680 176.763 0.917 25153 2104 1 3 . 1 1 43 43 MET CA C 43 59.730 59.730 57.995 1.735 25153 2105 1 3 . 1 1 43 43 MET CB C 43 32.700 32.700 31.875 0.825 25153 2106 1 3 . 1 1 43 43 MET H H 43 8.202 8.202 8.040 0.162 25153 2107 1 3 . 1 1 44 44 GLU N N 44 110.924 110.924 117.582 -6.658 25153 2108 1 3 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.256 -0.516 25153 2109 1 3 . 1 1 44 44 GLU C C 44 178.130 178.130 178.577 -0.447 25153 2110 1 3 . 1 1 44 44 GLU CA C 44 59.400 59.400 57.921 1.479 25153 2111 1 3 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.939 -0.389 25153 2112 1 3 . 1 1 45 45 GLN N N 45 115.756 115.756 118.532 -2.776 25153 2113 1 3 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.004 0.179 25153 2114 1 3 . 1 1 45 45 GLN C C 45 175.414 175.414 177.141 -1.727 25153 2115 1 3 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.676 -1.496 25153 2116 1 3 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.050 -0.450 25153 2117 1 3 . 1 1 45 45 GLN H H 45 7.516 7.516 7.456 0.060 25153 2118 1 3 . 1 1 46 46 TYR N N 46 117.860 117.860 118.195 -0.335 25153 2119 1 3 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.365 0.298 25153 2120 1 3 . 1 1 46 46 TYR C C 46 175.500 175.500 177.021 -1.521 25153 2121 1 3 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.352 -0.866 25153 2122 1 3 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.394 3.076 25153 2123 1 3 . 1 1 46 46 TYR H H 46 6.996 6.996 7.214 -0.218 25153 2124 1 3 . 1 1 47 47 ASP N N 47 121.683 121.683 120.637 1.046 25153 2125 1 3 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.724 -0.024 25153 2126 1 3 . 1 1 47 47 ASP C C 47 175.610 175.610 175.090 0.520 25153 2127 1 3 . 1 1 47 47 ASP CA C 47 56.700 56.700 56.713 -0.013 25153 2128 1 3 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.145 0.855 25153 2129 1 3 . 1 1 48 48 VAL N N 48 118.628 118.628 116.808 1.820 25153 2130 1 3 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.831 0.203 25153 2131 1 3 . 1 1 48 48 VAL C C 48 174.190 174.190 174.025 0.165 25153 2132 1 3 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.416 -1.226 25153 2133 1 3 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.981 0.119 25153 2134 1 3 . 1 1 48 48 VAL H H 48 7.628 7.628 7.379 0.249 25153 2135 1 3 . 1 1 49 49 LEU N N 49 128.190 128.190 123.458 4.732 25153 2136 1 3 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.410 0.193 25153 2137 1 3 . 1 1 49 49 LEU C C 49 174.880 174.880 175.445 -0.565 25153 2138 1 3 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.598 -1.358 25153 2139 1 3 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.411 -1.071 25153 2140 1 3 . 1 1 49 49 LEU H H 49 9.407 9.407 9.021 0.386 25153 2141 1 3 . 1 1 50 50 ILE N N 50 124.550 124.550 120.469 4.081 25153 2142 1 3 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.135 0.565 25153 2143 1 3 . 1 1 50 50 ILE C C 50 175.300 175.300 174.564 0.736 25153 2144 1 3 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.879 -1.015 25153 2145 1 3 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.367 -1.117 25153 2146 1 3 . 1 1 50 50 ILE H H 50 9.238 9.238 9.219 0.019 25153 2147 1 3 . 1 1 51 51 LEU N N 51 127.460 127.460 128.193 -0.733 25153 2148 1 3 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.869 0.316 25153 2149 1 3 . 1 1 51 51 LEU C C 51 174.544 174.544 175.908 -1.364 25153 2150 1 3 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.590 -0.770 25153 2151 1 3 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.230 -2.593 25153 2152 1 3 . 1 1 51 51 LEU H H 51 9.228 9.228 9.082 0.146 25153 2153 1 3 . 1 1 52 52 GLY N N 52 107.760 107.760 111.079 -3.319 25153 2154 1 3 . 1 1 52 52 GLY C C 52 174.710 174.710 172.342 2.368 25153 2155 1 3 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.980 -0.110 25153 2156 1 3 . 1 1 52 52 GLY H H 52 8.860 8.860 8.931 -0.071 25153 2157 1 3 . 1 1 53 53 ILE N N 53 123.890 123.890 119.740 4.150 25153 2158 1 3 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.892 0.378 25153 2159 1 3 . 1 1 53 53 ILE C C 53 172.630 172.630 173.150 -0.520 25153 2160 1 3 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.683 -0.003 25153 2161 1 3 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.650 3.510 25153 2162 1 3 . 1 1 53 53 ILE H H 53 8.458 8.458 8.043 0.415 25153 2163 1 3 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.803 0.585 25153 2164 1 3 . 1 1 54 54 PRO C C 54 175.000 175.000 176.416 -1.416 25153 2165 1 3 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.822 -0.222 25153 2166 1 3 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.740 -0.440 25153 2167 1 3 . 1 1 55 55 THR N N 55 112.754 112.754 119.024 -6.270 25153 2168 1 3 . 1 1 55 55 THR HA H 55 4.452 4.452 4.756 -0.304 25153 2169 1 3 . 1 1 55 55 THR C C 55 172.480 172.480 174.279 -1.799 25153 2170 1 3 . 1 1 55 55 THR CA C 55 62.350 62.350 63.747 -1.397 25153 2171 1 3 . 1 1 55 55 THR CB C 55 70.230 70.230 69.769 0.461 25153 2172 1 3 . 1 1 55 55 THR H H 55 6.523 6.523 8.232 -1.709 25153 2173 1 3 . 1 1 56 56 TRP N N 56 130.044 130.044 127.416 2.628 25153 2174 1 3 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.756 -2.041 25153 2175 1 3 . 1 1 56 56 TRP C C 56 172.890 172.890 175.916 -3.026 25153 2176 1 3 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.464 0.186 25153 2177 1 3 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.812 1.188 25153 2178 1 3 . 1 1 56 56 TRP H H 56 8.450 8.450 9.041 -0.591 25153 2179 1 3 . 1 1 57 57 ASP N N 57 115.275 115.275 121.287 -6.012 25153 2180 1 3 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.361 -0.009 25153 2181 1 3 . 1 1 57 57 ASP C C 57 173.660 173.660 175.193 -1.533 25153 2182 1 3 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.380 0.849 25153 2183 1 3 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.992 0.178 25153 2184 1 3 . 1 1 58 58 PHE N N 58 112.840 112.840 117.599 -4.759 25153 2185 1 3 . 1 1 58 58 PHE HA H 58 3.324 3.324 4.060 -0.736 25153 2186 1 3 . 1 1 58 58 PHE C C 58 175.730 175.730 176.355 -0.625 25153 2187 1 3 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.672 1.151 25153 2188 1 3 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.256 -2.502 25153 2189 1 3 . 1 1 58 58 PHE H H 58 7.640 7.640 8.419 -0.779 25153 2190 1 3 . 1 1 59 59 GLY N N 59 104.940 104.940 106.802 -1.862 25153 2191 1 3 . 1 1 59 59 GLY C C 59 173.750 173.750 173.537 0.213 25153 2192 1 3 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.143 1.147 25153 2193 1 3 . 1 1 59 59 GLY H H 59 8.024 8.024 8.667 -0.643 25153 2194 1 3 . 1 1 60 60 GLU N N 60 120.045 120.045 119.027 1.018 25153 2195 1 3 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.556 -0.143 25153 2196 1 3 . 1 1 60 60 GLU C C 60 176.050 176.050 175.383 0.667 25153 2197 1 3 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.395 0.225 25153 2198 1 3 . 1 1 60 60 GLU CB C 60 30.610 30.610 32.140 -1.530 25153 2199 1 3 . 1 1 61 61 ILE N N 61 120.790 120.790 121.863 -1.073 25153 2200 1 3 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.341 -0.874 25153 2201 1 3 . 1 1 61 61 ILE C C 61 175.130 175.130 176.111 -0.981 25153 2202 1 3 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.612 0.935 25153 2203 1 3 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.168 -0.318 25153 2204 1 3 . 1 1 61 61 ILE H H 61 8.200 8.200 8.372 -0.172 25153 2205 1 3 . 1 1 62 62 GLN N N 62 124.520 124.520 124.842 -0.322 25153 2206 1 3 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.158 -0.202 25153 2207 1 3 . 1 1 62 62 GLN C C 62 177.160 177.160 177.071 0.089 25153 2208 1 3 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.925 1.685 25153 2209 1 3 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.292 -2.642 25153 2210 1 3 . 1 1 62 62 GLN H H 62 5.667 5.667 8.867 -3.200 25153 2211 1 3 . 1 1 63 63 GLU N N 63 124.570 124.570 126.325 -1.755 25153 2212 1 3 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.170 -0.184 25153 2213 1 3 . 1 1 63 63 GLU C C 63 177.300 177.300 176.984 0.316 25153 2214 1 3 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.108 1.612 25153 2215 1 3 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.118 1.002 25153 2216 1 3 . 1 1 64 64 ASP N N 64 119.060 119.060 119.913 -0.853 25153 2217 1 3 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.415 0.205 25153 2218 1 3 . 1 1 64 64 ASP C C 64 179.180 179.180 177.498 1.682 25153 2219 1 3 . 1 1 64 64 ASP CA C 64 57.950 57.950 57.052 0.898 25153 2220 1 3 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.192 0.758 25153 2221 1 3 . 1 1 65 65 TRP N N 65 121.070 121.070 120.997 0.073 25153 2222 1 3 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.502 -0.162 25153 2223 1 3 . 1 1 65 65 TRP C C 65 178.970 178.970 178.179 0.791 25153 2224 1 3 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.770 0.050 25153 2225 1 3 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.420 -0.020 25153 2226 1 3 . 1 1 65 65 TRP H H 65 7.350 7.350 8.093 -0.743 25153 2227 1 3 . 1 1 66 66 GLU N N 66 120.900 120.900 118.926 1.974 25153 2228 1 3 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.881 -0.041 25153 2229 1 3 . 1 1 66 66 GLU C C 66 178.750 178.750 179.123 -0.373 25153 2230 1 3 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.453 0.547 25153 2231 1 3 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.269 -0.409 25153 2232 1 3 . 1 1 67 67 ALA N N 67 119.130 119.130 120.047 -0.917 25153 2233 1 3 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.248 0.005 25153 2234 1 3 . 1 1 67 67 ALA C C 67 179.410 179.410 179.179 0.231 25153 2235 1 3 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.787 -0.207 25153 2236 1 3 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.956 -0.146 25153 2237 1 3 . 1 1 67 67 ALA H H 67 7.640 7.640 8.151 -0.511 25153 2238 1 3 . 1 1 68 68 VAL N N 68 106.845 106.845 112.139 -5.294 25153 2239 1 3 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.485 0.325 25153 2240 1 3 . 1 1 68 68 VAL C C 68 176.750 176.750 176.924 -0.174 25153 2241 1 3 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.685 -3.075 25153 2242 1 3 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.593 0.027 25153 2243 1 3 . 1 1 68 68 VAL H H 68 7.219 7.219 7.554 -0.335 25153 2244 1 3 . 1 1 69 69 TRP N N 69 127.630 127.630 123.975 3.655 25153 2245 1 3 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.255 -0.017 25153 2246 1 3 . 1 1 69 69 TRP C C 69 178.670 178.670 177.022 1.648 25153 2247 1 3 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.706 -1.486 25153 2248 1 3 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.819 1.811 25153 2249 1 3 . 1 1 69 69 TRP H H 69 7.832 7.832 8.480 -0.648 25153 2250 1 3 . 1 1 70 70 ASP N N 70 114.544 114.544 118.300 -3.756 25153 2251 1 3 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.447 0.075 25153 2252 1 3 . 1 1 70 70 ASP C C 70 178.670 178.670 179.000 -0.330 25153 2253 1 3 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.238 -1.238 25153 2254 1 3 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.962 -1.112 25153 2255 1 3 . 1 1 71 71 GLN N N 71 120.040 120.040 119.503 0.537 25153 2256 1 3 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.100 0.084 25153 2257 1 3 . 1 1 71 71 GLN C C 71 178.910 178.910 178.838 0.072 25153 2258 1 3 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.439 -0.829 25153 2259 1 3 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.810 0.290 25153 2260 1 3 . 1 1 71 71 GLN H H 71 7.995 7.995 7.710 0.285 25153 2261 1 3 . 1 1 72 72 LEU N N 72 117.400 117.400 118.148 -0.748 25153 2262 1 3 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.967 -0.154 25153 2263 1 3 . 1 1 72 72 LEU C C 72 178.650 178.650 178.163 0.487 25153 2264 1 3 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.061 0.139 25153 2265 1 3 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.371 0.039 25153 2266 1 3 . 1 1 72 72 LEU H H 72 7.450 7.450 7.716 -0.266 25153 2267 1 3 . 1 1 73 73 ASP N N 73 115.750 115.750 117.466 -1.716 25153 2268 1 3 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.406 -0.238 25153 2269 1 3 . 1 1 73 73 ASP C C 73 177.560 177.560 177.297 0.263 25153 2270 1 3 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.635 0.765 25153 2271 1 3 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.513 -1.413 25153 2272 1 3 . 1 1 74 74 ASP N N 74 117.223 117.223 119.226 -2.003 25153 2273 1 3 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.634 0.069 25153 2274 1 3 . 1 1 74 74 ASP C C 74 176.388 176.388 176.847 -0.459 25153 2275 1 3 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.464 0.036 25153 2276 1 3 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.603 0.097 25153 2277 1 3 . 1 1 75 75 LEU N N 75 118.316 118.316 119.186 -0.870 25153 2278 1 3 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.386 -0.101 25153 2279 1 3 . 1 1 75 75 LEU C C 75 176.820 176.820 176.278 0.542 25153 2280 1 3 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.503 -0.103 25153 2281 1 3 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.377 0.903 25153 2282 1 3 . 1 1 75 75 LEU H H 75 6.960 6.960 7.364 -0.404 25153 2283 1 3 . 1 1 76 76 ASN N N 76 123.045 123.045 119.245 3.800 25153 2284 1 3 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.859 0.031 25153 2285 1 3 . 1 1 76 76 ASN C C 76 174.950 174.950 174.501 0.449 25153 2286 1 3 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.743 -0.693 25153 2287 1 3 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.331 -0.831 25153 2288 1 3 . 1 1 76 76 ASN H H 76 9.890 9.890 8.898 0.992 25153 2289 1 3 . 1 1 77 77 LEU N N 77 123.494 123.494 122.351 1.143 25153 2290 1 3 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.628 -0.258 25153 2291 1 3 . 1 1 77 77 LEU C C 77 175.040 175.040 175.404 -0.364 25153 2292 1 3 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.791 -1.541 25153 2293 1 3 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.887 0.013 25153 2294 1 3 . 1 1 77 77 LEU H H 77 8.730 8.730 7.597 1.133 25153 2295 1 3 . 1 1 78 78 GLU N N 78 120.870 120.870 119.764 1.106 25153 2296 1 3 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.662 -0.762 25153 2297 1 3 . 1 1 78 78 GLU C C 78 178.660 178.660 177.624 1.036 25153 2298 1 3 . 1 1 78 78 GLU CA C 78 58.760 58.760 56.521 2.239 25153 2299 1 3 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.207 0.193 25153 2300 1 3 . 1 1 79 79 GLY N N 79 113.240 113.240 112.775 0.465 25153 2301 1 3 . 1 1 79 79 GLY C C 79 174.460 174.460 174.179 0.281 25153 2302 1 3 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.484 -0.055 25153 2303 1 3 . 1 1 79 79 GLY H H 79 8.474 8.474 8.633 -0.159 25153 2304 1 3 . 1 1 80 80 LYS N N 80 120.295 120.295 119.659 0.636 25153 2305 1 3 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.676 -0.318 25153 2306 1 3 . 1 1 80 80 LYS C C 80 175.360 175.360 176.010 -0.650 25153 2307 1 3 . 1 1 80 80 LYS CA C 80 56.970 56.970 55.471 1.499 25153 2308 1 3 . 1 1 80 80 LYS CB C 80 33.200 33.200 34.228 -1.028 25153 2309 1 3 . 1 1 81 81 ILE N N 81 122.400 122.400 122.480 -0.080 25153 2310 1 3 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.590 0.203 25153 2311 1 3 . 1 1 81 81 ILE C C 81 174.760 174.760 175.452 -0.692 25153 2312 1 3 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.691 -1.861 25153 2313 1 3 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.793 -0.093 25153 2314 1 3 . 1 1 81 81 ILE H H 81 7.400 7.400 7.864 -0.464 25153 2315 1 3 . 1 1 82 82 VAL N N 82 127.840 127.840 126.352 1.488 25153 2316 1 3 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.928 0.334 25153 2317 1 3 . 1 1 82 82 VAL C C 82 172.724 172.724 174.387 -1.663 25153 2318 1 3 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.690 -0.280 25153 2319 1 3 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.248 0.152 25153 2320 1 3 . 1 1 82 82 VAL H H 82 8.790 8.790 8.776 0.014 25153 2321 1 3 . 1 1 83 83 ALA N N 83 131.347 131.347 130.165 1.182 25153 2322 1 3 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.351 0.031 25153 2323 1 3 . 1 1 83 83 ALA C C 83 175.750 175.750 176.459 -0.709 25153 2324 1 3 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.144 -0.274 25153 2325 1 3 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.641 2.809 25153 2326 1 3 . 1 1 83 83 ALA H H 83 9.300 9.300 8.986 0.314 25153 2327 1 3 . 1 1 84 84 LEU N N 84 124.200 124.200 126.714 -2.514 25153 2328 1 3 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.658 -0.138 25153 2329 1 3 . 1 1 84 84 LEU C C 84 175.760 175.760 176.887 -1.127 25153 2330 1 3 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.980 -0.480 25153 2331 1 3 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.365 1.535 25153 2332 1 3 . 1 1 84 84 LEU H H 84 10.287 10.287 9.073 1.214 25153 2333 1 3 . 1 1 85 85 TYR N N 85 115.912 115.912 118.913 -3.001 25153 2334 1 3 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.369 -0.409 25153 2335 1 3 . 1 1 85 85 TYR C C 85 172.372 172.372 173.865 -1.493 25153 2336 1 3 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.189 0.911 25153 2337 1 3 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.608 1.422 25153 2338 1 3 . 1 1 85 85 TYR H H 85 9.257 9.257 8.881 0.376 25153 2339 1 3 . 1 1 86 86 GLY N N 86 107.800 107.800 106.050 1.750 25153 2340 1 3 . 1 1 86 86 GLY C C 86 170.330 170.330 171.462 -1.132 25153 2341 1 3 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.994 -0.624 25153 2342 1 3 . 1 1 86 86 GLY H H 86 9.027 9.027 8.691 0.336 25153 2343 1 3 . 1 1 87 87 LEU N N 87 123.458 123.458 118.756 4.702 25153 2344 1 3 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.283 0.182 25153 2345 1 3 . 1 1 87 87 LEU C C 87 178.100 178.100 175.748 2.352 25153 2346 1 3 . 1 1 87 87 LEU CA C 87 53.590 53.590 53.022 0.569 25153 2347 1 3 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.540 -0.200 25153 2348 1 3 . 1 1 87 87 LEU H H 87 6.580 6.580 7.775 -1.195 25153 2349 1 3 . 1 1 88 88 GLY N N 88 108.966 108.966 108.136 0.830 25153 2350 1 3 . 1 1 88 88 GLY C C 88 172.820 172.820 171.501 1.319 25153 2351 1 3 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.133 1.527 25153 2352 1 3 . 1 1 88 88 GLY H H 88 8.070 8.070 8.366 -0.296 25153 2353 1 3 . 1 1 89 89 ASP N N 89 121.150 121.150 116.748 4.402 25153 2354 1 3 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.164 0.082 25153 2355 1 3 . 1 1 89 89 ASP C C 89 176.220 176.220 176.174 0.046 25153 2356 1 3 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.690 -0.220 25153 2357 1 3 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.209 -1.729 25153 2358 1 3 . 1 1 90 90 GLN N N 90 123.970 123.970 122.108 1.862 25153 2359 1 3 . 1 1 90 90 GLN HA H 90 3.488 3.488 3.978 -0.490 25153 2360 1 3 . 1 1 90 90 GLN C C 90 173.646 173.646 176.107 -2.461 25153 2361 1 3 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.191 1.119 25153 2362 1 3 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.647 -0.437 25153 2363 1 3 . 1 1 90 90 GLN H H 90 8.623 8.623 8.675 -0.052 25153 2364 1 3 . 1 1 91 91 LEU N N 91 118.017 118.017 120.201 -2.184 25153 2365 1 3 . 1 1 91 91 LEU HA H 91 4.375 4.375 3.959 0.416 25153 2366 1 3 . 1 1 91 91 LEU C C 91 180.160 180.160 178.571 1.589 25153 2367 1 3 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.390 -0.330 25153 2368 1 3 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.911 -0.361 25153 2369 1 3 . 1 1 91 91 LEU H H 91 7.046 7.046 8.687 -1.641 25153 2370 1 3 . 1 1 92 92 GLY N N 92 110.028 110.028 103.980 6.048 25153 2371 1 3 . 1 1 92 92 GLY C C 92 174.912 174.912 174.017 0.895 25153 2372 1 3 . 1 1 92 92 GLY CA C 92 46.180 46.180 44.671 1.509 25153 2373 1 3 . 1 1 92 92 GLY H H 92 9.238 9.238 8.349 0.889 25153 2374 1 3 . 1 1 93 93 TYR N N 93 115.910 115.910 118.680 -2.770 25153 2375 1 3 . 1 1 93 93 TYR HA H 93 5.009 5.009 4.142 0.867 25153 2376 1 3 . 1 1 93 93 TYR C C 93 176.850 176.850 175.444 1.406 25153 2377 1 3 . 1 1 93 93 TYR CA C 93 56.730 56.730 55.788 0.942 25153 2378 1 3 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.159 -0.029 25153 2379 1 3 . 1 1 93 93 TYR H H 93 6.962 6.962 7.316 -0.354 25153 2380 1 3 . 1 1 94 94 GLY N N 94 111.630 111.630 109.412 2.218 25153 2381 1 3 . 1 1 94 94 GLY C C 94 177.777 177.777 175.308 2.469 25153 2382 1 3 . 1 1 94 94 GLY CA C 94 50.030 50.030 46.725 3.305 25153 2383 1 3 . 1 1 94 94 GLY H H 94 7.835 7.835 8.110 -0.275 25153 2384 1 3 . 1 1 95 95 GLU N N 95 122.450 122.450 120.140 2.310 25153 2385 1 3 . 1 1 95 95 GLU HA H 95 3.918 3.918 4.066 -0.148 25153 2386 1 3 . 1 1 95 95 GLU C C 95 175.300 175.300 177.764 -2.464 25153 2387 1 3 . 1 1 95 95 GLU CA C 95 58.100 58.100 59.069 -0.969 25153 2388 1 3 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.009 -1.498 25153 2389 1 3 . 1 1 96 96 TRP N N 96 118.790 118.790 115.529 3.261 25153 2390 1 3 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.788 0.656 25153 2391 1 3 . 1 1 96 96 TRP C C 96 179.280 179.280 176.664 2.616 25153 2392 1 3 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.209 1.806 25153 2393 1 3 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.989 0.031 25153 2394 1 3 . 1 1 96 96 TRP H H 96 8.070 8.070 7.482 0.588 25153 2395 1 3 . 1 1 97 97 PHE N N 97 128.067 128.067 121.998 6.069 25153 2396 1 3 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.322 0.983 25153 2397 1 3 . 1 1 97 97 PHE C C 97 173.227 173.227 176.096 -2.869 25153 2398 1 3 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.895 -3.175 25153 2399 1 3 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.642 0.297 25153 2400 1 3 . 1 1 97 97 PHE H H 97 7.165 7.165 8.036 -0.871 25153 2401 1 3 . 1 1 98 98 LEU N N 98 114.306 114.306 122.544 -8.238 25153 2402 1 3 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.683 -0.193 25153 2403 1 3 . 1 1 98 98 LEU C C 98 179.365 179.365 177.522 1.843 25153 2404 1 3 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.467 -0.007 25153 2405 1 3 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.995 -0.765 25153 2406 1 3 . 1 1 98 98 LEU H H 98 7.453 7.453 8.458 -1.005 25153 2407 1 3 . 1 1 99 99 ASP N N 99 122.354 122.354 120.856 1.498 25153 2408 1 3 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.349 -0.416 25153 2409 1 3 . 1 1 99 99 ASP C C 99 178.800 178.800 177.231 1.569 25153 2410 1 3 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.616 1.564 25153 2411 1 3 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.275 -0.845 25153 2412 1 3 . 1 1 100 100 ALA N N 100 118.568 118.568 121.587 -3.019 25153 2413 1 3 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.074 -0.234 25153 2414 1 3 . 1 1 100 100 ALA C C 100 178.500 178.500 179.152 -0.652 25153 2415 1 3 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.154 -0.238 25153 2416 1 3 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.493 1.167 25153 2417 1 3 . 1 1 100 100 ALA H H 100 8.682 8.682 7.799 0.883 25153 2418 1 3 . 1 1 101 101 LEU N N 101 118.815 118.815 120.755 -1.940 25153 2419 1 3 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.999 -0.319 25153 2420 1 3 . 1 1 101 101 LEU C C 101 178.930 178.930 178.903 0.027 25153 2421 1 3 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.719 -0.019 25153 2422 1 3 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.547 0.853 25153 2423 1 3 . 1 1 101 101 LEU H H 101 6.637 6.637 7.380 -0.743 25153 2424 1 3 . 1 1 102 102 GLY N N 102 103.700 103.700 106.518 -2.818 25153 2425 1 3 . 1 1 102 102 GLY C C 102 175.530 175.530 176.174 -0.644 25153 2426 1 3 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.306 0.694 25153 2427 1 3 . 1 1 102 102 GLY H H 102 7.330 7.330 8.170 -0.840 25153 2428 1 3 . 1 1 103 103 MET N N 103 120.330 120.330 121.681 -1.351 25153 2429 1 3 . 1 1 103 103 MET HA H 103 4.254 4.254 4.226 0.028 25153 2430 1 3 . 1 1 103 103 MET C C 103 179.688 179.688 178.668 1.020 25153 2431 1 3 . 1 1 103 103 MET CA C 103 59.615 59.615 59.603 0.012 25153 2432 1 3 . 1 1 103 103 MET CB C 103 33.290 33.290 32.614 0.676 25153 2433 1 3 . 1 1 103 103 MET H H 103 8.407 8.407 8.254 0.153 25153 2434 1 3 . 1 1 104 104 LEU N N 104 123.450 123.450 119.728 3.722 25153 2435 1 3 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.680 0.516 25153 2436 1 3 . 1 1 104 104 LEU C C 104 177.620 177.620 178.763 -1.143 25153 2437 1 3 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.911 0.059 25153 2438 1 3 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.262 0.038 25153 2439 1 3 . 1 1 104 104 LEU H H 104 8.330 8.330 8.691 -0.361 25153 2440 1 3 . 1 1 105 105 HIS N N 105 119.040 119.040 119.401 -0.361 25153 2441 1 3 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.102 -0.225 25153 2442 1 3 . 1 1 105 105 HIS C C 105 177.100 177.100 177.054 0.046 25153 2443 1 3 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.867 0.103 25153 2444 1 3 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.847 -1.254 25153 2445 1 3 . 1 1 105 105 HIS H H 105 8.050 8.050 8.474 -0.424 25153 2446 1 3 . 1 1 106 106 ASP N N 106 119.950 119.950 119.240 0.710 25153 2447 1 3 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.518 -0.188 25153 2448 1 3 . 1 1 106 106 ASP C C 106 179.300 179.300 178.382 0.918 25153 2449 1 3 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.599 1.212 25153 2450 1 3 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.217 -0.817 25153 2451 1 3 . 1 1 107 107 LYS N N 107 122.060 122.060 120.836 1.224 25153 2452 1 3 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.032 0.101 25153 2453 1 3 . 1 1 107 107 LYS C C 107 178.100 178.100 178.984 -0.884 25153 2454 1 3 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.712 -0.512 25153 2455 1 3 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.202 0.158 25153 2456 1 3 . 1 1 108 108 LEU N N 108 115.610 115.610 117.872 -2.262 25153 2457 1 3 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.114 -0.046 25153 2458 1 3 . 1 1 108 108 LEU C C 108 178.866 178.866 178.260 0.606 25153 2459 1 3 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.794 -0.840 25153 2460 1 3 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.586 0.574 25153 2461 1 3 . 1 1 108 108 LEU H H 108 7.828 7.828 8.405 -0.577 25153 2462 1 3 . 1 1 109 109 SER N N 109 116.362 116.362 115.043 1.319 25153 2463 1 3 . 1 1 109 109 SER HA H 109 4.299 4.299 4.303 -0.004 25153 2464 1 3 . 1 1 109 109 SER C C 109 175.660 175.660 176.729 -1.069 25153 2465 1 3 . 1 1 109 109 SER CA C 109 62.350 62.350 61.054 1.296 25153 2466 1 3 . 1 1 109 109 SER CB C 109 62.815 62.815 62.866 -0.051 25153 2467 1 3 . 1 1 109 109 SER H H 109 8.278 8.278 8.658 -0.380 25153 2468 1 3 . 1 1 110 110 THR N N 110 110.230 110.230 116.197 -5.967 25153 2469 1 3 . 1 1 110 110 THR HA H 110 4.615 4.615 4.237 0.378 25153 2470 1 3 . 1 1 110 110 THR C C 110 175.990 175.990 175.473 0.517 25153 2471 1 3 . 1 1 110 110 THR CA C 110 62.090 62.090 64.240 -2.150 25153 2472 1 3 . 1 1 110 110 THR CB C 110 68.800 68.800 68.826 -0.026 25153 2473 1 3 . 1 1 110 110 THR H H 110 7.211 7.211 7.630 -0.419 25153 2474 1 3 . 1 1 111 111 LYS N N 111 119.900 119.900 120.117 -0.217 25153 2475 1 3 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.395 0.117 25153 2476 1 3 . 1 1 111 111 LYS C C 111 176.916 176.916 176.391 0.525 25153 2477 1 3 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.083 0.571 25153 2478 1 3 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.029 -1.186 25153 2479 1 3 . 1 1 112 112 GLY N N 112 107.910 107.910 107.956 -0.046 25153 2480 1 3 . 1 1 112 112 GLY C C 112 176.250 176.250 174.109 2.141 25153 2481 1 3 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.705 1.335 25153 2482 1 3 . 1 1 112 112 GLY H H 112 8.366 8.366 7.592 0.774 25153 2483 1 3 . 1 1 113 113 VAL N N 113 113.530 113.530 116.189 -2.659 25153 2484 1 3 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.546 -0.072 25153 2485 1 3 . 1 1 113 113 VAL C C 113 174.630 174.630 174.810 -0.180 25153 2486 1 3 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.664 -1.214 25153 2487 1 3 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.080 -0.530 25153 2488 1 3 . 1 1 113 113 VAL H H 113 6.903 6.903 6.963 -0.060 25153 2489 1 3 . 1 1 114 114 LYS N N 114 123.020 123.020 119.272 3.748 25153 2490 1 3 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.518 -0.013 25153 2491 1 3 . 1 1 114 114 LYS C C 114 175.000 175.000 174.759 0.241 25153 2492 1 3 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.407 -0.207 25153 2493 1 3 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.722 -1.382 25153 2494 1 3 . 1 1 115 115 PHE N N 115 123.290 123.290 120.332 2.958 25153 2495 1 3 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.724 -0.011 25153 2496 1 3 . 1 1 115 115 PHE C C 115 177.605 177.605 176.390 1.215 25153 2497 1 3 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.746 1.864 25153 2498 1 3 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.841 -0.841 25153 2499 1 3 . 1 1 115 115 PHE H H 115 8.494 8.494 8.504 -0.010 25153 2500 1 3 . 1 1 116 116 VAL N N 116 115.790 115.790 115.214 0.576 25153 2501 1 3 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.352 0.140 25153 2502 1 3 . 1 1 116 116 VAL C C 116 175.414 175.414 175.976 -0.562 25153 2503 1 3 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.442 -0.456 25153 2504 1 3 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.484 -0.385 25153 2505 1 3 . 1 1 116 116 VAL H H 116 8.889 8.889 8.356 0.533 25153 2506 1 3 . 1 1 117 117 GLY N N 117 108.300 108.300 107.889 0.411 25153 2507 1 3 . 1 1 117 117 GLY C C 117 176.180 176.180 174.721 1.459 25153 2508 1 3 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.559 2.241 25153 2509 1 3 . 1 1 117 117 GLY H H 117 9.810 9.810 8.635 1.175 25153 2510 1 3 . 1 1 118 118 TYR N N 118 120.050 120.050 119.337 0.713 25153 2511 1 3 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.795 0.159 25153 2512 1 3 . 1 1 118 118 TYR C C 118 177.450 177.450 175.942 1.508 25153 2513 1 3 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.416 -1.176 25153 2514 1 3 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.227 -3.117 25153 2515 1 3 . 1 1 118 118 TYR H H 118 8.592 8.592 7.454 1.138 25153 2516 1 3 . 1 1 119 119 TRP N N 119 125.500 125.500 120.804 4.696 25153 2517 1 3 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.098 0.930 25153 2518 1 3 . 1 1 119 119 TRP C C 119 173.090 173.090 174.190 -1.100 25153 2519 1 3 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.323 -0.423 25153 2520 1 3 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.028 3.222 25153 2521 1 3 . 1 1 119 119 TRP H H 119 7.926 7.926 8.191 -0.265 25153 2522 1 3 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.846 -0.036 25153 2523 1 3 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.707 0.973 25153 2524 1 3 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.540 -0.290 25153 2525 1 3 . 1 1 121 121 THR N N 121 109.114 109.114 112.049 -2.935 25153 2526 1 3 . 1 1 121 121 THR HA H 121 4.142 4.142 3.291 0.851 25153 2527 1 3 . 1 1 121 121 THR C C 121 176.300 176.300 175.155 1.145 25153 2528 1 3 . 1 1 121 121 THR CA C 121 61.230 61.230 63.553 -2.323 25153 2529 1 3 . 1 1 121 121 THR CB C 121 69.890 69.890 68.388 1.502 25153 2530 1 3 . 1 1 121 121 THR H H 121 7.356 7.356 8.490 -1.134 25153 2531 1 3 . 1 1 122 122 GLU N N 122 123.980 123.980 122.330 1.650 25153 2532 1 3 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.064 0.174 25153 2533 1 3 . 1 1 122 122 GLU C C 122 177.830 177.830 177.586 0.244 25153 2534 1 3 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.469 0.761 25153 2535 1 3 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.926 -0.156 25153 2536 1 3 . 1 1 123 123 GLY N N 123 114.570 114.570 112.500 2.070 25153 2537 1 3 . 1 1 123 123 GLY C C 123 173.700 173.700 173.761 -0.061 25153 2538 1 3 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.624 -0.224 25153 2539 1 3 . 1 1 123 123 GLY H H 123 9.181 9.181 8.920 0.261 25153 2540 1 3 . 1 1 124 124 TYR N N 124 118.923 118.923 119.549 -0.626 25153 2541 1 3 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.828 0.482 25153 2542 1 3 . 1 1 124 124 TYR C C 124 175.680 175.680 174.566 1.114 25153 2543 1 3 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.359 -0.889 25153 2544 1 3 . 1 1 124 124 TYR CB C 124 41.000 41.000 42.115 -1.115 25153 2545 1 3 . 1 1 124 124 TYR H H 124 7.877 7.877 7.643 0.234 25153 2546 1 3 . 1 1 125 125 GLU N N 125 124.890 124.890 122.601 2.289 25153 2547 1 3 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.683 0.017 25153 2548 1 3 . 1 1 125 125 GLU C C 125 172.880 172.880 175.036 -2.156 25153 2549 1 3 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.621 -0.191 25153 2550 1 3 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.741 -0.321 25153 2551 1 3 . 1 1 126 126 PHE N N 126 119.166 119.166 118.559 0.607 25153 2552 1 3 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.402 0.407 25153 2553 1 3 . 1 1 126 126 PHE C C 126 173.750 173.750 174.953 -1.203 25153 2554 1 3 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.408 -1.618 25153 2555 1 3 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.554 0.496 25153 2556 1 3 . 1 1 126 126 PHE H H 126 7.716 7.716 8.291 -0.575 25153 2557 1 3 . 1 1 127 127 THR N N 127 106.800 106.800 113.795 -6.995 25153 2558 1 3 . 1 1 127 127 THR HA H 127 4.400 4.400 3.340 1.060 25153 2559 1 3 . 1 1 127 127 THR C C 127 175.300 175.300 174.202 1.098 25153 2560 1 3 . 1 1 127 127 THR CA C 127 61.100 61.100 63.168 -2.068 25153 2561 1 3 . 1 1 127 127 THR CB C 127 70.600 70.600 67.812 2.788 25153 2562 1 3 . 1 1 127 127 THR H H 127 7.220 7.220 6.785 0.435 25153 2563 1 3 . 1 1 128 128 SER N N 128 118.360 118.360 115.792 2.568 25153 2564 1 3 . 1 1 128 128 SER HA H 128 4.680 4.680 4.787 -0.107 25153 2565 1 3 . 1 1 128 128 SER C C 128 175.720 175.720 173.932 1.788 25153 2566 1 3 . 1 1 128 128 SER CA C 128 56.250 56.250 56.828 -0.578 25153 2567 1 3 . 1 1 128 128 SER CB C 128 65.635 65.635 64.437 1.198 25153 2568 1 3 . 1 1 128 128 SER H H 128 7.411 7.411 8.115 -0.704 25153 2569 1 3 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.726 0.049 25153 2570 1 3 . 1 1 129 129 PRO CA C 129 62.500 62.500 63.956 -1.456 25153 2571 1 3 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.456 -0.056 25153 2572 1 3 . 1 1 130 130 LYS N N 130 122.014 122.014 120.503 1.511 25153 2573 1 3 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.336 -0.103 25153 2574 1 3 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.787 2.913 25153 2575 1 3 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.066 -0.496 25153 2576 1 3 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.558 -0.040 25153 2577 1 3 . 1 1 131 131 PRO C C 131 174.000 174.000 175.212 -1.212 25153 2578 1 3 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.467 2.233 25153 2579 1 3 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.312 0.888 25153 2580 1 3 . 1 1 132 132 VAL N N 132 113.260 113.260 117.753 -4.493 25153 2581 1 3 . 1 1 132 132 VAL HA H 132 5.200 5.200 5.027 0.173 25153 2582 1 3 . 1 1 132 132 VAL C C 132 175.210 175.210 175.061 0.149 25153 2583 1 3 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.845 -0.225 25153 2584 1 3 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.934 -0.954 25153 2585 1 3 . 1 1 132 132 VAL H H 132 6.697 6.697 7.684 -0.987 25153 2586 1 3 . 1 1 133 133 ILE N N 133 119.940 119.940 116.980 2.960 25153 2587 1 3 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.489 -0.109 25153 2588 1 3 . 1 1 133 133 ILE C C 133 175.440 175.440 175.646 -0.206 25153 2589 1 3 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.202 2.248 25153 2590 1 3 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.837 1.263 25153 2591 1 3 . 1 1 133 133 ILE H H 133 8.756 8.756 8.513 0.243 25153 2592 1 3 . 1 1 134 134 ALA N N 134 122.632 122.632 123.735 -1.103 25153 2593 1 3 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.770 0.190 25153 2594 1 3 . 1 1 134 134 ALA C C 134 178.312 178.312 177.525 0.787 25153 2595 1 3 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.658 -1.578 25153 2596 1 3 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.539 -0.703 25153 2597 1 3 . 1 1 134 134 ALA H H 134 8.523 8.523 8.269 0.254 25153 2598 1 3 . 1 1 135 135 ASP N N 135 117.366 117.366 122.261 -4.895 25153 2599 1 3 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.671 -0.419 25153 2600 1 3 . 1 1 135 135 ASP C C 135 176.387 176.387 176.914 -0.527 25153 2601 1 3 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.514 1.696 25153 2602 1 3 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.553 -1.853 25153 2603 1 3 . 1 1 136 136 GLY N N 136 104.310 104.310 107.743 -3.433 25153 2604 1 3 . 1 1 136 136 GLY C C 136 174.922 174.922 174.917 0.005 25153 2605 1 3 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.506 -0.406 25153 2606 1 3 . 1 1 136 136 GLY H H 136 7.610 7.610 8.276 -0.666 25153 2607 1 3 . 1 1 137 137 GLN N N 137 118.784 118.784 117.374 1.410 25153 2608 1 3 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.494 -0.439 25153 2609 1 3 . 1 1 137 137 GLN C C 137 176.390 176.390 175.530 0.860 25153 2610 1 3 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.908 1.732 25153 2611 1 3 . 1 1 137 137 GLN CB C 137 30.230 30.230 29.811 0.419 25153 2612 1 3 . 1 1 137 137 GLN H H 137 7.870 7.870 7.792 0.078 25153 2613 1 3 . 1 1 138 138 LEU N N 138 118.040 118.040 119.544 -1.504 25153 2614 1 3 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.084 -0.097 25153 2615 1 3 . 1 1 138 138 LEU C C 138 175.913 175.913 175.444 0.469 25153 2616 1 3 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.151 0.449 25153 2617 1 3 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.158 2.242 25153 2618 1 3 . 1 1 138 138 LEU H H 138 7.356 7.356 7.235 0.121 25153 2619 1 3 . 1 1 139 139 PHE N N 139 119.060 119.060 120.459 -1.399 25153 2620 1 3 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.852 0.458 25153 2621 1 3 . 1 1 139 139 PHE C C 139 178.780 178.780 177.651 1.129 25153 2622 1 3 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.433 -0.583 25153 2623 1 3 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.631 3.829 25153 2624 1 3 . 1 1 139 139 PHE H H 139 10.094 10.094 8.966 1.128 25153 2625 1 3 . 1 1 140 140 VAL N N 140 109.690 109.690 115.268 -5.578 25153 2626 1 3 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.377 0.104 25153 2627 1 3 . 1 1 140 140 VAL C C 140 172.790 172.790 175.597 -2.807 25153 2628 1 3 . 1 1 140 140 VAL CA C 140 62.000 62.000 64.061 -2.061 25153 2629 1 3 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.431 -0.881 25153 2630 1 3 . 1 1 140 140 VAL H H 140 7.470 7.470 8.070 -0.600 25153 2631 1 3 . 1 1 141 141 GLY N N 141 107.060 107.060 105.103 1.957 25153 2632 1 3 . 1 1 141 141 GLY C C 141 171.513 171.513 172.614 -1.101 25153 2633 1 3 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.438 0.992 25153 2634 1 3 . 1 1 141 141 GLY H H 141 7.137 7.137 7.319 -0.182 25153 2635 1 3 . 1 1 142 142 LEU N N 142 117.863 117.863 120.955 -3.092 25153 2636 1 3 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.092 -1.117 25153 2637 1 3 . 1 1 142 142 LEU C C 142 173.640 173.640 175.099 -1.459 25153 2638 1 3 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.703 1.217 25153 2639 1 3 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.135 -4.585 25153 2640 1 3 . 1 1 142 142 LEU H H 142 7.517 7.517 7.811 -0.294 25153 2641 1 3 . 1 1 143 143 ALA N N 143 126.990 126.990 129.040 -2.050 25153 2642 1 3 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.728 -0.451 25153 2643 1 3 . 1 1 143 143 ALA C C 143 175.730 175.730 175.810 -0.080 25153 2644 1 3 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.222 -0.782 25153 2645 1 3 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.916 3.394 25153 2646 1 3 . 1 1 143 143 ALA H H 143 5.186 5.186 8.186 -3.000 25153 2647 1 3 . 1 1 144 144 LEU N N 144 125.477 125.477 123.760 1.717 25153 2648 1 3 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.710 0.070 25153 2649 1 3 . 1 1 144 144 LEU C C 144 174.473 174.473 175.044 -0.571 25153 2650 1 3 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.594 -0.354 25153 2651 1 3 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.727 -0.427 25153 2652 1 3 . 1 1 144 144 LEU H H 144 8.758 8.758 8.174 0.584 25153 2653 1 3 . 1 1 145 145 ASP N N 145 118.915 118.915 118.852 0.063 25153 2654 1 3 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.295 0.237 25153 2655 1 3 . 1 1 145 145 ASP C C 145 176.470 176.470 175.991 0.479 25153 2656 1 3 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.996 -0.366 25153 2657 1 3 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.269 -1.269 25153 2658 1 3 . 1 1 146 146 GLU N N 146 124.813 124.813 123.548 1.265 25153 2659 1 3 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.519 -0.143 25153 2660 1 3 . 1 1 146 146 GLU C C 146 177.290 177.290 176.507 0.783 25153 2661 1 3 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.059 0.061 25153 2662 1 3 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.454 0.696 25153 2663 1 3 . 1 1 147 147 THR N N 147 118.328 118.328 114.119 4.209 25153 2664 1 3 . 1 1 147 147 THR HA H 147 4.200 4.200 4.715 -0.515 25153 2665 1 3 . 1 1 147 147 THR C C 147 175.683 175.683 174.614 1.069 25153 2666 1 3 . 1 1 147 147 THR CA C 147 66.250 66.250 63.325 2.925 25153 2667 1 3 . 1 1 147 147 THR CB C 147 69.600 69.600 70.186 -0.586 25153 2668 1 3 . 1 1 147 147 THR H H 147 8.562 8.562 8.667 -0.105 25153 2669 1 3 . 1 1 148 148 ASN N N 148 115.550 115.550 117.392 -1.842 25153 2670 1 3 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.784 0.203 25153 2671 1 3 . 1 1 148 148 ASN C C 148 175.870 175.870 175.517 0.353 25153 2672 1 3 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.352 -0.652 25153 2673 1 3 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.061 1.819 25153 2674 1 3 . 1 1 148 148 ASN H H 148 9.118 9.118 8.972 0.146 25153 2675 1 3 . 1 1 149 149 GLN N N 149 117.400 117.400 119.575 -2.175 25153 2676 1 3 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.355 0.488 25153 2677 1 3 . 1 1 149 149 GLN C C 149 177.780 177.780 176.189 1.591 25153 2678 1 3 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.156 -1.256 25153 2679 1 3 . 1 1 149 149 GLN CB C 149 29.300 29.300 29.046 0.254 25153 2680 1 3 . 1 1 149 149 GLN H H 149 7.555 7.555 8.061 -0.506 25153 2681 1 3 . 1 1 150 150 TYR N N 150 120.674 120.674 117.724 2.950 25153 2682 1 3 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.346 0.182 25153 2683 1 3 . 1 1 150 150 TYR C C 150 177.830 177.830 176.590 1.240 25153 2684 1 3 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.290 0.197 25153 2685 1 3 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.883 -0.283 25153 2686 1 3 . 1 1 150 150 TYR H H 150 6.983 6.983 7.796 -0.813 25153 2687 1 3 . 1 1 151 151 ASP N N 151 120.810 120.810 119.348 1.462 25153 2688 1 3 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.648 -0.133 25153 2689 1 3 . 1 1 151 151 ASP C C 151 176.400 176.400 177.151 -0.751 25153 2690 1 3 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.877 -0.477 25153 2691 1 3 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.317 -2.237 25153 2692 1 3 . 1 1 152 152 LEU N N 152 118.083 118.083 113.093 4.990 25153 2693 1 3 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.714 -0.038 25153 2694 1 3 . 1 1 152 152 LEU C C 152 178.470 178.470 178.339 0.131 25153 2695 1 3 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.789 -1.189 25153 2696 1 3 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.115 -0.516 25153 2697 1 3 . 1 1 152 152 LEU H H 152 7.453 7.453 7.437 0.016 25153 2698 1 3 . 1 1 153 153 SER N N 153 116.407 116.407 118.402 -1.995 25153 2699 1 3 . 1 1 153 153 SER HA H 153 3.960 3.960 4.048 -0.088 25153 2700 1 3 . 1 1 153 153 SER C C 153 174.590 174.590 175.684 -1.094 25153 2701 1 3 . 1 1 153 153 SER CA C 153 63.400 63.400 63.690 -0.290 25153 2702 1 3 . 1 1 153 153 SER CB C 153 63.100 63.100 62.784 0.316 25153 2703 1 3 . 1 1 153 153 SER H H 153 7.360 7.360 8.583 -1.223 25153 2704 1 3 . 1 1 154 154 ASP N N 154 121.960 121.960 120.620 1.340 25153 2705 1 3 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.323 -0.013 25153 2706 1 3 . 1 1 154 154 ASP C C 154 178.640 178.640 177.695 0.945 25153 2707 1 3 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.360 1.640 25153 2708 1 3 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.978 -1.408 25153 2709 1 3 . 1 1 155 155 GLU N N 155 121.310 121.310 118.892 2.418 25153 2710 1 3 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.049 0.136 25153 2711 1 3 . 1 1 155 155 GLU C C 155 179.600 179.600 178.907 0.693 25153 2712 1 3 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.945 0.505 25153 2713 1 3 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.452 -0.052 25153 2714 1 3 . 1 1 156 156 ARG N N 156 121.394 121.394 119.068 2.326 25153 2715 1 3 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.264 0.036 25153 2716 1 3 . 1 1 156 156 ARG C C 156 177.330 177.330 178.729 -1.399 25153 2717 1 3 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.696 1.764 25153 2718 1 3 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.289 0.471 25153 2719 1 3 . 1 1 157 157 ILE N N 157 118.390 118.390 121.298 -2.908 25153 2720 1 3 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.752 -0.318 25153 2721 1 3 . 1 1 157 157 ILE C C 157 178.814 178.814 177.758 1.056 25153 2722 1 3 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.716 0.978 25153 2723 1 3 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.801 1.052 25153 2724 1 3 . 1 1 157 157 ILE H H 157 8.966 8.966 7.553 1.413 25153 2725 1 3 . 1 1 158 158 GLN N N 158 120.060 120.060 118.633 1.427 25153 2726 1 3 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.971 -0.015 25153 2727 1 3 . 1 1 158 158 GLN C C 158 178.843 178.843 178.967 -0.124 25153 2728 1 3 . 1 1 158 158 GLN CA C 158 60.600 60.600 58.934 1.666 25153 2729 1 3 . 1 1 158 158 GLN CB C 158 28.390 28.390 27.901 0.489 25153 2730 1 3 . 1 1 158 158 GLN H H 158 8.394 8.394 7.870 0.524 25153 2731 1 3 . 1 1 159 159 SER N N 159 115.613 115.613 115.915 -0.302 25153 2732 1 3 . 1 1 159 159 SER HA H 159 4.455 4.455 4.371 0.084 25153 2733 1 3 . 1 1 159 159 SER C C 159 177.330 177.330 176.811 0.519 25153 2734 1 3 . 1 1 159 159 SER CA C 159 62.400 62.400 61.078 1.322 25153 2735 1 3 . 1 1 159 159 SER CB C 159 63.760 63.760 63.415 0.345 25153 2736 1 3 . 1 1 159 159 SER H H 159 8.460 8.460 7.947 0.513 25153 2737 1 3 . 1 1 160 160 TRP N N 160 126.820 126.820 125.053 1.767 25153 2738 1 3 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.141 0.324 25153 2739 1 3 . 1 1 160 160 TRP C C 160 178.050 178.050 177.517 0.533 25153 2740 1 3 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.887 0.813 25153 2741 1 3 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.362 -0.002 25153 2742 1 3 . 1 1 160 160 TRP H H 160 9.318 9.318 8.522 0.796 25153 2743 1 3 . 1 1 161 161 CYS N N 161 116.750 116.750 117.759 -1.009 25153 2744 1 3 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.735 0.148 25153 2745 1 3 . 1 1 161 161 CYS C C 161 176.270 176.270 177.016 -0.746 25153 2746 1 3 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.329 1.031 25153 2747 1 3 . 1 1 161 161 CYS CB C 161 27.880 27.880 27.023 0.857 25153 2748 1 3 . 1 1 161 161 CYS H H 161 8.950 8.950 9.123 -0.173 25153 2749 1 3 . 1 1 162 162 GLU N N 162 118.096 118.096 118.969 -0.873 25153 2750 1 3 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.052 -0.122 25153 2751 1 3 . 1 1 162 162 GLU C C 162 178.680 178.680 177.708 0.972 25153 2752 1 3 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.072 0.658 25153 2753 1 3 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.510 -0.080 25153 2754 1 3 . 1 1 163 163 GLN N N 163 120.790 120.790 118.070 2.720 25153 2755 1 3 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.119 0.058 25153 2756 1 3 . 1 1 163 163 GLN C C 163 179.690 179.690 178.009 1.681 25153 2757 1 3 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.177 1.363 25153 2758 1 3 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.912 0.088 25153 2759 1 3 . 1 1 163 163 GLN H H 163 8.205 8.205 7.517 0.688 25153 2760 1 3 . 1 1 164 164 ILE N N 164 114.860 114.860 118.927 -4.067 25153 2761 1 3 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.860 0.183 25153 2762 1 3 . 1 1 164 164 ILE C C 164 178.680 178.680 177.369 1.311 25153 2763 1 3 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.026 2.184 25153 2764 1 3 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.597 0.103 25153 2765 1 3 . 1 1 164 164 ILE H H 164 9.005 9.005 8.017 0.988 25153 2766 1 3 . 1 1 165 165 LEU N N 165 123.900 123.900 116.146 7.754 25153 2767 1 3 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.200 -0.050 25153 2768 1 3 . 1 1 165 165 LEU C C 165 180.520 180.520 177.321 3.199 25153 2769 1 3 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.245 1.055 25153 2770 1 3 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.286 -0.236 25153 2771 1 3 . 1 1 165 165 LEU H H 165 7.825 7.825 8.026 -0.201 25153 2772 1 3 . 1 1 166 166 ASN N N 166 120.112 120.112 117.731 2.381 25153 2773 1 3 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.774 -0.191 25153 2774 1 3 . 1 1 166 166 ASN C C 166 178.440 178.440 177.121 1.319 25153 2775 1 3 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.770 0.650 25153 2776 1 3 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.827 -1.407 25153 2777 1 3 . 1 1 166 166 ASN H H 166 7.760 7.760 7.907 -0.147 25153 2778 1 3 . 1 1 167 167 GLU N N 167 121.370 121.370 122.112 -0.742 25153 2779 1 3 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.970 0.133 25153 2780 1 3 . 1 1 167 167 GLU C C 167 180.332 180.332 179.297 1.035 25153 2781 1 3 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.916 0.234 25153 2782 1 3 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.680 1.340 25153 2783 1 3 . 1 1 168 168 MET N N 168 118.532 118.532 117.307 1.225 25153 2784 1 3 . 1 1 168 168 MET HA H 168 4.015 4.015 4.210 -0.195 25153 2785 1 3 . 1 1 168 168 MET C C 168 176.600 176.600 178.177 -1.577 25153 2786 1 3 . 1 1 168 168 MET CA C 168 59.300 59.300 59.580 -0.280 25153 2787 1 3 . 1 1 168 168 MET CB C 168 33.400 33.400 32.689 0.711 25153 2788 1 3 . 1 1 168 168 MET H H 168 8.718 8.718 8.470 0.248 25153 2789 1 3 . 1 1 169 169 ALA N N 169 121.922 121.922 122.024 -0.102 25153 2790 1 3 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.159 0.015 25153 2791 1 3 . 1 1 169 169 ALA C C 169 179.410 179.410 179.678 -0.268 25153 2792 1 3 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.779 -0.379 25153 2793 1 3 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.486 -0.076 25153 2794 1 3 . 1 1 169 169 ALA H H 169 7.448 7.448 7.803 -0.355 25153 2795 1 3 . 1 1 170 170 GLU N N 170 117.300 117.300 116.774 0.526 25153 2796 1 3 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.065 0.030 25153 2797 1 3 . 1 1 170 170 GLU C C 170 177.470 177.470 179.356 -1.886 25153 2798 1 3 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.926 -0.976 25153 2799 1 3 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.355 0.420 25153 2800 1 3 . 1 1 171 171 HIS N N 171 117.944 117.944 119.529 -1.585 25153 2801 1 3 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.361 0.139 25153 2802 1 3 . 1 1 171 171 HIS C C 171 175.120 175.120 176.798 -1.678 25153 2803 1 3 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.213 -2.013 25153 2804 1 3 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.124 0.476 25153 2805 1 3 . 1 1 171 171 HIS H H 171 7.788 7.788 7.946 -0.158 25153 2806 1 3 . 1 1 172 172 TYR N N 172 120.040 120.040 117.738 2.302 25153 2807 1 3 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.527 0.066 25153 2808 1 3 . 1 1 172 172 TYR C C 172 174.612 174.612 175.330 -0.718 25153 2809 1 3 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.381 -0.401 25153 2810 1 3 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.597 0.383 25153 2811 1 3 . 1 1 172 172 TYR H H 172 7.820 7.820 8.043 -0.223 25153 2812 1 4 . 1 1 2 2 ASN N N 2 123.320 123.320 119.100 4.220 25153 2813 1 4 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.321 -0.113 25153 2814 1 4 . 1 1 2 2 ASN C C 2 174.590 174.590 173.578 1.012 25153 2815 1 4 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.299 0.701 25153 2816 1 4 . 1 1 2 2 ASN CB C 2 39.970 39.970 41.600 -1.630 25153 2817 1 4 . 1 1 2 2 ASN H H 2 9.428 9.428 8.315 1.113 25153 2818 1 4 . 1 1 3 3 MET N N 3 120.920 120.920 118.377 2.543 25153 2819 1 4 . 1 1 3 3 MET HA H 3 5.530 5.530 5.401 0.130 25153 2820 1 4 . 1 1 3 3 MET C C 3 174.400 174.400 175.076 -0.676 25153 2821 1 4 . 1 1 3 3 MET CA C 3 54.643 54.643 54.063 0.580 25153 2822 1 4 . 1 1 3 3 MET CB C 3 34.637 34.637 37.105 -2.468 25153 2823 1 4 . 1 1 3 3 MET H H 3 8.751 8.751 9.235 -0.484 25153 2824 1 4 . 1 1 4 4 GLY N N 4 115.542 115.542 108.792 6.750 25153 2825 1 4 . 1 1 4 4 GLY C C 4 170.413 170.413 172.088 -1.675 25153 2826 1 4 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.842 -0.740 25153 2827 1 4 . 1 1 4 4 GLY H H 4 8.927 8.927 8.862 0.065 25153 2828 1 4 . 1 1 5 5 LEU N N 5 131.030 131.030 128.014 3.016 25153 2829 1 4 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.200 1.202 25153 2830 1 4 . 1 1 5 5 LEU C C 5 175.952 175.952 174.596 1.356 25153 2831 1 4 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.450 1.000 25153 2832 1 4 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.452 3.140 25153 2833 1 4 . 1 1 5 5 LEU H H 5 8.928 8.928 8.681 0.247 25153 2834 1 4 . 1 1 6 6 PHE N N 6 125.790 125.790 126.403 -0.613 25153 2835 1 4 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.731 0.009 25153 2836 1 4 . 1 1 6 6 PHE C C 6 174.300 174.300 175.916 -1.616 25153 2837 1 4 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.470 -1.150 25153 2838 1 4 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.396 -0.166 25153 2839 1 4 . 1 1 6 6 PHE H H 6 9.237 9.237 9.505 -0.268 25153 2840 1 4 . 1 1 7 7 TYR N N 7 117.289 117.289 116.771 0.518 25153 2841 1 4 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.892 0.073 25153 2842 1 4 . 1 1 7 7 TYR C C 7 171.262 171.262 173.388 -2.126 25153 2843 1 4 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.382 -0.982 25153 2844 1 4 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.894 0.346 25153 2845 1 4 . 1 1 7 7 TYR H H 7 8.125 8.125 8.338 -0.213 25153 2846 1 4 . 1 1 8 8 GLY N N 8 107.420 107.420 106.749 0.671 25153 2847 1 4 . 1 1 8 8 GLY C C 8 172.000 172.000 172.362 -0.362 25153 2848 1 4 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.263 -0.319 25153 2849 1 4 . 1 1 8 8 GLY H H 8 7.031 7.031 8.472 -1.441 25153 2850 1 4 . 1 1 9 9 SER N N 9 118.150 118.150 117.284 0.866 25153 2851 1 4 . 1 1 9 9 SER HA H 9 5.200 5.200 5.190 0.010 25153 2852 1 4 . 1 1 9 9 SER C C 9 175.000 175.000 174.246 0.754 25153 2853 1 4 . 1 1 9 9 SER CA C 9 57.570 57.570 57.230 0.340 25153 2854 1 4 . 1 1 9 9 SER CB C 9 66.700 66.700 65.915 0.785 25153 2855 1 4 . 1 1 9 9 SER H H 9 9.604 9.604 8.366 1.238 25153 2856 1 4 . 1 1 10 10 SER N N 10 131.193 131.193 120.913 10.280 25153 2857 1 4 . 1 1 10 10 SER HA H 10 4.775 4.775 4.390 0.385 25153 2858 1 4 . 1 1 10 10 SER C C 10 175.730 175.730 175.636 0.094 25153 2859 1 4 . 1 1 10 10 SER CA C 10 61.750 61.750 60.521 1.229 25153 2860 1 4 . 1 1 10 10 SER CB C 10 64.400 64.400 63.564 0.836 25153 2861 1 4 . 1 1 10 10 SER H H 10 11.636 11.636 9.079 2.557 25153 2862 1 4 . 1 1 11 11 THR N N 11 115.848 115.848 116.131 -0.283 25153 2863 1 4 . 1 1 11 11 THR HA H 11 4.770 4.770 4.177 0.593 25153 2864 1 4 . 1 1 11 11 THR C C 11 173.700 173.700 174.757 -1.057 25153 2865 1 4 . 1 1 11 11 THR CA C 11 60.700 60.700 62.547 -1.847 25153 2866 1 4 . 1 1 11 11 THR CB C 11 67.430 67.430 69.264 -1.834 25153 2867 1 4 . 1 1 11 11 THR H H 11 9.550 9.550 8.499 1.051 25153 2868 1 4 . 1 1 12 12 CYS N N 12 109.780 109.780 115.122 -5.342 25153 2869 1 4 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.767 -0.697 25153 2870 1 4 . 1 1 12 12 CYS C C 12 176.220 176.220 175.295 0.925 25153 2871 1 4 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.378 5.222 25153 2872 1 4 . 1 1 12 12 CYS CB C 12 26.400 26.400 28.079 -1.679 25153 2873 1 4 . 1 1 12 12 CYS H H 12 7.437 7.437 7.420 0.017 25153 2874 1 4 . 1 1 13 13 TYR N N 13 127.830 127.830 122.937 4.893 25153 2875 1 4 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.294 -0.191 25153 2876 1 4 . 1 1 13 13 TYR C C 13 180.880 180.880 178.166 2.714 25153 2877 1 4 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.217 3.883 25153 2878 1 4 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.535 -0.700 25153 2879 1 4 . 1 1 13 13 TYR H H 13 10.886 10.886 7.193 3.693 25153 2880 1 4 . 1 1 14 14 THR N N 14 124.428 124.428 114.251 10.177 25153 2881 1 4 . 1 1 14 14 THR HA H 14 4.160 4.160 4.101 0.059 25153 2882 1 4 . 1 1 14 14 THR C C 14 177.760 177.760 176.435 1.325 25153 2883 1 4 . 1 1 14 14 THR CA C 14 67.823 67.823 66.501 1.322 25153 2884 1 4 . 1 1 14 14 THR CB C 14 68.040 68.040 68.346 -0.306 25153 2885 1 4 . 1 1 14 14 THR H H 14 11.405 11.405 8.598 2.807 25153 2886 1 4 . 1 1 15 15 GLU N N 15 123.050 123.050 122.895 0.155 25153 2887 1 4 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.192 -0.302 25153 2888 1 4 . 1 1 15 15 GLU C C 15 176.392 176.392 178.215 -1.823 25153 2889 1 4 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.570 -0.370 25153 2890 1 4 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.359 1.091 25153 2891 1 4 . 1 1 16 16 MET N N 16 120.173 120.173 118.543 1.630 25153 2892 1 4 . 1 1 16 16 MET HA H 16 4.050 4.050 4.150 -0.100 25153 2893 1 4 . 1 1 16 16 MET C C 16 179.940 179.940 178.685 1.255 25153 2894 1 4 . 1 1 16 16 MET CA C 16 59.240 59.240 59.248 -0.008 25153 2895 1 4 . 1 1 16 16 MET CB C 16 32.970 32.970 32.900 0.070 25153 2896 1 4 . 1 1 16 16 MET H H 16 8.469 8.469 8.434 0.035 25153 2897 1 4 . 1 1 17 17 ALA N N 17 121.930 121.930 121.724 0.206 25153 2898 1 4 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.862 -0.026 25153 2899 1 4 . 1 1 17 17 ALA C C 17 177.900 177.900 178.688 -0.788 25153 2900 1 4 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.131 0.069 25153 2901 1 4 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.099 -0.099 25153 2902 1 4 . 1 1 17 17 ALA H H 17 7.880 7.880 8.425 -0.545 25153 2903 1 4 . 1 1 18 18 ALA N N 18 121.477 121.477 121.451 0.026 25153 2904 1 4 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.758 -0.021 25153 2905 1 4 . 1 1 18 18 ALA C C 18 179.380 179.380 179.386 -0.006 25153 2906 1 4 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.145 -0.145 25153 2907 1 4 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.817 1.013 25153 2908 1 4 . 1 1 18 18 ALA H H 18 7.374 7.374 8.001 -0.627 25153 2909 1 4 . 1 1 19 19 GLU N N 19 116.650 116.650 118.190 -1.540 25153 2910 1 4 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.835 -0.219 25153 2911 1 4 . 1 1 19 19 GLU C C 19 178.479 178.479 179.291 -0.812 25153 2912 1 4 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.561 0.169 25153 2913 1 4 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.387 -0.087 25153 2914 1 4 . 1 1 20 20 LYS N N 20 119.470 119.470 119.768 -0.298 25153 2915 1 4 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.014 0.036 25153 2916 1 4 . 1 1 20 20 LYS C C 20 179.116 179.116 179.078 0.038 25153 2917 1 4 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.468 0.362 25153 2918 1 4 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.441 0.409 25153 2919 1 4 . 1 1 21 21 ILE N N 21 121.030 121.030 120.691 0.339 25153 2920 1 4 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.690 -0.300 25153 2921 1 4 . 1 1 21 21 ILE C C 21 177.580 177.580 178.170 -0.590 25153 2922 1 4 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.769 0.051 25153 2923 1 4 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.896 0.452 25153 2924 1 4 . 1 1 21 21 ILE H H 21 8.100 8.100 8.607 -0.507 25153 2925 1 4 . 1 1 22 22 ARG N N 22 119.720 119.720 119.574 0.146 25153 2926 1 4 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.837 -0.282 25153 2927 1 4 . 1 1 22 22 ARG C C 22 177.320 177.320 178.137 -0.817 25153 2928 1 4 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.745 -0.025 25153 2929 1 4 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.710 -0.778 25153 2930 1 4 . 1 1 23 23 ASP N N 23 118.730 118.730 119.230 -0.500 25153 2931 1 4 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.417 -0.054 25153 2932 1 4 . 1 1 23 23 ASP C C 23 178.330 178.330 178.792 -0.462 25153 2933 1 4 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.355 -0.405 25153 2934 1 4 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.880 -0.640 25153 2935 1 4 . 1 1 24 24 ILE N N 24 121.090 121.090 119.448 1.642 25153 2936 1 4 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.785 0.011 25153 2937 1 4 . 1 1 24 24 ILE C C 24 178.250 178.250 177.888 0.362 25153 2938 1 4 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.791 -0.641 25153 2939 1 4 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.260 0.220 25153 2940 1 4 . 1 1 24 24 ILE H H 24 7.910 7.910 8.206 -0.296 25153 2941 1 4 . 1 1 25 25 ILE N N 25 121.406 121.406 117.400 4.006 25153 2942 1 4 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.864 -0.218 25153 2943 1 4 . 1 1 25 25 ILE C C 25 176.800 176.800 176.780 0.020 25153 2944 1 4 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.062 2.638 25153 2945 1 4 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.934 -0.745 25153 2946 1 4 . 1 1 25 25 ILE H H 25 8.476 8.476 8.122 0.354 25153 2947 1 4 . 1 1 26 26 GLY N N 26 108.900 108.900 105.151 3.749 25153 2948 1 4 . 1 1 26 26 GLY C C 26 173.710 173.710 172.243 1.467 25153 2949 1 4 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.642 -0.312 25153 2950 1 4 . 1 1 26 26 GLY H H 26 8.016 8.016 7.772 0.244 25153 2951 1 4 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.672 -0.334 25153 2952 1 4 . 1 1 27 27 PRO C C 27 177.200 177.200 177.444 -0.244 25153 2953 1 4 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.535 1.151 25153 2954 1 4 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.151 0.049 25153 2955 1 4 . 1 1 28 28 GLU N N 28 116.295 116.295 118.279 -1.984 25153 2956 1 4 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.189 0.081 25153 2957 1 4 . 1 1 28 28 GLU C C 28 176.980 176.980 177.354 -0.374 25153 2958 1 4 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.579 -0.839 25153 2959 1 4 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.427 -0.757 25153 2960 1 4 . 1 1 29 29 LEU N N 29 120.250 120.250 112.089 8.161 25153 2961 1 4 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.686 -0.050 25153 2962 1 4 . 1 1 29 29 LEU C C 29 175.770 175.770 175.070 0.700 25153 2963 1 4 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.111 0.689 25153 2964 1 4 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.055 1.045 25153 2965 1 4 . 1 1 29 29 LEU H H 29 7.940 7.940 7.637 0.303 25153 2966 1 4 . 1 1 30 30 VAL N N 30 118.693 118.693 120.397 -1.704 25153 2967 1 4 . 1 1 30 30 VAL HA H 30 4.648 4.648 5.021 -0.373 25153 2968 1 4 . 1 1 30 30 VAL C C 30 174.347 174.347 175.516 -1.169 25153 2969 1 4 . 1 1 30 30 VAL CA C 30 60.868 60.868 60.430 0.438 25153 2970 1 4 . 1 1 30 30 VAL CB C 30 34.580 34.580 34.454 0.126 25153 2971 1 4 . 1 1 30 30 VAL H H 30 7.434 7.434 7.954 -0.520 25153 2972 1 4 . 1 1 31 31 THR N N 31 123.800 123.800 120.551 3.249 25153 2973 1 4 . 1 1 31 31 THR HA H 31 4.362 4.362 4.601 -0.239 25153 2974 1 4 . 1 1 31 31 THR C C 31 172.964 172.964 173.354 -0.390 25153 2975 1 4 . 1 1 31 31 THR CA C 31 61.720 61.720 60.941 0.779 25153 2976 1 4 . 1 1 31 31 THR CB C 31 70.485 70.485 71.036 -0.551 25153 2977 1 4 . 1 1 31 31 THR H H 31 7.844 7.844 8.183 -0.339 25153 2978 1 4 . 1 1 32 32 LEU N N 32 127.800 127.800 126.762 1.038 25153 2979 1 4 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.591 0.093 25153 2980 1 4 . 1 1 32 32 LEU C C 32 176.600 176.600 176.495 0.105 25153 2981 1 4 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.055 0.100 25153 2982 1 4 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.785 1.065 25153 2983 1 4 . 1 1 32 32 LEU H H 32 8.660 8.660 8.590 0.070 25153 2984 1 4 . 1 1 33 33 HIS N N 33 119.670 119.670 119.816 -0.146 25153 2985 1 4 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.788 -0.388 25153 2986 1 4 . 1 1 33 33 HIS C C 33 171.667 171.667 173.187 -1.520 25153 2987 1 4 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.071 0.129 25153 2988 1 4 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.651 0.548 25153 2989 1 4 . 1 1 33 33 HIS H H 33 9.060 9.060 8.788 0.272 25153 2990 1 4 . 1 1 34 34 ASN N N 34 124.068 124.068 123.144 0.924 25153 2991 1 4 . 1 1 34 34 ASN HA H 34 3.434 3.434 3.981 -0.547 25153 2992 1 4 . 1 1 34 34 ASN C C 34 178.000 178.000 176.067 1.933 25153 2993 1 4 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.000 -0.571 25153 2994 1 4 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.040 -0.480 25153 2995 1 4 . 1 1 34 34 ASN H H 34 8.780 8.780 8.155 0.625 25153 2996 1 4 . 1 1 35 35 LEU N N 35 129.040 129.040 126.487 2.553 25153 2997 1 4 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.179 0.136 25153 2998 1 4 . 1 1 35 35 LEU C C 35 177.700 177.700 177.827 -0.127 25153 2999 1 4 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.430 0.050 25153 3000 1 4 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.800 1.500 25153 3001 1 4 . 1 1 35 35 LEU H H 35 8.821 8.821 8.497 0.324 25153 3002 1 4 . 1 1 36 36 LYS N N 36 121.043 121.043 116.410 4.633 25153 3003 1 4 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.076 -0.196 25153 3004 1 4 . 1 1 36 36 LYS C C 36 176.230 176.230 177.017 -0.787 25153 3005 1 4 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.389 1.031 25153 3006 1 4 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.520 0.750 25153 3007 1 4 . 1 1 37 37 ASP N N 37 114.965 114.965 118.068 -3.103 25153 3008 1 4 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.791 -0.014 25153 3009 1 4 . 1 1 37 37 ASP C C 37 175.440 175.440 175.932 -0.492 25153 3010 1 4 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.558 0.153 25153 3011 1 4 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.515 1.185 25153 3012 1 4 . 1 1 38 38 ASP N N 38 121.650 121.650 121.487 0.163 25153 3013 1 4 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.907 -0.037 25153 3014 1 4 . 1 1 38 38 ASP C C 38 174.852 174.852 175.955 -1.103 25153 3015 1 4 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.383 -1.304 25153 3016 1 4 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.499 -0.389 25153 3017 1 4 . 1 1 39 39 SER N N 39 115.207 115.207 117.774 -2.567 25153 3018 1 4 . 1 1 39 39 SER HA H 39 4.585 4.585 4.697 -0.112 25153 3019 1 4 . 1 1 39 39 SER C C 39 175.040 175.040 174.321 0.719 25153 3020 1 4 . 1 1 39 39 SER CA C 39 54.960 54.960 56.368 -1.408 25153 3021 1 4 . 1 1 39 39 SER CB C 39 64.720 64.720 63.537 1.183 25153 3022 1 4 . 1 1 39 39 SER H H 39 8.351 8.351 8.613 -0.262 25153 3023 1 4 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.270 -0.265 25153 3024 1 4 . 1 1 40 40 PRO C C 40 176.730 176.730 177.779 -1.049 25153 3025 1 4 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.970 -0.070 25153 3026 1 4 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.755 -0.355 25153 3027 1 4 . 1 1 41 41 LYS N N 41 121.150 121.150 119.689 1.461 25153 3028 1 4 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.049 -0.137 25153 3029 1 4 . 1 1 41 41 LYS C C 41 179.600 179.600 178.621 0.979 25153 3030 1 4 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.130 -0.930 25153 3031 1 4 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.643 0.357 25153 3032 1 4 . 1 1 42 42 LEU N N 42 118.103 118.103 116.861 1.242 25153 3033 1 4 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.206 -0.169 25153 3034 1 4 . 1 1 42 42 LEU C C 42 178.760 178.760 178.928 -0.168 25153 3035 1 4 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.153 0.027 25153 3036 1 4 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.991 0.982 25153 3037 1 4 . 1 1 42 42 LEU H H 42 7.600 7.600 7.532 0.068 25153 3038 1 4 . 1 1 43 43 MET N N 43 118.917 118.917 118.531 0.386 25153 3039 1 4 . 1 1 43 43 MET HA H 43 3.750 3.750 4.310 -0.560 25153 3040 1 4 . 1 1 43 43 MET C C 43 177.680 177.680 176.837 0.843 25153 3041 1 4 . 1 1 43 43 MET CA C 43 59.730 59.730 58.076 1.654 25153 3042 1 4 . 1 1 43 43 MET CB C 43 32.700 32.700 32.026 0.673 25153 3043 1 4 . 1 1 43 43 MET H H 43 8.202 8.202 7.942 0.260 25153 3044 1 4 . 1 1 44 44 GLU N N 44 110.924 110.924 116.976 -6.052 25153 3045 1 4 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.270 -0.530 25153 3046 1 4 . 1 1 44 44 GLU C C 44 178.130 178.130 178.719 -0.589 25153 3047 1 4 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.409 0.991 25153 3048 1 4 . 1 1 44 44 GLU CB C 44 29.550 29.550 30.006 -0.456 25153 3049 1 4 . 1 1 45 45 GLN N N 45 115.756 115.756 118.331 -2.575 25153 3050 1 4 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.044 0.139 25153 3051 1 4 . 1 1 45 45 GLN C C 45 175.414 175.414 177.184 -1.770 25153 3052 1 4 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.489 -1.309 25153 3053 1 4 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.131 -0.531 25153 3054 1 4 . 1 1 45 45 GLN H H 45 7.516 7.516 7.553 -0.037 25153 3055 1 4 . 1 1 46 46 TYR N N 46 117.860 117.860 118.587 -0.727 25153 3056 1 4 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.504 0.159 25153 3057 1 4 . 1 1 46 46 TYR C C 46 175.500 175.500 176.979 -1.479 25153 3058 1 4 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.277 -0.791 25153 3059 1 4 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.238 3.232 25153 3060 1 4 . 1 1 46 46 TYR H H 46 6.996 6.996 7.263 -0.267 25153 3061 1 4 . 1 1 47 47 ASP N N 47 121.683 121.683 123.008 -1.325 25153 3062 1 4 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.900 -0.200 25153 3063 1 4 . 1 1 47 47 ASP C C 47 175.610 175.610 174.776 0.834 25153 3064 1 4 . 1 1 47 47 ASP CA C 47 56.700 56.700 54.862 1.837 25153 3065 1 4 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.191 0.809 25153 3066 1 4 . 1 1 48 48 VAL N N 48 118.628 118.628 117.542 1.086 25153 3067 1 4 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.960 0.074 25153 3068 1 4 . 1 1 48 48 VAL C C 48 174.190 174.190 174.058 0.132 25153 3069 1 4 . 1 1 48 48 VAL CA C 48 60.190 60.190 60.584 -0.395 25153 3070 1 4 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.402 0.698 25153 3071 1 4 . 1 1 48 48 VAL H H 48 7.628 7.628 7.432 0.196 25153 3072 1 4 . 1 1 49 49 LEU N N 49 128.190 128.190 124.860 3.330 25153 3073 1 4 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.422 0.181 25153 3074 1 4 . 1 1 49 49 LEU C C 49 174.880 174.880 175.599 -0.719 25153 3075 1 4 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.197 -0.956 25153 3076 1 4 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.933 -0.593 25153 3077 1 4 . 1 1 49 49 LEU H H 49 9.407 9.407 9.033 0.374 25153 3078 1 4 . 1 1 50 50 ILE N N 50 124.550 124.550 120.827 3.723 25153 3079 1 4 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.040 0.660 25153 3080 1 4 . 1 1 50 50 ILE C C 50 175.300 175.300 174.630 0.670 25153 3081 1 4 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.014 -1.150 25153 3082 1 4 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.986 -0.736 25153 3083 1 4 . 1 1 50 50 ILE H H 50 9.238 9.238 9.236 0.002 25153 3084 1 4 . 1 1 51 51 LEU N N 51 127.460 127.460 128.483 -1.023 25153 3085 1 4 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.835 0.350 25153 3086 1 4 . 1 1 51 51 LEU C C 51 174.544 174.544 175.987 -1.443 25153 3087 1 4 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.692 -0.872 25153 3088 1 4 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.769 -2.132 25153 3089 1 4 . 1 1 51 51 LEU H H 51 9.228 9.228 9.148 0.080 25153 3090 1 4 . 1 1 52 52 GLY N N 52 107.760 107.760 112.183 -4.423 25153 3091 1 4 . 1 1 52 52 GLY C C 52 174.710 174.710 172.661 2.049 25153 3092 1 4 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.780 0.090 25153 3093 1 4 . 1 1 52 52 GLY H H 52 8.860 8.860 9.311 -0.451 25153 3094 1 4 . 1 1 53 53 ILE N N 53 123.890 123.890 121.082 2.808 25153 3095 1 4 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.806 0.464 25153 3096 1 4 . 1 1 53 53 ILE C C 53 172.630 172.630 172.839 -0.209 25153 3097 1 4 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.475 0.205 25153 3098 1 4 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.915 4.245 25153 3099 1 4 . 1 1 53 53 ILE H H 53 8.458 8.458 8.029 0.429 25153 3100 1 4 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.945 0.443 25153 3101 1 4 . 1 1 54 54 PRO C C 54 175.000 175.000 176.277 -1.277 25153 3102 1 4 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.542 0.058 25153 3103 1 4 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.136 -0.836 25153 3104 1 4 . 1 1 55 55 THR N N 55 112.754 112.754 119.041 -6.287 25153 3105 1 4 . 1 1 55 55 THR HA H 55 4.452 4.452 4.643 -0.191 25153 3106 1 4 . 1 1 55 55 THR C C 55 172.480 172.480 174.063 -1.583 25153 3107 1 4 . 1 1 55 55 THR CA C 55 62.350 62.350 63.866 -1.516 25153 3108 1 4 . 1 1 55 55 THR CB C 55 70.230 70.230 69.845 0.385 25153 3109 1 4 . 1 1 55 55 THR H H 55 6.523 6.523 8.121 -1.598 25153 3110 1 4 . 1 1 56 56 TRP N N 56 130.044 130.044 127.377 2.667 25153 3111 1 4 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.557 -1.842 25153 3112 1 4 . 1 1 56 56 TRP C C 56 172.890 172.890 175.268 -2.378 25153 3113 1 4 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.340 0.310 25153 3114 1 4 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.126 0.874 25153 3115 1 4 . 1 1 56 56 TRP H H 56 8.450 8.450 8.793 -0.343 25153 3116 1 4 . 1 1 57 57 ASP N N 57 115.275 115.275 121.150 -5.875 25153 3117 1 4 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.927 0.425 25153 3118 1 4 . 1 1 57 57 ASP C C 57 173.660 173.660 174.764 -1.104 25153 3119 1 4 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.167 1.063 25153 3120 1 4 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.789 0.381 25153 3121 1 4 . 1 1 58 58 PHE N N 58 112.840 112.840 115.546 -2.706 25153 3122 1 4 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.465 -0.141 25153 3123 1 4 . 1 1 58 58 PHE C C 58 175.730 175.730 176.008 -0.278 25153 3124 1 4 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.707 1.116 25153 3125 1 4 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.948 -2.194 25153 3126 1 4 . 1 1 58 58 PHE H H 58 7.640 7.640 7.451 0.189 25153 3127 1 4 . 1 1 59 59 GLY N N 59 104.940 104.940 105.241 -0.301 25153 3128 1 4 . 1 1 59 59 GLY C C 59 173.750 173.750 174.952 -1.202 25153 3129 1 4 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.493 0.797 25153 3130 1 4 . 1 1 59 59 GLY H H 59 8.024 8.024 8.625 -0.601 25153 3131 1 4 . 1 1 60 60 GLU N N 60 120.045 120.045 119.519 0.526 25153 3132 1 4 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.469 -0.056 25153 3133 1 4 . 1 1 60 60 GLU C C 60 176.050 176.050 176.144 -0.094 25153 3134 1 4 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.557 -0.937 25153 3135 1 4 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.000 -0.390 25153 3136 1 4 . 1 1 61 61 ILE N N 61 120.790 120.790 121.528 -0.738 25153 3137 1 4 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.037 -0.570 25153 3138 1 4 . 1 1 61 61 ILE C C 61 175.130 175.130 176.192 -1.062 25153 3139 1 4 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.569 -0.022 25153 3140 1 4 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.727 0.123 25153 3141 1 4 . 1 1 61 61 ILE H H 61 8.200 8.200 8.497 -0.297 25153 3142 1 4 . 1 1 62 62 GLN N N 62 124.520 124.520 123.129 1.391 25153 3143 1 4 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.208 -0.252 25153 3144 1 4 . 1 1 62 62 GLN C C 62 177.160 177.160 177.171 -0.011 25153 3145 1 4 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.675 0.935 25153 3146 1 4 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.141 -2.491 25153 3147 1 4 . 1 1 62 62 GLN H H 62 5.667 5.667 8.636 -2.969 25153 3148 1 4 . 1 1 63 63 GLU N N 63 124.570 124.570 126.092 -1.522 25153 3149 1 4 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.279 -0.293 25153 3150 1 4 . 1 1 63 63 GLU C C 63 177.300 177.300 177.491 -0.191 25153 3151 1 4 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.768 1.952 25153 3152 1 4 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.336 0.784 25153 3153 1 4 . 1 1 64 64 ASP N N 64 119.060 119.060 120.186 -1.126 25153 3154 1 4 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.538 0.082 25153 3155 1 4 . 1 1 64 64 ASP C C 64 179.180 179.180 177.840 1.340 25153 3156 1 4 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.222 1.728 25153 3157 1 4 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.812 0.138 25153 3158 1 4 . 1 1 65 65 TRP N N 65 121.070 121.070 121.425 -0.355 25153 3159 1 4 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.511 -0.171 25153 3160 1 4 . 1 1 65 65 TRP C C 65 178.970 178.970 178.222 0.748 25153 3161 1 4 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.583 0.237 25153 3162 1 4 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.093 0.307 25153 3163 1 4 . 1 1 65 65 TRP H H 65 7.350 7.350 7.689 -0.339 25153 3164 1 4 . 1 1 66 66 GLU N N 66 120.900 120.900 118.332 2.568 25153 3165 1 4 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.870 -0.030 25153 3166 1 4 . 1 1 66 66 GLU C C 66 178.750 178.750 179.082 -0.332 25153 3167 1 4 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.423 0.577 25153 3168 1 4 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.235 -0.375 25153 3169 1 4 . 1 1 67 67 ALA N N 67 119.130 119.130 119.687 -0.557 25153 3170 1 4 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.253 -0.000 25153 3171 1 4 . 1 1 67 67 ALA C C 67 179.410 179.410 179.084 0.326 25153 3172 1 4 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.634 -0.054 25153 3173 1 4 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.960 -0.150 25153 3174 1 4 . 1 1 67 67 ALA H H 67 7.640 7.640 7.704 -0.064 25153 3175 1 4 . 1 1 68 68 VAL N N 68 106.845 106.845 111.696 -4.851 25153 3176 1 4 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.521 0.289 25153 3177 1 4 . 1 1 68 68 VAL C C 68 176.750 176.750 176.886 -0.136 25153 3178 1 4 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.458 -2.848 25153 3179 1 4 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.723 -0.103 25153 3180 1 4 . 1 1 68 68 VAL H H 68 7.219 7.219 7.579 -0.360 25153 3181 1 4 . 1 1 69 69 TRP N N 69 127.630 127.630 124.002 3.628 25153 3182 1 4 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.252 -0.014 25153 3183 1 4 . 1 1 69 69 TRP C C 69 178.670 178.670 177.023 1.647 25153 3184 1 4 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.701 -1.481 25153 3185 1 4 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.870 1.760 25153 3186 1 4 . 1 1 69 69 TRP H H 69 7.832 7.832 8.456 -0.624 25153 3187 1 4 . 1 1 70 70 ASP N N 70 114.544 114.544 118.274 -3.730 25153 3188 1 4 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.445 0.077 25153 3189 1 4 . 1 1 70 70 ASP C C 70 178.670 178.670 178.981 -0.311 25153 3190 1 4 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.217 -1.217 25153 3191 1 4 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.967 -1.117 25153 3192 1 4 . 1 1 71 71 GLN N N 71 120.040 120.040 119.325 0.715 25153 3193 1 4 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.121 0.063 25153 3194 1 4 . 1 1 71 71 GLN C C 71 178.910 178.910 178.835 0.075 25153 3195 1 4 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.336 -0.726 25153 3196 1 4 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.807 0.293 25153 3197 1 4 . 1 1 71 71 GLN H H 71 7.995 7.995 7.721 0.274 25153 3198 1 4 . 1 1 72 72 LEU N N 72 117.400 117.400 119.087 -1.687 25153 3199 1 4 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.996 -0.183 25153 3200 1 4 . 1 1 72 72 LEU C C 72 178.650 178.650 178.460 0.190 25153 3201 1 4 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.298 -0.098 25153 3202 1 4 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.240 0.170 25153 3203 1 4 . 1 1 72 72 LEU H H 72 7.450 7.450 7.690 -0.240 25153 3204 1 4 . 1 1 73 73 ASP N N 73 115.750 115.750 118.625 -2.875 25153 3205 1 4 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.408 -0.240 25153 3206 1 4 . 1 1 73 73 ASP C C 73 177.560 177.560 177.217 0.343 25153 3207 1 4 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.939 0.461 25153 3208 1 4 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.143 -1.043 25153 3209 1 4 . 1 1 74 74 ASP N N 74 117.223 117.223 118.936 -1.713 25153 3210 1 4 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.691 0.012 25153 3211 1 4 . 1 1 74 74 ASP C C 74 176.388 176.388 176.776 -0.388 25153 3212 1 4 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.195 0.305 25153 3213 1 4 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.599 0.101 25153 3214 1 4 . 1 1 75 75 LEU N N 75 118.316 118.316 118.732 -0.416 25153 3215 1 4 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.467 -0.182 25153 3216 1 4 . 1 1 75 75 LEU C C 75 176.820 176.820 175.761 1.059 25153 3217 1 4 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.404 -0.004 25153 3218 1 4 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.894 0.386 25153 3219 1 4 . 1 1 75 75 LEU H H 75 6.960 6.960 7.190 -0.230 25153 3220 1 4 . 1 1 76 76 ASN N N 76 123.045 123.045 117.187 5.858 25153 3221 1 4 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.079 -0.189 25153 3222 1 4 . 1 1 76 76 ASN C C 76 174.950 174.950 174.857 0.093 25153 3223 1 4 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.127 -0.077 25153 3224 1 4 . 1 1 76 76 ASN CB C 76 37.500 37.500 39.175 -1.675 25153 3225 1 4 . 1 1 76 76 ASN H H 76 9.890 9.890 8.691 1.199 25153 3226 1 4 . 1 1 77 77 LEU N N 77 123.494 123.494 122.937 0.557 25153 3227 1 4 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.558 -0.188 25153 3228 1 4 . 1 1 77 77 LEU C C 77 175.040 175.040 176.054 -1.014 25153 3229 1 4 . 1 1 77 77 LEU CA C 77 52.250 52.250 54.036 -1.786 25153 3230 1 4 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.870 0.030 25153 3231 1 4 . 1 1 77 77 LEU H H 77 8.730 8.730 8.535 0.195 25153 3232 1 4 . 1 1 78 78 GLU N N 78 120.870 120.870 121.669 -0.799 25153 3233 1 4 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.518 -0.618 25153 3234 1 4 . 1 1 78 78 GLU C C 78 178.660 178.660 177.926 0.734 25153 3235 1 4 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.194 1.565 25153 3236 1 4 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.398 1.002 25153 3237 1 4 . 1 1 79 79 GLY N N 79 113.240 113.240 113.835 -0.595 25153 3238 1 4 . 1 1 79 79 GLY C C 79 174.460 174.460 174.646 -0.186 25153 3239 1 4 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.226 0.204 25153 3240 1 4 . 1 1 79 79 GLY H H 79 8.474 8.474 8.658 -0.184 25153 3241 1 4 . 1 1 80 80 LYS N N 80 120.295 120.295 119.880 0.415 25153 3242 1 4 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.448 -0.090 25153 3243 1 4 . 1 1 80 80 LYS C C 80 175.360 175.360 176.093 -0.733 25153 3244 1 4 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.155 0.815 25153 3245 1 4 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.934 -0.735 25153 3246 1 4 . 1 1 81 81 ILE N N 81 122.400 122.400 121.397 1.003 25153 3247 1 4 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.634 0.159 25153 3248 1 4 . 1 1 81 81 ILE C C 81 174.760 174.760 175.668 -0.908 25153 3249 1 4 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.320 -1.490 25153 3250 1 4 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.894 -0.194 25153 3251 1 4 . 1 1 81 81 ILE H H 81 7.400 7.400 7.898 -0.498 25153 3252 1 4 . 1 1 82 82 VAL N N 82 127.840 127.840 125.222 2.618 25153 3253 1 4 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.035 0.227 25153 3254 1 4 . 1 1 82 82 VAL C C 82 172.724 172.724 174.293 -1.569 25153 3255 1 4 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.312 0.097 25153 3256 1 4 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.584 -0.184 25153 3257 1 4 . 1 1 82 82 VAL H H 82 8.790 8.790 8.822 -0.032 25153 3258 1 4 . 1 1 83 83 ALA N N 83 131.347 131.347 129.773 1.574 25153 3259 1 4 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.369 0.013 25153 3260 1 4 . 1 1 83 83 ALA C C 83 175.750 175.750 176.512 -0.762 25153 3261 1 4 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.109 -0.239 25153 3262 1 4 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.128 2.322 25153 3263 1 4 . 1 1 83 83 ALA H H 83 9.300 9.300 9.000 0.300 25153 3264 1 4 . 1 1 84 84 LEU N N 84 124.200 124.200 126.693 -2.493 25153 3265 1 4 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.672 -0.152 25153 3266 1 4 . 1 1 84 84 LEU C C 84 175.760 175.760 176.849 -1.089 25153 3267 1 4 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.948 -0.448 25153 3268 1 4 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.362 1.538 25153 3269 1 4 . 1 1 84 84 LEU H H 84 10.287 10.287 9.103 1.184 25153 3270 1 4 . 1 1 85 85 TYR N N 85 115.912 115.912 119.045 -3.133 25153 3271 1 4 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.271 -0.311 25153 3272 1 4 . 1 1 85 85 TYR C C 85 172.372 172.372 173.720 -1.348 25153 3273 1 4 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.148 0.952 25153 3274 1 4 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.502 1.528 25153 3275 1 4 . 1 1 85 85 TYR H H 85 9.257 9.257 8.853 0.404 25153 3276 1 4 . 1 1 86 86 GLY N N 86 107.800 107.800 105.703 2.097 25153 3277 1 4 . 1 1 86 86 GLY C C 86 170.330 170.330 171.477 -1.147 25153 3278 1 4 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.704 -0.334 25153 3279 1 4 . 1 1 86 86 GLY H H 86 9.027 9.027 8.656 0.371 25153 3280 1 4 . 1 1 87 87 LEU N N 87 123.458 123.458 118.372 5.086 25153 3281 1 4 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.198 0.267 25153 3282 1 4 . 1 1 87 87 LEU C C 87 178.100 178.100 175.884 2.216 25153 3283 1 4 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.888 0.702 25153 3284 1 4 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.447 -0.107 25153 3285 1 4 . 1 1 87 87 LEU H H 87 6.580 6.580 7.630 -1.050 25153 3286 1 4 . 1 1 88 88 GLY N N 88 108.966 108.966 107.400 1.566 25153 3287 1 4 . 1 1 88 88 GLY C C 88 172.820 172.820 171.716 1.104 25153 3288 1 4 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.212 1.448 25153 3289 1 4 . 1 1 88 88 GLY H H 88 8.070 8.070 8.074 -0.004 25153 3290 1 4 . 1 1 89 89 ASP N N 89 121.150 121.150 116.846 4.304 25153 3291 1 4 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.139 0.107 25153 3292 1 4 . 1 1 89 89 ASP C C 89 176.220 176.220 176.228 -0.008 25153 3293 1 4 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.041 -0.571 25153 3294 1 4 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.074 -1.594 25153 3295 1 4 . 1 1 90 90 GLN N N 90 123.970 123.970 122.855 1.115 25153 3296 1 4 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.187 -0.699 25153 3297 1 4 . 1 1 90 90 GLN C C 90 173.646 173.646 176.533 -2.887 25153 3298 1 4 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.620 0.690 25153 3299 1 4 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.764 -0.554 25153 3300 1 4 . 1 1 90 90 GLN H H 90 8.623 8.623 8.806 -0.183 25153 3301 1 4 . 1 1 91 91 LEU N N 91 118.017 118.017 120.179 -2.162 25153 3302 1 4 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.078 0.297 25153 3303 1 4 . 1 1 91 91 LEU C C 91 180.160 180.160 178.578 1.582 25153 3304 1 4 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.483 -0.423 25153 3305 1 4 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.992 -0.443 25153 3306 1 4 . 1 1 91 91 LEU H H 91 7.046 7.046 8.878 -1.832 25153 3307 1 4 . 1 1 92 92 GLY N N 92 110.028 110.028 103.935 6.093 25153 3308 1 4 . 1 1 92 92 GLY C C 92 174.912 174.912 174.548 0.364 25153 3309 1 4 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.009 1.171 25153 3310 1 4 . 1 1 92 92 GLY H H 92 9.238 9.238 8.699 0.539 25153 3311 1 4 . 1 1 93 93 TYR N N 93 115.910 115.910 119.123 -3.213 25153 3312 1 4 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.377 -0.368 25153 3313 1 4 . 1 1 93 93 TYR C C 93 176.850 176.850 176.917 -0.067 25153 3314 1 4 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.362 0.368 25153 3315 1 4 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.853 -0.723 25153 3316 1 4 . 1 1 93 93 TYR H H 93 6.962 6.962 7.687 -0.725 25153 3317 1 4 . 1 1 94 94 GLY N N 94 111.630 111.630 110.540 1.090 25153 3318 1 4 . 1 1 94 94 GLY C C 94 177.777 177.777 175.818 1.959 25153 3319 1 4 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.390 2.640 25153 3320 1 4 . 1 1 94 94 GLY H H 94 7.835 7.835 8.169 -0.334 25153 3321 1 4 . 1 1 95 95 GLU N N 95 122.450 122.450 120.264 2.186 25153 3322 1 4 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.918 -0.000 25153 3323 1 4 . 1 1 95 95 GLU C C 95 175.300 175.300 176.662 -1.362 25153 3324 1 4 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.364 -0.264 25153 3325 1 4 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.168 -0.657 25153 3326 1 4 . 1 1 96 96 TRP N N 96 118.790 118.790 116.923 1.867 25153 3327 1 4 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.912 0.532 25153 3328 1 4 . 1 1 96 96 TRP C C 96 179.280 179.280 175.974 3.306 25153 3329 1 4 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.784 1.231 25153 3330 1 4 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.039 -0.019 25153 3331 1 4 . 1 1 96 96 TRP H H 96 8.070 8.070 8.123 -0.053 25153 3332 1 4 . 1 1 97 97 PHE N N 97 128.067 128.067 123.675 4.392 25153 3333 1 4 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.334 0.971 25153 3334 1 4 . 1 1 97 97 PHE C C 97 173.227 173.227 175.983 -2.756 25153 3335 1 4 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.665 -2.945 25153 3336 1 4 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.474 0.466 25153 3337 1 4 . 1 1 97 97 PHE H H 97 7.165 7.165 8.412 -1.247 25153 3338 1 4 . 1 1 98 98 LEU N N 98 114.306 114.306 124.534 -10.228 25153 3339 1 4 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.662 -0.172 25153 3340 1 4 . 1 1 98 98 LEU C C 98 179.365 179.365 177.274 2.091 25153 3341 1 4 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.623 -0.164 25153 3342 1 4 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.790 -0.560 25153 3343 1 4 . 1 1 98 98 LEU H H 98 7.453 7.453 8.664 -1.211 25153 3344 1 4 . 1 1 99 99 ASP N N 99 122.354 122.354 120.493 1.861 25153 3345 1 4 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.306 -0.373 25153 3346 1 4 . 1 1 99 99 ASP C C 99 178.800 178.800 177.198 1.602 25153 3347 1 4 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.812 1.368 25153 3348 1 4 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.473 -1.043 25153 3349 1 4 . 1 1 100 100 ALA N N 100 118.568 118.568 121.994 -3.426 25153 3350 1 4 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.056 -0.216 25153 3351 1 4 . 1 1 100 100 ALA C C 100 178.500 178.500 179.229 -0.729 25153 3352 1 4 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.023 -0.107 25153 3353 1 4 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.365 1.295 25153 3354 1 4 . 1 1 100 100 ALA H H 100 8.682 8.682 7.869 0.813 25153 3355 1 4 . 1 1 101 101 LEU N N 101 118.815 118.815 120.550 -1.735 25153 3356 1 4 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.954 -0.274 25153 3357 1 4 . 1 1 101 101 LEU C C 101 178.930 178.930 178.814 0.116 25153 3358 1 4 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.850 -0.150 25153 3359 1 4 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.534 0.866 25153 3360 1 4 . 1 1 101 101 LEU H H 101 6.637 6.637 7.360 -0.723 25153 3361 1 4 . 1 1 102 102 GLY N N 102 103.700 103.700 106.270 -2.570 25153 3362 1 4 . 1 1 102 102 GLY C C 102 175.530 175.530 176.100 -0.570 25153 3363 1 4 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.259 0.741 25153 3364 1 4 . 1 1 102 102 GLY H H 102 7.330 7.330 7.868 -0.538 25153 3365 1 4 . 1 1 103 103 MET N N 103 120.330 120.330 121.619 -1.289 25153 3366 1 4 . 1 1 103 103 MET HA H 103 4.254 4.254 4.253 0.001 25153 3367 1 4 . 1 1 103 103 MET C C 103 179.688 179.688 178.618 1.070 25153 3368 1 4 . 1 1 103 103 MET CA C 103 59.615 59.615 59.576 0.039 25153 3369 1 4 . 1 1 103 103 MET CB C 103 33.290 33.290 32.612 0.678 25153 3370 1 4 . 1 1 103 103 MET H H 103 8.407 8.407 7.798 0.609 25153 3371 1 4 . 1 1 104 104 LEU N N 104 123.450 123.450 119.974 3.476 25153 3372 1 4 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.712 0.484 25153 3373 1 4 . 1 1 104 104 LEU C C 104 177.620 177.620 178.820 -1.200 25153 3374 1 4 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.948 0.022 25153 3375 1 4 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.278 0.022 25153 3376 1 4 . 1 1 104 104 LEU H H 104 8.330 8.330 8.668 -0.338 25153 3377 1 4 . 1 1 105 105 HIS N N 105 119.040 119.040 119.225 -0.185 25153 3378 1 4 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.049 -0.172 25153 3379 1 4 . 1 1 105 105 HIS C C 105 177.100 177.100 177.042 0.058 25153 3380 1 4 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.669 0.301 25153 3381 1 4 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.679 -1.086 25153 3382 1 4 . 1 1 105 105 HIS H H 105 8.050 8.050 8.365 -0.315 25153 3383 1 4 . 1 1 106 106 ASP N N 106 119.950 119.950 119.133 0.817 25153 3384 1 4 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.361 -0.031 25153 3385 1 4 . 1 1 106 106 ASP C C 106 179.300 179.300 178.396 0.904 25153 3386 1 4 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.256 0.554 25153 3387 1 4 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.159 -0.759 25153 3388 1 4 . 1 1 107 107 LYS N N 107 122.060 122.060 120.000 2.060 25153 3389 1 4 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.055 0.078 25153 3390 1 4 . 1 1 107 107 LYS C C 107 178.100 178.100 179.451 -1.351 25153 3391 1 4 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.686 -0.486 25153 3392 1 4 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.147 0.214 25153 3393 1 4 . 1 1 108 108 LEU N N 108 115.610 115.610 117.905 -2.295 25153 3394 1 4 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.160 -0.092 25153 3395 1 4 . 1 1 108 108 LEU C C 108 178.866 178.866 178.281 0.585 25153 3396 1 4 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.823 -0.869 25153 3397 1 4 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.599 0.561 25153 3398 1 4 . 1 1 108 108 LEU H H 108 7.828 7.828 8.495 -0.667 25153 3399 1 4 . 1 1 109 109 SER N N 109 116.362 116.362 115.338 1.024 25153 3400 1 4 . 1 1 109 109 SER HA H 109 4.299 4.299 4.240 0.059 25153 3401 1 4 . 1 1 109 109 SER C C 109 175.660 175.660 176.788 -1.128 25153 3402 1 4 . 1 1 109 109 SER CA C 109 62.350 62.350 61.281 1.069 25153 3403 1 4 . 1 1 109 109 SER CB C 109 62.815 62.815 62.951 -0.136 25153 3404 1 4 . 1 1 109 109 SER H H 109 8.278 8.278 8.575 -0.297 25153 3405 1 4 . 1 1 110 110 THR N N 110 110.230 110.230 115.500 -5.270 25153 3406 1 4 . 1 1 110 110 THR HA H 110 4.615 4.615 4.226 0.389 25153 3407 1 4 . 1 1 110 110 THR C C 110 175.990 175.990 175.466 0.524 25153 3408 1 4 . 1 1 110 110 THR CA C 110 62.090 62.090 64.269 -2.179 25153 3409 1 4 . 1 1 110 110 THR CB C 110 68.800 68.800 68.502 0.298 25153 3410 1 4 . 1 1 110 110 THR H H 110 7.211 7.211 7.861 -0.650 25153 3411 1 4 . 1 1 111 111 LYS N N 111 119.900 119.900 119.780 0.120 25153 3412 1 4 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.516 -0.004 25153 3413 1 4 . 1 1 111 111 LYS C C 111 176.916 176.916 176.454 0.462 25153 3414 1 4 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.165 0.489 25153 3415 1 4 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.014 -1.171 25153 3416 1 4 . 1 1 112 112 GLY N N 112 107.910 107.910 108.116 -0.206 25153 3417 1 4 . 1 1 112 112 GLY C C 112 176.250 176.250 174.077 2.173 25153 3418 1 4 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.677 1.363 25153 3419 1 4 . 1 1 112 112 GLY H H 112 8.366 8.366 7.592 0.774 25153 3420 1 4 . 1 1 113 113 VAL N N 113 113.530 113.530 114.634 -1.104 25153 3421 1 4 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.451 0.023 25153 3422 1 4 . 1 1 113 113 VAL C C 113 174.630 174.630 174.621 0.009 25153 3423 1 4 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.556 -1.106 25153 3424 1 4 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.832 -0.282 25153 3425 1 4 . 1 1 113 113 VAL H H 113 6.903 6.903 6.933 -0.030 25153 3426 1 4 . 1 1 114 114 LYS N N 114 123.020 123.020 119.302 3.718 25153 3427 1 4 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.511 -0.006 25153 3428 1 4 . 1 1 114 114 LYS C C 114 175.000 175.000 174.707 0.293 25153 3429 1 4 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.549 -0.349 25153 3430 1 4 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.680 -1.340 25153 3431 1 4 . 1 1 115 115 PHE N N 115 123.290 123.290 120.507 2.783 25153 3432 1 4 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.756 -0.043 25153 3433 1 4 . 1 1 115 115 PHE C C 115 177.605 177.605 176.401 1.204 25153 3434 1 4 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.726 1.884 25153 3435 1 4 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.794 -0.794 25153 3436 1 4 . 1 1 115 115 PHE H H 115 8.494 8.494 8.386 0.108 25153 3437 1 4 . 1 1 116 116 VAL N N 116 115.790 115.790 115.423 0.367 25153 3438 1 4 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.391 0.101 25153 3439 1 4 . 1 1 116 116 VAL C C 116 175.414 175.414 176.029 -0.615 25153 3440 1 4 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.431 -0.445 25153 3441 1 4 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.522 -0.422 25153 3442 1 4 . 1 1 116 116 VAL H H 116 8.889 8.889 8.501 0.388 25153 3443 1 4 . 1 1 117 117 GLY N N 117 108.300 108.300 108.040 0.260 25153 3444 1 4 . 1 1 117 117 GLY C C 117 176.180 176.180 174.744 1.436 25153 3445 1 4 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.510 2.290 25153 3446 1 4 . 1 1 117 117 GLY H H 117 9.810 9.810 8.677 1.133 25153 3447 1 4 . 1 1 118 118 TYR N N 118 120.050 120.050 119.547 0.503 25153 3448 1 4 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.822 0.132 25153 3449 1 4 . 1 1 118 118 TYR C C 118 177.450 177.450 176.099 1.351 25153 3450 1 4 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.295 -1.055 25153 3451 1 4 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.009 -2.899 25153 3452 1 4 . 1 1 118 118 TYR H H 118 8.592 8.592 7.571 1.021 25153 3453 1 4 . 1 1 119 119 TRP N N 119 125.500 125.500 122.339 3.161 25153 3454 1 4 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.157 0.871 25153 3455 1 4 . 1 1 119 119 TRP C C 119 173.090 173.090 174.273 -1.183 25153 3456 1 4 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.383 -0.483 25153 3457 1 4 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.066 3.184 25153 3458 1 4 . 1 1 119 119 TRP H H 119 7.926 7.926 8.199 -0.273 25153 3459 1 4 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.720 0.090 25153 3460 1 4 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.830 0.850 25153 3461 1 4 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.683 -0.433 25153 3462 1 4 . 1 1 121 121 THR N N 121 109.114 109.114 111.415 -2.301 25153 3463 1 4 . 1 1 121 121 THR HA H 121 4.142 4.142 3.516 0.626 25153 3464 1 4 . 1 1 121 121 THR C C 121 176.300 176.300 175.521 0.779 25153 3465 1 4 . 1 1 121 121 THR CA C 121 61.230 61.230 62.542 -1.312 25153 3466 1 4 . 1 1 121 121 THR CB C 121 69.890 69.890 68.625 1.265 25153 3467 1 4 . 1 1 121 121 THR H H 121 7.356 7.356 8.363 -1.007 25153 3468 1 4 . 1 1 122 122 GLU N N 122 123.980 123.980 122.016 1.964 25153 3469 1 4 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.017 0.221 25153 3470 1 4 . 1 1 122 122 GLU C C 122 177.830 177.830 177.887 -0.057 25153 3471 1 4 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.631 0.599 25153 3472 1 4 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.909 -0.139 25153 3473 1 4 . 1 1 123 123 GLY N N 123 114.570 114.570 113.352 1.218 25153 3474 1 4 . 1 1 123 123 GLY C C 123 173.700 173.700 174.401 -0.701 25153 3475 1 4 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.470 -0.070 25153 3476 1 4 . 1 1 123 123 GLY H H 123 9.181 9.181 8.793 0.388 25153 3477 1 4 . 1 1 124 124 TYR N N 124 118.923 118.923 121.028 -2.105 25153 3478 1 4 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.627 0.683 25153 3479 1 4 . 1 1 124 124 TYR C C 124 175.680 175.680 175.236 0.444 25153 3480 1 4 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.600 -2.130 25153 3481 1 4 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.207 0.793 25153 3482 1 4 . 1 1 124 124 TYR H H 124 7.877 7.877 7.784 0.093 25153 3483 1 4 . 1 1 125 125 GLU N N 125 124.890 124.890 121.803 3.087 25153 3484 1 4 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.567 0.133 25153 3485 1 4 . 1 1 125 125 GLU C C 125 172.880 172.880 175.106 -2.226 25153 3486 1 4 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.612 -0.182 25153 3487 1 4 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.795 -0.375 25153 3488 1 4 . 1 1 126 126 PHE N N 126 119.166 119.166 120.236 -1.070 25153 3489 1 4 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.462 0.347 25153 3490 1 4 . 1 1 126 126 PHE C C 126 173.750 173.750 174.721 -0.971 25153 3491 1 4 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.222 -1.432 25153 3492 1 4 . 1 1 126 126 PHE CB C 126 40.050 40.050 38.551 1.499 25153 3493 1 4 . 1 1 126 126 PHE H H 126 7.716 7.716 7.979 -0.263 25153 3494 1 4 . 1 1 127 127 THR N N 127 106.800 106.800 114.870 -8.070 25153 3495 1 4 . 1 1 127 127 THR HA H 127 4.400 4.400 3.338 1.062 25153 3496 1 4 . 1 1 127 127 THR C C 127 175.300 175.300 174.033 1.267 25153 3497 1 4 . 1 1 127 127 THR CA C 127 61.100 61.100 63.134 -2.034 25153 3498 1 4 . 1 1 127 127 THR CB C 127 70.600 70.600 68.065 2.535 25153 3499 1 4 . 1 1 127 127 THR H H 127 7.220 7.220 6.530 0.690 25153 3500 1 4 . 1 1 128 128 SER N N 128 118.360 118.360 115.595 2.765 25153 3501 1 4 . 1 1 128 128 SER HA H 128 4.680 4.680 4.544 0.136 25153 3502 1 4 . 1 1 128 128 SER C C 128 175.720 175.720 173.942 1.778 25153 3503 1 4 . 1 1 128 128 SER CA C 128 56.250 56.250 56.859 -0.609 25153 3504 1 4 . 1 1 128 128 SER CB C 128 65.635 65.635 64.323 1.312 25153 3505 1 4 . 1 1 128 128 SER H H 128 7.411 7.411 8.141 -0.730 25153 3506 1 4 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.545 0.230 25153 3507 1 4 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.134 -1.634 25153 3508 1 4 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.218 0.182 25153 3509 1 4 . 1 1 130 130 LYS N N 130 122.014 122.014 118.930 3.084 25153 3510 1 4 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.449 -0.216 25153 3511 1 4 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.004 3.696 25153 3512 1 4 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.358 0.212 25153 3513 1 4 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.488 0.030 25153 3514 1 4 . 1 1 131 131 PRO C C 131 174.000 174.000 175.026 -1.026 25153 3515 1 4 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.520 2.180 25153 3516 1 4 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.219 0.981 25153 3517 1 4 . 1 1 132 132 VAL N N 132 113.260 113.260 116.912 -3.652 25153 3518 1 4 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.866 0.334 25153 3519 1 4 . 1 1 132 132 VAL C C 132 175.210 175.210 174.970 0.240 25153 3520 1 4 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.898 -0.278 25153 3521 1 4 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.800 -0.820 25153 3522 1 4 . 1 1 132 132 VAL H H 132 6.697 6.697 7.624 -0.927 25153 3523 1 4 . 1 1 133 133 ILE N N 133 119.940 119.940 117.464 2.476 25153 3524 1 4 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.521 -0.141 25153 3525 1 4 . 1 1 133 133 ILE C C 133 175.440 175.440 175.247 0.193 25153 3526 1 4 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.962 1.488 25153 3527 1 4 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.028 2.072 25153 3528 1 4 . 1 1 133 133 ILE H H 133 8.756 8.756 8.660 0.096 25153 3529 1 4 . 1 1 134 134 ALA N N 134 122.632 122.632 123.939 -1.307 25153 3530 1 4 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.926 0.034 25153 3531 1 4 . 1 1 134 134 ALA C C 134 178.312 178.312 177.237 1.075 25153 3532 1 4 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.619 -1.539 25153 3533 1 4 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.249 -0.413 25153 3534 1 4 . 1 1 134 134 ALA H H 134 8.523 8.523 8.511 0.012 25153 3535 1 4 . 1 1 135 135 ASP N N 135 117.366 117.366 122.714 -5.348 25153 3536 1 4 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.669 -0.417 25153 3537 1 4 . 1 1 135 135 ASP C C 135 176.387 176.387 176.642 -0.255 25153 3538 1 4 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.357 1.853 25153 3539 1 4 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.236 -1.536 25153 3540 1 4 . 1 1 136 136 GLY N N 136 104.310 104.310 108.076 -3.766 25153 3541 1 4 . 1 1 136 136 GLY C C 136 174.922 174.922 174.926 -0.004 25153 3542 1 4 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.386 -0.287 25153 3543 1 4 . 1 1 136 136 GLY H H 136 7.610 7.610 8.329 -0.719 25153 3544 1 4 . 1 1 137 137 GLN N N 137 118.784 118.784 117.697 1.087 25153 3545 1 4 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.435 -0.380 25153 3546 1 4 . 1 1 137 137 GLN C C 137 176.390 176.390 175.452 0.938 25153 3547 1 4 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.806 1.834 25153 3548 1 4 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.243 -0.013 25153 3549 1 4 . 1 1 137 137 GLN H H 137 7.870 7.870 7.880 -0.010 25153 3550 1 4 . 1 1 138 138 LEU N N 138 118.040 118.040 115.831 2.209 25153 3551 1 4 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.986 0.001 25153 3552 1 4 . 1 1 138 138 LEU C C 138 175.913 175.913 175.042 0.871 25153 3553 1 4 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.215 0.385 25153 3554 1 4 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.971 1.429 25153 3555 1 4 . 1 1 138 138 LEU H H 138 7.356 7.356 7.195 0.161 25153 3556 1 4 . 1 1 139 139 PHE N N 139 119.060 119.060 118.965 0.095 25153 3557 1 4 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.901 0.409 25153 3558 1 4 . 1 1 139 139 PHE C C 139 178.780 178.780 177.598 1.182 25153 3559 1 4 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.219 -0.370 25153 3560 1 4 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.852 3.608 25153 3561 1 4 . 1 1 139 139 PHE H H 139 10.094 10.094 8.869 1.225 25153 3562 1 4 . 1 1 140 140 VAL N N 140 109.690 109.690 113.765 -4.075 25153 3563 1 4 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.350 0.131 25153 3564 1 4 . 1 1 140 140 VAL C C 140 172.790 172.790 175.403 -2.613 25153 3565 1 4 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.616 -1.616 25153 3566 1 4 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.184 -0.634 25153 3567 1 4 . 1 1 140 140 VAL H H 140 7.470 7.470 8.001 -0.531 25153 3568 1 4 . 1 1 141 141 GLY N N 141 107.060 107.060 105.164 1.896 25153 3569 1 4 . 1 1 141 141 GLY C C 141 171.513 171.513 172.517 -1.004 25153 3570 1 4 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.430 1.000 25153 3571 1 4 . 1 1 141 141 GLY H H 141 7.137 7.137 7.282 -0.145 25153 3572 1 4 . 1 1 142 142 LEU N N 142 117.863 117.863 120.282 -2.419 25153 3573 1 4 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.260 -1.285 25153 3574 1 4 . 1 1 142 142 LEU C C 142 173.640 173.640 175.108 -1.468 25153 3575 1 4 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.599 1.321 25153 3576 1 4 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.504 -4.954 25153 3577 1 4 . 1 1 142 142 LEU H H 142 7.517 7.517 7.642 -0.125 25153 3578 1 4 . 1 1 143 143 ALA N N 143 126.990 126.990 129.210 -2.220 25153 3579 1 4 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.334 -0.057 25153 3580 1 4 . 1 1 143 143 ALA C C 143 175.730 175.730 175.806 -0.076 25153 3581 1 4 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.325 -0.885 25153 3582 1 4 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.201 4.109 25153 3583 1 4 . 1 1 143 143 ALA H H 143 5.186 5.186 8.212 -3.026 25153 3584 1 4 . 1 1 144 144 LEU N N 144 125.477 125.477 123.996 1.481 25153 3585 1 4 . 1 1 144 144 LEU HA H 144 4.780 4.780 5.009 -0.229 25153 3586 1 4 . 1 1 144 144 LEU C C 144 174.473 174.473 175.536 -1.063 25153 3587 1 4 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.240 -0.000 25153 3588 1 4 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.883 -0.583 25153 3589 1 4 . 1 1 144 144 LEU H H 144 8.758 8.758 8.016 0.742 25153 3590 1 4 . 1 1 145 145 ASP N N 145 118.915 118.915 118.750 0.165 25153 3591 1 4 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.139 0.393 25153 3592 1 4 . 1 1 145 145 ASP C C 145 176.470 176.470 176.060 0.410 25153 3593 1 4 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.226 -0.596 25153 3594 1 4 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.041 -1.041 25153 3595 1 4 . 1 1 146 146 GLU N N 146 124.813 124.813 124.007 0.806 25153 3596 1 4 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.556 -0.180 25153 3597 1 4 . 1 1 146 146 GLU C C 146 177.290 177.290 176.325 0.965 25153 3598 1 4 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.894 0.226 25153 3599 1 4 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.166 0.984 25153 3600 1 4 . 1 1 147 147 THR N N 147 118.328 118.328 112.893 5.435 25153 3601 1 4 . 1 1 147 147 THR HA H 147 4.200 4.200 4.673 -0.473 25153 3602 1 4 . 1 1 147 147 THR C C 147 175.683 175.683 174.555 1.128 25153 3603 1 4 . 1 1 147 147 THR CA C 147 66.250 66.250 62.940 3.310 25153 3604 1 4 . 1 1 147 147 THR CB C 147 69.600 69.600 70.217 -0.617 25153 3605 1 4 . 1 1 147 147 THR H H 147 8.562 8.562 8.805 -0.243 25153 3606 1 4 . 1 1 148 148 ASN N N 148 115.550 115.550 118.760 -3.210 25153 3607 1 4 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.879 0.108 25153 3608 1 4 . 1 1 148 148 ASN C C 148 175.870 175.870 174.910 0.960 25153 3609 1 4 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.822 -1.122 25153 3610 1 4 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.853 2.027 25153 3611 1 4 . 1 1 148 148 ASN H H 148 9.118 9.118 8.787 0.331 25153 3612 1 4 . 1 1 149 149 GLN N N 149 117.400 117.400 119.885 -2.485 25153 3613 1 4 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.244 0.599 25153 3614 1 4 . 1 1 149 149 GLN C C 149 177.780 177.780 176.358 1.422 25153 3615 1 4 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.215 -2.315 25153 3616 1 4 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.682 0.618 25153 3617 1 4 . 1 1 149 149 GLN H H 149 7.555 7.555 8.552 -0.997 25153 3618 1 4 . 1 1 150 150 TYR N N 150 120.674 120.674 118.137 2.537 25153 3619 1 4 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.173 0.355 25153 3620 1 4 . 1 1 150 150 TYR C C 150 177.830 177.830 176.436 1.394 25153 3621 1 4 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.057 0.430 25153 3622 1 4 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.833 -0.233 25153 3623 1 4 . 1 1 150 150 TYR H H 150 6.983 6.983 7.791 -0.808 25153 3624 1 4 . 1 1 151 151 ASP N N 151 120.810 120.810 119.480 1.330 25153 3625 1 4 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.630 -0.115 25153 3626 1 4 . 1 1 151 151 ASP C C 151 176.400 176.400 177.268 -0.868 25153 3627 1 4 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.987 -0.587 25153 3628 1 4 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.332 -2.252 25153 3629 1 4 . 1 1 152 152 LEU N N 152 118.083 118.083 113.169 4.914 25153 3630 1 4 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.684 -0.008 25153 3631 1 4 . 1 1 152 152 LEU C C 152 178.470 178.470 178.317 0.153 25153 3632 1 4 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.653 -1.053 25153 3633 1 4 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.041 -0.441 25153 3634 1 4 . 1 1 152 152 LEU H H 152 7.453 7.453 7.579 -0.126 25153 3635 1 4 . 1 1 153 153 SER N N 153 116.407 116.407 119.076 -2.669 25153 3636 1 4 . 1 1 153 153 SER HA H 153 3.960 3.960 3.996 -0.036 25153 3637 1 4 . 1 1 153 153 SER C C 153 174.590 174.590 175.751 -1.161 25153 3638 1 4 . 1 1 153 153 SER CA C 153 63.400 63.400 62.783 0.617 25153 3639 1 4 . 1 1 153 153 SER CB C 153 63.100 63.100 62.700 0.400 25153 3640 1 4 . 1 1 153 153 SER H H 153 7.360 7.360 8.519 -1.159 25153 3641 1 4 . 1 1 154 154 ASP N N 154 121.960 121.960 120.400 1.560 25153 3642 1 4 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.358 -0.048 25153 3643 1 4 . 1 1 154 154 ASP C C 154 178.640 178.640 177.760 0.880 25153 3644 1 4 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.379 1.621 25153 3645 1 4 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.919 -1.349 25153 3646 1 4 . 1 1 155 155 GLU N N 155 121.310 121.310 119.082 2.228 25153 3647 1 4 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.119 0.066 25153 3648 1 4 . 1 1 155 155 GLU C C 155 179.600 179.600 179.066 0.534 25153 3649 1 4 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.004 0.446 25153 3650 1 4 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.632 -0.232 25153 3651 1 4 . 1 1 156 156 ARG N N 156 121.394 121.394 119.790 1.604 25153 3652 1 4 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.483 -0.183 25153 3653 1 4 . 1 1 156 156 ARG C C 156 177.330 177.330 179.078 -1.748 25153 3654 1 4 . 1 1 156 156 ARG CA C 156 60.460 60.460 57.228 3.232 25153 3655 1 4 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.066 0.694 25153 3656 1 4 . 1 1 157 157 ILE N N 157 118.390 118.390 121.312 -2.922 25153 3657 1 4 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.819 -0.385 25153 3658 1 4 . 1 1 157 157 ILE C C 157 178.814 178.814 177.941 0.873 25153 3659 1 4 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.111 0.583 25153 3660 1 4 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.907 0.946 25153 3661 1 4 . 1 1 157 157 ILE H H 157 8.966 8.966 8.292 0.674 25153 3662 1 4 . 1 1 158 158 GLN N N 158 120.060 120.060 119.440 0.620 25153 3663 1 4 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.992 -0.036 25153 3664 1 4 . 1 1 158 158 GLN C C 158 178.843 178.843 178.378 0.465 25153 3665 1 4 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.231 1.369 25153 3666 1 4 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.280 0.110 25153 3667 1 4 . 1 1 158 158 GLN H H 158 8.394 8.394 7.950 0.444 25153 3668 1 4 . 1 1 159 159 SER N N 159 115.613 115.613 115.580 0.033 25153 3669 1 4 . 1 1 159 159 SER HA H 159 4.455 4.455 4.543 -0.088 25153 3670 1 4 . 1 1 159 159 SER C C 159 177.330 177.330 176.731 0.599 25153 3671 1 4 . 1 1 159 159 SER CA C 159 62.400 62.400 60.536 1.864 25153 3672 1 4 . 1 1 159 159 SER CB C 159 63.760 63.760 63.379 0.381 25153 3673 1 4 . 1 1 159 159 SER H H 159 8.460 8.460 8.112 0.348 25153 3674 1 4 . 1 1 160 160 TRP N N 160 126.820 126.820 125.218 1.602 25153 3675 1 4 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.075 0.390 25153 3676 1 4 . 1 1 160 160 TRP C C 160 178.050 178.050 177.626 0.424 25153 3677 1 4 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.927 0.773 25153 3678 1 4 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.518 -0.158 25153 3679 1 4 . 1 1 160 160 TRP H H 160 9.318 9.318 7.917 1.401 25153 3680 1 4 . 1 1 161 161 CYS N N 161 116.750 116.750 118.289 -1.539 25153 3681 1 4 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.714 0.169 25153 3682 1 4 . 1 1 161 161 CYS C C 161 176.270 176.270 176.815 -0.545 25153 3683 1 4 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.320 1.040 25153 3684 1 4 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.603 1.277 25153 3685 1 4 . 1 1 161 161 CYS H H 161 8.950 8.950 8.955 -0.005 25153 3686 1 4 . 1 1 162 162 GLU N N 162 118.096 118.096 119.233 -1.137 25153 3687 1 4 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.044 -0.114 25153 3688 1 4 . 1 1 162 162 GLU C C 162 178.680 178.680 177.792 0.888 25153 3689 1 4 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.205 0.526 25153 3690 1 4 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.536 -0.106 25153 3691 1 4 . 1 1 163 163 GLN N N 163 120.790 120.790 117.880 2.910 25153 3692 1 4 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.107 0.070 25153 3693 1 4 . 1 1 163 163 GLN C C 163 179.690 179.690 178.017 1.673 25153 3694 1 4 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.141 1.399 25153 3695 1 4 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.741 0.259 25153 3696 1 4 . 1 1 163 163 GLN H H 163 8.205 8.205 7.425 0.780 25153 3697 1 4 . 1 1 164 164 ILE N N 164 114.860 114.860 118.735 -3.875 25153 3698 1 4 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.865 0.178 25153 3699 1 4 . 1 1 164 164 ILE C C 164 178.680 178.680 177.320 1.360 25153 3700 1 4 . 1 1 164 164 ILE CA C 164 66.210 66.210 63.994 2.216 25153 3701 1 4 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.630 0.070 25153 3702 1 4 . 1 1 164 164 ILE H H 164 9.005 9.005 7.927 1.078 25153 3703 1 4 . 1 1 165 165 LEU N N 165 123.900 123.900 115.867 8.033 25153 3704 1 4 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.211 -0.061 25153 3705 1 4 . 1 1 165 165 LEU C C 165 180.520 180.520 177.262 3.258 25153 3706 1 4 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.163 1.137 25153 3707 1 4 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.228 -0.178 25153 3708 1 4 . 1 1 165 165 LEU H H 165 7.825 7.825 8.106 -0.281 25153 3709 1 4 . 1 1 166 166 ASN N N 166 120.112 120.112 117.947 2.165 25153 3710 1 4 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.763 -0.180 25153 3711 1 4 . 1 1 166 166 ASN C C 166 178.440 178.440 177.109 1.331 25153 3712 1 4 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.933 0.487 25153 3713 1 4 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.827 -1.407 25153 3714 1 4 . 1 1 166 166 ASN H H 166 7.760 7.760 7.893 -0.133 25153 3715 1 4 . 1 1 167 167 GLU N N 167 121.370 121.370 121.773 -0.403 25153 3716 1 4 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.007 0.096 25153 3717 1 4 . 1 1 167 167 GLU C C 167 180.332 180.332 179.380 0.952 25153 3718 1 4 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.737 0.413 25153 3719 1 4 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.683 1.337 25153 3720 1 4 . 1 1 168 168 MET N N 168 118.532 118.532 117.475 1.057 25153 3721 1 4 . 1 1 168 168 MET HA H 168 4.015 4.015 4.276 -0.261 25153 3722 1 4 . 1 1 168 168 MET C C 168 176.600 176.600 178.028 -1.428 25153 3723 1 4 . 1 1 168 168 MET CA C 168 59.300 59.300 59.446 -0.146 25153 3724 1 4 . 1 1 168 168 MET CB C 168 33.400 33.400 32.827 0.573 25153 3725 1 4 . 1 1 168 168 MET H H 168 8.718 8.718 8.434 0.284 25153 3726 1 4 . 1 1 169 169 ALA N N 169 121.922 121.922 121.923 -0.001 25153 3727 1 4 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.197 -0.023 25153 3728 1 4 . 1 1 169 169 ALA C C 169 179.410 179.410 179.619 -0.209 25153 3729 1 4 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.705 -0.305 25153 3730 1 4 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.535 -0.125 25153 3731 1 4 . 1 1 169 169 ALA H H 169 7.448 7.448 7.837 -0.389 25153 3732 1 4 . 1 1 170 170 GLU N N 170 117.300 117.300 116.698 0.602 25153 3733 1 4 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.107 -0.012 25153 3734 1 4 . 1 1 170 170 GLU C C 170 177.470 177.470 179.084 -1.614 25153 3735 1 4 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.674 -0.724 25153 3736 1 4 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.484 0.291 25153 3737 1 4 . 1 1 171 171 HIS N N 171 117.944 117.944 119.723 -1.779 25153 3738 1 4 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.358 0.142 25153 3739 1 4 . 1 1 171 171 HIS C C 171 175.120 175.120 176.757 -1.637 25153 3740 1 4 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.750 -1.550 25153 3741 1 4 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.007 0.593 25153 3742 1 4 . 1 1 171 171 HIS H H 171 7.788 7.788 7.708 0.080 25153 3743 1 4 . 1 1 172 172 TYR N N 172 120.040 120.040 118.953 1.087 25153 3744 1 4 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.301 0.292 25153 3745 1 4 . 1 1 172 172 TYR C C 172 174.612 174.612 175.685 -1.073 25153 3746 1 4 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.536 -0.556 25153 3747 1 4 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.696 0.284 25153 3748 1 4 . 1 1 172 172 TYR H H 172 7.820 7.820 7.987 -0.167 25153 3749 1 5 . 1 1 2 2 ASN N N 2 123.320 123.320 117.051 6.269 25153 3750 1 5 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.415 -0.207 25153 3751 1 5 . 1 1 2 2 ASN C C 2 174.590 174.590 173.807 0.783 25153 3752 1 5 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.597 0.403 25153 3753 1 5 . 1 1 2 2 ASN CB C 2 39.970 39.970 42.681 -2.712 25153 3754 1 5 . 1 1 2 2 ASN H H 2 9.428 9.428 9.318 0.110 25153 3755 1 5 . 1 1 3 3 MET N N 3 120.920 120.920 118.433 2.487 25153 3756 1 5 . 1 1 3 3 MET HA H 3 5.530 5.530 5.470 0.060 25153 3757 1 5 . 1 1 3 3 MET C C 3 174.400 174.400 174.751 -0.351 25153 3758 1 5 . 1 1 3 3 MET CA C 3 54.643 54.643 54.178 0.465 25153 3759 1 5 . 1 1 3 3 MET CB C 3 34.637 34.637 37.870 -3.233 25153 3760 1 5 . 1 1 3 3 MET H H 3 8.751 8.751 9.338 -0.587 25153 3761 1 5 . 1 1 4 4 GLY N N 4 115.542 115.542 109.094 6.448 25153 3762 1 5 . 1 1 4 4 GLY C C 4 170.413 170.413 172.109 -1.696 25153 3763 1 5 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.672 -0.570 25153 3764 1 5 . 1 1 4 4 GLY H H 4 8.927 8.927 8.812 0.115 25153 3765 1 5 . 1 1 5 5 LEU N N 5 131.030 131.030 128.037 2.993 25153 3766 1 5 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.290 1.112 25153 3767 1 5 . 1 1 5 5 LEU C C 5 175.952 175.952 174.489 1.463 25153 3768 1 5 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.010 0.440 25153 3769 1 5 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.887 2.705 25153 3770 1 5 . 1 1 5 5 LEU H H 5 8.928 8.928 8.590 0.338 25153 3771 1 5 . 1 1 6 6 PHE N N 6 125.790 125.790 126.273 -0.483 25153 3772 1 5 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.781 -0.041 25153 3773 1 5 . 1 1 6 6 PHE C C 6 174.300 174.300 175.863 -1.563 25153 3774 1 5 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.357 -1.037 25153 3775 1 5 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.495 -0.265 25153 3776 1 5 . 1 1 6 6 PHE H H 6 9.237 9.237 9.381 -0.144 25153 3777 1 5 . 1 1 7 7 TYR N N 7 117.289 117.289 117.399 -0.110 25153 3778 1 5 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.945 0.020 25153 3779 1 5 . 1 1 7 7 TYR C C 7 171.262 171.262 173.324 -2.062 25153 3780 1 5 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.324 -0.924 25153 3781 1 5 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.217 0.023 25153 3782 1 5 . 1 1 7 7 TYR H H 7 8.125 8.125 8.442 -0.317 25153 3783 1 5 . 1 1 8 8 GLY N N 8 107.420 107.420 106.327 1.093 25153 3784 1 5 . 1 1 8 8 GLY C C 8 172.000 172.000 172.227 -0.227 25153 3785 1 5 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.407 -0.463 25153 3786 1 5 . 1 1 8 8 GLY H H 8 7.031 7.031 8.436 -1.405 25153 3787 1 5 . 1 1 9 9 SER N N 9 118.150 118.150 115.626 2.524 25153 3788 1 5 . 1 1 9 9 SER HA H 9 5.200 5.200 5.130 0.070 25153 3789 1 5 . 1 1 9 9 SER C C 9 175.000 175.000 174.212 0.788 25153 3790 1 5 . 1 1 9 9 SER CA C 9 57.570 57.570 57.360 0.210 25153 3791 1 5 . 1 1 9 9 SER CB C 9 66.700 66.700 66.189 0.511 25153 3792 1 5 . 1 1 9 9 SER H H 9 9.604 9.604 8.293 1.311 25153 3793 1 5 . 1 1 10 10 SER N N 10 131.193 131.193 119.624 11.569 25153 3794 1 5 . 1 1 10 10 SER HA H 10 4.775 4.775 4.413 0.362 25153 3795 1 5 . 1 1 10 10 SER C C 10 175.730 175.730 175.561 0.169 25153 3796 1 5 . 1 1 10 10 SER CA C 10 61.750 61.750 60.344 1.406 25153 3797 1 5 . 1 1 10 10 SER CB C 10 64.400 64.400 63.551 0.849 25153 3798 1 5 . 1 1 10 10 SER H H 10 11.636 11.636 9.070 2.566 25153 3799 1 5 . 1 1 11 11 THR N N 11 115.848 115.848 115.967 -0.119 25153 3800 1 5 . 1 1 11 11 THR HA H 11 4.770 4.770 4.202 0.568 25153 3801 1 5 . 1 1 11 11 THR C C 11 173.700 173.700 174.687 -0.987 25153 3802 1 5 . 1 1 11 11 THR CA C 11 60.700 60.700 62.409 -1.709 25153 3803 1 5 . 1 1 11 11 THR CB C 11 67.430 67.430 69.384 -1.954 25153 3804 1 5 . 1 1 11 11 THR H H 11 9.550 9.550 8.471 1.079 25153 3805 1 5 . 1 1 12 12 CYS N N 12 109.780 109.780 114.550 -4.770 25153 3806 1 5 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.742 -0.672 25153 3807 1 5 . 1 1 12 12 CYS C C 12 176.220 176.220 175.251 0.969 25153 3808 1 5 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.301 5.299 25153 3809 1 5 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.857 -1.457 25153 3810 1 5 . 1 1 12 12 CYS H H 12 7.437 7.437 7.435 0.002 25153 3811 1 5 . 1 1 13 13 TYR N N 13 127.830 127.830 123.086 4.744 25153 3812 1 5 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.303 -0.200 25153 3813 1 5 . 1 1 13 13 TYR C C 13 180.880 180.880 177.821 3.059 25153 3814 1 5 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.164 3.936 25153 3815 1 5 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.646 -0.811 25153 3816 1 5 . 1 1 13 13 TYR H H 13 10.886 10.886 7.150 3.736 25153 3817 1 5 . 1 1 14 14 THR N N 14 124.428 124.428 113.942 10.486 25153 3818 1 5 . 1 1 14 14 THR HA H 14 4.160 4.160 4.069 0.091 25153 3819 1 5 . 1 1 14 14 THR C C 14 177.760 177.760 176.086 1.674 25153 3820 1 5 . 1 1 14 14 THR CA C 14 67.823 67.823 66.963 0.860 25153 3821 1 5 . 1 1 14 14 THR CB C 14 68.040 68.040 68.404 -0.364 25153 3822 1 5 . 1 1 14 14 THR H H 14 11.405 11.405 8.598 2.807 25153 3823 1 5 . 1 1 15 15 GLU N N 15 123.050 123.050 123.078 -0.028 25153 3824 1 5 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.250 -0.360 25153 3825 1 5 . 1 1 15 15 GLU C C 15 176.392 176.392 178.176 -1.784 25153 3826 1 5 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.511 -0.311 25153 3827 1 5 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.358 1.092 25153 3828 1 5 . 1 1 16 16 MET N N 16 120.173 120.173 118.456 1.717 25153 3829 1 5 . 1 1 16 16 MET HA H 16 4.050 4.050 4.149 -0.099 25153 3830 1 5 . 1 1 16 16 MET C C 16 179.940 179.940 178.736 1.204 25153 3831 1 5 . 1 1 16 16 MET CA C 16 59.240 59.240 59.219 0.021 25153 3832 1 5 . 1 1 16 16 MET CB C 16 32.970 32.970 32.858 0.112 25153 3833 1 5 . 1 1 16 16 MET H H 16 8.469 8.469 8.464 0.005 25153 3834 1 5 . 1 1 17 17 ALA N N 17 121.930 121.930 121.795 0.135 25153 3835 1 5 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.858 -0.022 25153 3836 1 5 . 1 1 17 17 ALA C C 17 177.900 177.900 178.755 -0.855 25153 3837 1 5 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.162 0.038 25153 3838 1 5 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.119 -0.119 25153 3839 1 5 . 1 1 17 17 ALA H H 17 7.880 7.880 8.453 -0.573 25153 3840 1 5 . 1 1 18 18 ALA N N 18 121.477 121.477 121.435 0.042 25153 3841 1 5 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.837 -0.100 25153 3842 1 5 . 1 1 18 18 ALA C C 18 179.380 179.380 179.572 -0.192 25153 3843 1 5 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.168 -0.168 25153 3844 1 5 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.810 1.020 25153 3845 1 5 . 1 1 18 18 ALA H H 18 7.374 7.374 8.128 -0.754 25153 3846 1 5 . 1 1 19 19 GLU N N 19 116.650 116.650 118.090 -1.440 25153 3847 1 5 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.848 -0.232 25153 3848 1 5 . 1 1 19 19 GLU C C 19 178.479 178.479 179.297 -0.818 25153 3849 1 5 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.524 0.206 25153 3850 1 5 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.392 -0.092 25153 3851 1 5 . 1 1 20 20 LYS N N 20 119.470 119.470 119.901 -0.431 25153 3852 1 5 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.017 0.033 25153 3853 1 5 . 1 1 20 20 LYS C C 20 179.116 179.116 179.047 0.069 25153 3854 1 5 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.462 0.368 25153 3855 1 5 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.433 0.417 25153 3856 1 5 . 1 1 21 21 ILE N N 21 121.030 121.030 120.748 0.282 25153 3857 1 5 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.671 -0.281 25153 3858 1 5 . 1 1 21 21 ILE C C 21 177.580 177.580 178.214 -0.634 25153 3859 1 5 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.761 0.059 25153 3860 1 5 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.904 0.444 25153 3861 1 5 . 1 1 21 21 ILE H H 21 8.100 8.100 8.624 -0.524 25153 3862 1 5 . 1 1 22 22 ARG N N 22 119.720 119.720 119.446 0.274 25153 3863 1 5 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.853 -0.298 25153 3864 1 5 . 1 1 22 22 ARG C C 22 177.320 177.320 178.099 -0.779 25153 3865 1 5 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.731 -0.011 25153 3866 1 5 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.755 -0.823 25153 3867 1 5 . 1 1 23 23 ASP N N 23 118.730 118.730 119.448 -0.718 25153 3868 1 5 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.415 -0.052 25153 3869 1 5 . 1 1 23 23 ASP C C 23 178.330 178.330 178.796 -0.466 25153 3870 1 5 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.354 -0.404 25153 3871 1 5 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.865 -0.625 25153 3872 1 5 . 1 1 24 24 ILE N N 24 121.090 121.090 119.505 1.585 25153 3873 1 5 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.771 0.025 25153 3874 1 5 . 1 1 24 24 ILE C C 24 178.250 178.250 177.919 0.331 25153 3875 1 5 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.832 -0.682 25153 3876 1 5 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.266 0.214 25153 3877 1 5 . 1 1 24 24 ILE H H 24 7.910 7.910 8.227 -0.317 25153 3878 1 5 . 1 1 25 25 ILE N N 25 121.406 121.406 117.188 4.218 25153 3879 1 5 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.875 -0.229 25153 3880 1 5 . 1 1 25 25 ILE C C 25 176.800 176.800 176.736 0.064 25153 3881 1 5 . 1 1 25 25 ILE CA C 25 65.700 65.700 62.973 2.727 25153 3882 1 5 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.978 -0.788 25153 3883 1 5 . 1 1 25 25 ILE H H 25 8.476 8.476 8.042 0.434 25153 3884 1 5 . 1 1 26 26 GLY N N 26 108.900 108.900 105.296 3.604 25153 3885 1 5 . 1 1 26 26 GLY C C 26 173.710 173.710 172.275 1.435 25153 3886 1 5 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.648 -0.318 25153 3887 1 5 . 1 1 26 26 GLY H H 26 8.016 8.016 7.804 0.212 25153 3888 1 5 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.717 -0.379 25153 3889 1 5 . 1 1 27 27 PRO C C 27 177.200 177.200 177.114 0.086 25153 3890 1 5 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.521 1.165 25153 3891 1 5 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.024 0.176 25153 3892 1 5 . 1 1 28 28 GLU N N 28 116.295 116.295 117.915 -1.620 25153 3893 1 5 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.213 0.057 25153 3894 1 5 . 1 1 28 28 GLU C C 28 176.980 176.980 177.340 -0.360 25153 3895 1 5 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.156 -0.415 25153 3896 1 5 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.554 -0.884 25153 3897 1 5 . 1 1 29 29 LEU N N 29 120.250 120.250 111.143 9.107 25153 3898 1 5 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.741 -0.105 25153 3899 1 5 . 1 1 29 29 LEU C C 29 175.770 175.770 176.094 -0.324 25153 3900 1 5 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.048 0.752 25153 3901 1 5 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.626 1.474 25153 3902 1 5 . 1 1 29 29 LEU H H 29 7.940 7.940 7.588 0.352 25153 3903 1 5 . 1 1 30 30 VAL N N 30 118.693 118.693 121.023 -2.330 25153 3904 1 5 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.943 -0.295 25153 3905 1 5 . 1 1 30 30 VAL C C 30 174.347 174.347 176.043 -1.696 25153 3906 1 5 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.402 -0.534 25153 3907 1 5 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.505 2.075 25153 3908 1 5 . 1 1 30 30 VAL H H 30 7.434 7.434 8.018 -0.584 25153 3909 1 5 . 1 1 31 31 THR N N 31 123.800 123.800 121.819 1.981 25153 3910 1 5 . 1 1 31 31 THR HA H 31 4.362 4.362 4.559 -0.197 25153 3911 1 5 . 1 1 31 31 THR C C 31 172.964 172.964 173.416 -0.452 25153 3912 1 5 . 1 1 31 31 THR CA C 31 61.720 61.720 60.949 0.771 25153 3913 1 5 . 1 1 31 31 THR CB C 31 70.485 70.485 71.111 -0.626 25153 3914 1 5 . 1 1 31 31 THR H H 31 7.844 7.844 8.217 -0.373 25153 3915 1 5 . 1 1 32 32 LEU N N 32 127.800 127.800 127.034 0.766 25153 3916 1 5 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.648 0.036 25153 3917 1 5 . 1 1 32 32 LEU C C 32 176.600 176.600 176.517 0.083 25153 3918 1 5 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.201 -0.046 25153 3919 1 5 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.700 1.150 25153 3920 1 5 . 1 1 32 32 LEU H H 32 8.660 8.660 8.577 0.083 25153 3921 1 5 . 1 1 33 33 HIS N N 33 119.670 119.670 119.850 -0.180 25153 3922 1 5 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.812 -0.412 25153 3923 1 5 . 1 1 33 33 HIS C C 33 171.667 171.667 173.261 -1.594 25153 3924 1 5 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.170 0.030 25153 3925 1 5 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.811 0.389 25153 3926 1 5 . 1 1 33 33 HIS H H 33 9.060 9.060 8.695 0.365 25153 3927 1 5 . 1 1 34 34 ASN N N 34 124.068 124.068 123.213 0.855 25153 3928 1 5 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.189 -0.755 25153 3929 1 5 . 1 1 34 34 ASN C C 34 178.000 178.000 175.987 2.013 25153 3930 1 5 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.973 -0.544 25153 3931 1 5 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.204 -0.644 25153 3932 1 5 . 1 1 34 34 ASN H H 34 8.780 8.780 8.581 0.199 25153 3933 1 5 . 1 1 35 35 LEU N N 35 129.040 129.040 126.520 2.520 25153 3934 1 5 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.207 0.108 25153 3935 1 5 . 1 1 35 35 LEU C C 35 177.700 177.700 177.917 -0.217 25153 3936 1 5 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.367 0.113 25153 3937 1 5 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.809 1.491 25153 3938 1 5 . 1 1 35 35 LEU H H 35 8.821 8.821 8.460 0.361 25153 3939 1 5 . 1 1 36 36 LYS N N 36 121.043 121.043 116.952 4.091 25153 3940 1 5 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.965 -0.085 25153 3941 1 5 . 1 1 36 36 LYS C C 36 176.230 176.230 177.056 -0.826 25153 3942 1 5 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.504 0.916 25153 3943 1 5 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.480 0.790 25153 3944 1 5 . 1 1 37 37 ASP N N 37 114.965 114.965 117.990 -3.025 25153 3945 1 5 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.798 -0.021 25153 3946 1 5 . 1 1 37 37 ASP C C 37 175.440 175.440 175.957 -0.517 25153 3947 1 5 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.470 0.241 25153 3948 1 5 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.564 1.136 25153 3949 1 5 . 1 1 38 38 ASP N N 38 121.650 121.650 121.709 -0.059 25153 3950 1 5 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.881 -0.011 25153 3951 1 5 . 1 1 38 38 ASP C C 38 174.852 174.852 176.002 -1.150 25153 3952 1 5 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.639 -1.559 25153 3953 1 5 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.296 -0.186 25153 3954 1 5 . 1 1 39 39 SER N N 39 115.207 115.207 117.888 -2.681 25153 3955 1 5 . 1 1 39 39 SER HA H 39 4.585 4.585 4.696 -0.111 25153 3956 1 5 . 1 1 39 39 SER C C 39 175.040 175.040 174.339 0.701 25153 3957 1 5 . 1 1 39 39 SER CA C 39 54.960 54.960 56.297 -1.337 25153 3958 1 5 . 1 1 39 39 SER CB C 39 64.720 64.720 63.629 1.091 25153 3959 1 5 . 1 1 39 39 SER H H 39 8.351 8.351 8.593 -0.242 25153 3960 1 5 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.205 -0.200 25153 3961 1 5 . 1 1 40 40 PRO C C 40 176.730 176.730 177.848 -1.118 25153 3962 1 5 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.068 -0.168 25153 3963 1 5 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.761 -0.361 25153 3964 1 5 . 1 1 41 41 LYS N N 41 121.150 121.150 119.842 1.308 25153 3965 1 5 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.987 -0.075 25153 3966 1 5 . 1 1 41 41 LYS C C 41 179.600 179.600 178.502 1.098 25153 3967 1 5 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.479 -1.279 25153 3968 1 5 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.636 0.364 25153 3969 1 5 . 1 1 42 42 LEU N N 42 118.103 118.103 116.014 2.089 25153 3970 1 5 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.220 -0.183 25153 3971 1 5 . 1 1 42 42 LEU C C 42 178.760 178.760 178.739 0.021 25153 3972 1 5 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.229 -0.049 25153 3973 1 5 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.489 1.484 25153 3974 1 5 . 1 1 42 42 LEU H H 42 7.600 7.600 7.501 0.099 25153 3975 1 5 . 1 1 43 43 MET N N 43 118.917 118.917 116.911 2.006 25153 3976 1 5 . 1 1 43 43 MET HA H 43 3.750 3.750 4.459 -0.709 25153 3977 1 5 . 1 1 43 43 MET C C 43 177.680 177.680 176.897 0.783 25153 3978 1 5 . 1 1 43 43 MET CA C 43 59.730 59.730 58.032 1.698 25153 3979 1 5 . 1 1 43 43 MET CB C 43 32.700 32.700 31.854 0.846 25153 3980 1 5 . 1 1 43 43 MET H H 43 8.202 8.202 8.051 0.151 25153 3981 1 5 . 1 1 44 44 GLU N N 44 110.924 110.924 117.963 -7.039 25153 3982 1 5 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.231 -0.491 25153 3983 1 5 . 1 1 44 44 GLU C C 44 178.130 178.130 178.879 -0.749 25153 3984 1 5 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.290 1.110 25153 3985 1 5 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.957 -0.407 25153 3986 1 5 . 1 1 45 45 GLN N N 45 115.756 115.756 118.081 -2.325 25153 3987 1 5 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.031 0.152 25153 3988 1 5 . 1 1 45 45 GLN C C 45 175.414 175.414 177.276 -1.862 25153 3989 1 5 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.582 -1.402 25153 3990 1 5 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.069 -0.469 25153 3991 1 5 . 1 1 45 45 GLN H H 45 7.516 7.516 7.492 0.024 25153 3992 1 5 . 1 1 46 46 TYR N N 46 117.860 117.860 118.624 -0.764 25153 3993 1 5 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.320 0.343 25153 3994 1 5 . 1 1 46 46 TYR C C 46 175.500 175.500 176.578 -1.078 25153 3995 1 5 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.287 -0.801 25153 3996 1 5 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.603 2.867 25153 3997 1 5 . 1 1 46 46 TYR H H 46 6.996 6.996 7.308 -0.312 25153 3998 1 5 . 1 1 47 47 ASP N N 47 121.683 121.683 120.365 1.318 25153 3999 1 5 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.632 0.068 25153 4000 1 5 . 1 1 47 47 ASP C C 47 175.610 175.610 175.766 -0.156 25153 4001 1 5 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.441 -0.740 25153 4002 1 5 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.889 1.111 25153 4003 1 5 . 1 1 48 48 VAL N N 48 118.628 118.628 115.894 2.734 25153 4004 1 5 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.682 0.352 25153 4005 1 5 . 1 1 48 48 VAL C C 48 174.190 174.190 173.796 0.394 25153 4006 1 5 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.125 -0.935 25153 4007 1 5 . 1 1 48 48 VAL CB C 48 36.100 36.100 36.143 -0.043 25153 4008 1 5 . 1 1 48 48 VAL H H 48 7.628 7.628 7.342 0.286 25153 4009 1 5 . 1 1 49 49 LEU N N 49 128.190 128.190 123.217 4.973 25153 4010 1 5 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.446 0.157 25153 4011 1 5 . 1 1 49 49 LEU C C 49 174.880 174.880 175.743 -0.863 25153 4012 1 5 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.558 -0.318 25153 4013 1 5 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.509 -0.169 25153 4014 1 5 . 1 1 49 49 LEU H H 49 9.407 9.407 9.049 0.358 25153 4015 1 5 . 1 1 50 50 ILE N N 50 124.550 124.550 120.443 4.107 25153 4016 1 5 . 1 1 50 50 ILE HA H 50 5.700 5.700 4.971 0.729 25153 4017 1 5 . 1 1 50 50 ILE C C 50 175.300 175.300 174.674 0.626 25153 4018 1 5 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.060 -1.196 25153 4019 1 5 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.785 -0.534 25153 4020 1 5 . 1 1 50 50 ILE H H 50 9.238 9.238 9.117 0.121 25153 4021 1 5 . 1 1 51 51 LEU N N 51 127.460 127.460 128.433 -0.973 25153 4022 1 5 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.830 0.355 25153 4023 1 5 . 1 1 51 51 LEU C C 51 174.544 174.544 175.896 -1.352 25153 4024 1 5 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.593 -0.773 25153 4025 1 5 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.025 -2.388 25153 4026 1 5 . 1 1 51 51 LEU H H 51 9.228 9.228 9.120 0.108 25153 4027 1 5 . 1 1 52 52 GLY N N 52 107.760 107.760 111.579 -3.819 25153 4028 1 5 . 1 1 52 52 GLY C C 52 174.710 174.710 172.483 2.227 25153 4029 1 5 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.823 0.047 25153 4030 1 5 . 1 1 52 52 GLY H H 52 8.860 8.860 9.082 -0.222 25153 4031 1 5 . 1 1 53 53 ILE N N 53 123.890 123.890 120.307 3.583 25153 4032 1 5 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.811 0.459 25153 4033 1 5 . 1 1 53 53 ILE C C 53 172.630 172.630 173.231 -0.601 25153 4034 1 5 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.669 0.011 25153 4035 1 5 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.251 3.909 25153 4036 1 5 . 1 1 53 53 ILE H H 53 8.458 8.458 8.002 0.456 25153 4037 1 5 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.918 0.470 25153 4038 1 5 . 1 1 54 54 PRO C C 54 175.000 175.000 176.434 -1.434 25153 4039 1 5 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.866 -0.266 25153 4040 1 5 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.927 -0.627 25153 4041 1 5 . 1 1 55 55 THR N N 55 112.754 112.754 118.308 -5.554 25153 4042 1 5 . 1 1 55 55 THR HA H 55 4.452 4.452 4.856 -0.404 25153 4043 1 5 . 1 1 55 55 THR C C 55 172.480 172.480 174.029 -1.549 25153 4044 1 5 . 1 1 55 55 THR CA C 55 62.350 62.350 63.322 -0.972 25153 4045 1 5 . 1 1 55 55 THR CB C 55 70.230 70.230 70.137 0.093 25153 4046 1 5 . 1 1 55 55 THR H H 55 6.523 6.523 8.082 -1.559 25153 4047 1 5 . 1 1 56 56 TRP N N 56 130.044 130.044 127.122 2.922 25153 4048 1 5 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.571 -1.856 25153 4049 1 5 . 1 1 56 56 TRP C C 56 172.890 172.890 175.287 -2.397 25153 4050 1 5 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.376 0.274 25153 4051 1 5 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.315 0.685 25153 4052 1 5 . 1 1 56 56 TRP H H 56 8.450 8.450 8.760 -0.310 25153 4053 1 5 . 1 1 57 57 ASP N N 57 115.275 115.275 121.165 -5.890 25153 4054 1 5 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.894 0.458 25153 4055 1 5 . 1 1 57 57 ASP C C 57 173.660 173.660 174.748 -1.088 25153 4056 1 5 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.126 1.104 25153 4057 1 5 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.757 0.413 25153 4058 1 5 . 1 1 58 58 PHE N N 58 112.840 112.840 116.111 -3.271 25153 4059 1 5 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.626 -0.302 25153 4060 1 5 . 1 1 58 58 PHE C C 58 175.730 175.730 176.277 -0.547 25153 4061 1 5 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.588 1.235 25153 4062 1 5 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.120 -2.366 25153 4063 1 5 . 1 1 58 58 PHE H H 58 7.640 7.640 7.409 0.231 25153 4064 1 5 . 1 1 59 59 GLY N N 59 104.940 104.940 107.377 -2.437 25153 4065 1 5 . 1 1 59 59 GLY C C 59 173.750 173.750 174.358 -0.608 25153 4066 1 5 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.216 1.074 25153 4067 1 5 . 1 1 59 59 GLY H H 59 8.024 8.024 8.801 -0.777 25153 4068 1 5 . 1 1 60 60 GLU N N 60 120.045 120.045 119.030 1.015 25153 4069 1 5 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.657 -0.244 25153 4070 1 5 . 1 1 60 60 GLU C C 60 176.050 176.050 175.727 0.323 25153 4071 1 5 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.679 -0.059 25153 4072 1 5 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.755 -1.145 25153 4073 1 5 . 1 1 61 61 ILE N N 61 120.790 120.790 120.816 -0.026 25153 4074 1 5 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.213 -0.746 25153 4075 1 5 . 1 1 61 61 ILE C C 61 175.130 175.130 176.105 -0.975 25153 4076 1 5 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.985 0.562 25153 4077 1 5 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.169 -0.319 25153 4078 1 5 . 1 1 61 61 ILE H H 61 8.200 8.200 8.489 -0.289 25153 4079 1 5 . 1 1 62 62 GLN N N 62 124.520 124.520 124.599 -0.079 25153 4080 1 5 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.182 -0.226 25153 4081 1 5 . 1 1 62 62 GLN C C 62 177.160 177.160 176.979 0.181 25153 4082 1 5 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.752 1.859 25153 4083 1 5 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.231 -2.581 25153 4084 1 5 . 1 1 62 62 GLN H H 62 5.667 5.667 8.833 -3.166 25153 4085 1 5 . 1 1 63 63 GLU N N 63 124.570 124.570 125.836 -1.266 25153 4086 1 5 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.198 -0.212 25153 4087 1 5 . 1 1 63 63 GLU C C 63 177.300 177.300 177.194 0.106 25153 4088 1 5 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.969 1.751 25153 4089 1 5 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.220 0.900 25153 4090 1 5 . 1 1 64 64 ASP N N 64 119.060 119.060 119.566 -0.506 25153 4091 1 5 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.411 0.209 25153 4092 1 5 . 1 1 64 64 ASP C C 64 179.180 179.180 177.242 1.938 25153 4093 1 5 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.957 0.993 25153 4094 1 5 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.153 0.798 25153 4095 1 5 . 1 1 65 65 TRP N N 65 121.070 121.070 120.876 0.194 25153 4096 1 5 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.530 -0.190 25153 4097 1 5 . 1 1 65 65 TRP C C 65 178.970 178.970 178.085 0.885 25153 4098 1 5 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.651 0.169 25153 4099 1 5 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.590 -0.191 25153 4100 1 5 . 1 1 65 65 TRP H H 65 7.350 7.350 8.084 -0.734 25153 4101 1 5 . 1 1 66 66 GLU N N 66 120.900 120.900 119.059 1.841 25153 4102 1 5 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.895 -0.055 25153 4103 1 5 . 1 1 66 66 GLU C C 66 178.750 178.750 179.120 -0.370 25153 4104 1 5 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.487 0.513 25153 4105 1 5 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.284 -0.424 25153 4106 1 5 . 1 1 67 67 ALA N N 67 119.130 119.130 120.272 -1.142 25153 4107 1 5 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.262 -0.009 25153 4108 1 5 . 1 1 67 67 ALA C C 67 179.410 179.410 179.198 0.212 25153 4109 1 5 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.868 -0.288 25153 4110 1 5 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.872 -0.062 25153 4111 1 5 . 1 1 67 67 ALA H H 67 7.640 7.640 8.185 -0.545 25153 4112 1 5 . 1 1 68 68 VAL N N 68 106.845 106.845 112.120 -5.275 25153 4113 1 5 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.520 0.290 25153 4114 1 5 . 1 1 68 68 VAL C C 68 176.750 176.750 176.952 -0.202 25153 4115 1 5 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.178 -2.568 25153 4116 1 5 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.209 0.411 25153 4117 1 5 . 1 1 68 68 VAL H H 68 7.219 7.219 7.634 -0.415 25153 4118 1 5 . 1 1 69 69 TRP N N 69 127.630 127.630 124.215 3.415 25153 4119 1 5 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.315 -0.077 25153 4120 1 5 . 1 1 69 69 TRP C C 69 178.670 178.670 177.220 1.450 25153 4121 1 5 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.347 -1.127 25153 4122 1 5 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.320 2.310 25153 4123 1 5 . 1 1 69 69 TRP H H 69 7.832 7.832 8.591 -0.759 25153 4124 1 5 . 1 1 70 70 ASP N N 70 114.544 114.544 118.307 -3.763 25153 4125 1 5 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.459 0.063 25153 4126 1 5 . 1 1 70 70 ASP C C 70 178.670 178.670 178.991 -0.321 25153 4127 1 5 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.253 -1.253 25153 4128 1 5 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.993 -1.143 25153 4129 1 5 . 1 1 71 71 GLN N N 71 120.040 120.040 119.427 0.613 25153 4130 1 5 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.122 0.062 25153 4131 1 5 . 1 1 71 71 GLN C C 71 178.910 178.910 178.824 0.086 25153 4132 1 5 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.331 -0.721 25153 4133 1 5 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.824 0.276 25153 4134 1 5 . 1 1 71 71 GLN H H 71 7.995 7.995 7.713 0.282 25153 4135 1 5 . 1 1 72 72 LEU N N 72 117.400 117.400 119.167 -1.767 25153 4136 1 5 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.928 -0.115 25153 4137 1 5 . 1 1 72 72 LEU C C 72 178.650 178.650 178.026 0.624 25153 4138 1 5 . 1 1 72 72 LEU CA C 72 57.200 57.200 56.954 0.246 25153 4139 1 5 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.343 0.067 25153 4140 1 5 . 1 1 72 72 LEU H H 72 7.450 7.450 7.678 -0.228 25153 4141 1 5 . 1 1 73 73 ASP N N 73 115.750 115.750 117.617 -1.867 25153 4142 1 5 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.395 -0.227 25153 4143 1 5 . 1 1 73 73 ASP C C 73 177.560 177.560 177.183 0.377 25153 4144 1 5 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.605 0.795 25153 4145 1 5 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.622 -1.522 25153 4146 1 5 . 1 1 74 74 ASP N N 74 117.223 117.223 119.771 -2.548 25153 4147 1 5 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.560 0.143 25153 4148 1 5 . 1 1 74 74 ASP C C 74 176.388 176.388 177.231 -0.843 25153 4149 1 5 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.270 -0.770 25153 4150 1 5 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.552 0.148 25153 4151 1 5 . 1 1 75 75 LEU N N 75 118.316 118.316 119.507 -1.191 25153 4152 1 5 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.406 -0.121 25153 4153 1 5 . 1 1 75 75 LEU C C 75 176.820 176.820 175.932 0.888 25153 4154 1 5 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.548 -0.148 25153 4155 1 5 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.351 0.929 25153 4156 1 5 . 1 1 75 75 LEU H H 75 6.960 6.960 7.503 -0.543 25153 4157 1 5 . 1 1 76 76 ASN N N 76 123.045 123.045 118.103 4.942 25153 4158 1 5 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.071 -0.181 25153 4159 1 5 . 1 1 76 76 ASN C C 76 174.950 174.950 174.944 0.006 25153 4160 1 5 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.429 -0.379 25153 4161 1 5 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.788 -1.288 25153 4162 1 5 . 1 1 76 76 ASN H H 76 9.890 9.890 8.715 1.175 25153 4163 1 5 . 1 1 77 77 LEU N N 77 123.494 123.494 122.512 0.982 25153 4164 1 5 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.523 -0.153 25153 4165 1 5 . 1 1 77 77 LEU C C 77 175.040 175.040 175.940 -0.900 25153 4166 1 5 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.476 -1.226 25153 4167 1 5 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.448 0.452 25153 4168 1 5 . 1 1 77 77 LEU H H 77 8.730 8.730 7.780 0.950 25153 4169 1 5 . 1 1 78 78 GLU N N 78 120.870 120.870 120.903 -0.033 25153 4170 1 5 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.461 -0.561 25153 4171 1 5 . 1 1 78 78 GLU C C 78 178.660 178.660 177.760 0.900 25153 4172 1 5 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.160 1.600 25153 4173 1 5 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.250 1.151 25153 4174 1 5 . 1 1 79 79 GLY N N 79 113.240 113.240 113.923 -0.683 25153 4175 1 5 . 1 1 79 79 GLY C C 79 174.460 174.460 173.430 1.030 25153 4176 1 5 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.442 -0.012 25153 4177 1 5 . 1 1 79 79 GLY H H 79 8.474 8.474 8.690 -0.216 25153 4178 1 5 . 1 1 80 80 LYS N N 80 120.295 120.295 117.151 3.144 25153 4179 1 5 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.777 -0.419 25153 4180 1 5 . 1 1 80 80 LYS C C 80 175.360 175.360 174.846 0.514 25153 4181 1 5 . 1 1 80 80 LYS CA C 80 56.970 56.970 54.015 2.955 25153 4182 1 5 . 1 1 80 80 LYS CB C 80 33.200 33.200 35.873 -2.674 25153 4183 1 5 . 1 1 81 81 ILE N N 81 122.400 122.400 119.745 2.655 25153 4184 1 5 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.750 0.043 25153 4185 1 5 . 1 1 81 81 ILE C C 81 174.760 174.760 175.272 -0.512 25153 4186 1 5 . 1 1 81 81 ILE CA C 81 59.830 59.830 60.405 -0.575 25153 4187 1 5 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.913 -1.213 25153 4188 1 5 . 1 1 81 81 ILE H H 81 7.400 7.400 7.874 -0.474 25153 4189 1 5 . 1 1 82 82 VAL N N 82 127.840 127.840 123.428 4.412 25153 4190 1 5 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.979 0.283 25153 4191 1 5 . 1 1 82 82 VAL C C 82 172.724 172.724 174.296 -1.572 25153 4192 1 5 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.410 -0.000 25153 4193 1 5 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.163 0.237 25153 4194 1 5 . 1 1 82 82 VAL H H 82 8.790 8.790 8.744 0.046 25153 4195 1 5 . 1 1 83 83 ALA N N 83 131.347 131.347 130.321 1.026 25153 4196 1 5 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.241 0.141 25153 4197 1 5 . 1 1 83 83 ALA C C 83 175.750 175.750 176.372 -0.622 25153 4198 1 5 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.157 -0.287 25153 4199 1 5 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.031 2.419 25153 4200 1 5 . 1 1 83 83 ALA H H 83 9.300 9.300 8.874 0.426 25153 4201 1 5 . 1 1 84 84 LEU N N 84 124.200 124.200 126.608 -2.408 25153 4202 1 5 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.649 -0.129 25153 4203 1 5 . 1 1 84 84 LEU C C 84 175.760 175.760 176.831 -1.071 25153 4204 1 5 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.892 -0.392 25153 4205 1 5 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.410 1.490 25153 4206 1 5 . 1 1 84 84 LEU H H 84 10.287 10.287 8.994 1.293 25153 4207 1 5 . 1 1 85 85 TYR N N 85 115.912 115.912 119.204 -3.292 25153 4208 1 5 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.330 -0.370 25153 4209 1 5 . 1 1 85 85 TYR C C 85 172.372 172.372 173.807 -1.435 25153 4210 1 5 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.133 0.967 25153 4211 1 5 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.475 1.555 25153 4212 1 5 . 1 1 85 85 TYR H H 85 9.257 9.257 8.835 0.421 25153 4213 1 5 . 1 1 86 86 GLY N N 86 107.800 107.800 105.561 2.239 25153 4214 1 5 . 1 1 86 86 GLY C C 86 170.330 170.330 171.478 -1.148 25153 4215 1 5 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.791 -0.421 25153 4216 1 5 . 1 1 86 86 GLY H H 86 9.027 9.027 8.695 0.332 25153 4217 1 5 . 1 1 87 87 LEU N N 87 123.458 123.458 118.662 4.796 25153 4218 1 5 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.323 0.142 25153 4219 1 5 . 1 1 87 87 LEU C C 87 178.100 178.100 175.988 2.112 25153 4220 1 5 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.864 0.727 25153 4221 1 5 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.260 0.080 25153 4222 1 5 . 1 1 87 87 LEU H H 87 6.580 6.580 7.861 -1.281 25153 4223 1 5 . 1 1 88 88 GLY N N 88 108.966 108.966 107.797 1.169 25153 4224 1 5 . 1 1 88 88 GLY C C 88 172.820 172.820 171.559 1.261 25153 4225 1 5 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.246 1.414 25153 4226 1 5 . 1 1 88 88 GLY H H 88 8.070 8.070 8.477 -0.407 25153 4227 1 5 . 1 1 89 89 ASP N N 89 121.150 121.150 116.901 4.249 25153 4228 1 5 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.109 0.137 25153 4229 1 5 . 1 1 89 89 ASP C C 89 176.220 176.220 176.259 -0.039 25153 4230 1 5 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.023 -0.553 25153 4231 1 5 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.011 -1.531 25153 4232 1 5 . 1 1 90 90 GLN N N 90 123.970 123.970 122.890 1.080 25153 4233 1 5 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.250 -0.762 25153 4234 1 5 . 1 1 90 90 GLN C C 90 173.646 173.646 176.445 -2.799 25153 4235 1 5 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.719 0.591 25153 4236 1 5 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.809 -0.599 25153 4237 1 5 . 1 1 90 90 GLN H H 90 8.623 8.623 8.852 -0.229 25153 4238 1 5 . 1 1 91 91 LEU N N 91 118.017 118.017 119.866 -1.849 25153 4239 1 5 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.100 0.275 25153 4240 1 5 . 1 1 91 91 LEU C C 91 180.160 180.160 178.545 1.615 25153 4241 1 5 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.382 -0.322 25153 4242 1 5 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.003 -0.453 25153 4243 1 5 . 1 1 91 91 LEU H H 91 7.046 7.046 8.746 -1.700 25153 4244 1 5 . 1 1 92 92 GLY N N 92 110.028 110.028 104.374 5.654 25153 4245 1 5 . 1 1 92 92 GLY C C 92 174.912 174.912 174.561 0.351 25153 4246 1 5 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.073 1.107 25153 4247 1 5 . 1 1 92 92 GLY H H 92 9.238 9.238 8.652 0.586 25153 4248 1 5 . 1 1 93 93 TYR N N 93 115.910 115.910 119.152 -3.242 25153 4249 1 5 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.386 -0.377 25153 4250 1 5 . 1 1 93 93 TYR C C 93 176.850 176.850 176.944 -0.094 25153 4251 1 5 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.334 0.396 25153 4252 1 5 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.818 -0.688 25153 4253 1 5 . 1 1 93 93 TYR H H 93 6.962 6.962 7.652 -0.690 25153 4254 1 5 . 1 1 94 94 GLY N N 94 111.630 111.630 110.632 0.998 25153 4255 1 5 . 1 1 94 94 GLY C C 94 177.777 177.777 175.348 2.429 25153 4256 1 5 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.611 2.419 25153 4257 1 5 . 1 1 94 94 GLY H H 94 7.835 7.835 8.148 -0.313 25153 4258 1 5 . 1 1 95 95 GLU N N 95 122.450 122.450 119.136 3.314 25153 4259 1 5 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.918 0.000 25153 4260 1 5 . 1 1 95 95 GLU C C 95 175.300 175.300 176.495 -1.195 25153 4261 1 5 . 1 1 95 95 GLU CA C 95 58.100 58.100 57.929 0.171 25153 4262 1 5 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.084 -0.574 25153 4263 1 5 . 1 1 96 96 TRP N N 96 118.790 118.790 116.560 2.230 25153 4264 1 5 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.899 0.545 25153 4265 1 5 . 1 1 96 96 TRP C C 96 179.280 179.280 175.891 3.389 25153 4266 1 5 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.935 1.080 25153 4267 1 5 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.375 -0.355 25153 4268 1 5 . 1 1 96 96 TRP H H 96 8.070 8.070 7.944 0.126 25153 4269 1 5 . 1 1 97 97 PHE N N 97 128.067 128.067 123.645 4.422 25153 4270 1 5 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.304 1.001 25153 4271 1 5 . 1 1 97 97 PHE C C 97 173.227 173.227 175.726 -2.499 25153 4272 1 5 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.873 -3.153 25153 4273 1 5 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.529 0.411 25153 4274 1 5 . 1 1 97 97 PHE H H 97 7.165 7.165 8.181 -1.016 25153 4275 1 5 . 1 1 98 98 LEU N N 98 114.306 114.306 123.218 -8.912 25153 4276 1 5 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.664 -0.174 25153 4277 1 5 . 1 1 98 98 LEU C C 98 179.365 179.365 177.603 1.762 25153 4278 1 5 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.645 -0.185 25153 4279 1 5 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.871 -0.641 25153 4280 1 5 . 1 1 98 98 LEU H H 98 7.453 7.453 8.363 -0.910 25153 4281 1 5 . 1 1 99 99 ASP N N 99 122.354 122.354 120.687 1.667 25153 4282 1 5 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.299 -0.366 25153 4283 1 5 . 1 1 99 99 ASP C C 99 178.800 178.800 177.154 1.646 25153 4284 1 5 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.797 1.383 25153 4285 1 5 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.424 -0.994 25153 4286 1 5 . 1 1 100 100 ALA N N 100 118.568 118.568 121.748 -3.180 25153 4287 1 5 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.080 -0.240 25153 4288 1 5 . 1 1 100 100 ALA C C 100 178.500 178.500 179.316 -0.816 25153 4289 1 5 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.000 -0.084 25153 4290 1 5 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.369 1.291 25153 4291 1 5 . 1 1 100 100 ALA H H 100 8.682 8.682 7.876 0.806 25153 4292 1 5 . 1 1 101 101 LEU N N 101 118.815 118.815 120.651 -1.836 25153 4293 1 5 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.995 -0.315 25153 4294 1 5 . 1 1 101 101 LEU C C 101 178.930 178.930 178.822 0.108 25153 4295 1 5 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.806 -0.106 25153 4296 1 5 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.565 0.835 25153 4297 1 5 . 1 1 101 101 LEU H H 101 6.637 6.637 7.608 -0.971 25153 4298 1 5 . 1 1 102 102 GLY N N 102 103.700 103.700 106.621 -2.921 25153 4299 1 5 . 1 1 102 102 GLY C C 102 175.530 175.530 176.158 -0.628 25153 4300 1 5 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.316 0.684 25153 4301 1 5 . 1 1 102 102 GLY H H 102 7.330 7.330 7.887 -0.557 25153 4302 1 5 . 1 1 103 103 MET N N 103 120.330 120.330 121.648 -1.318 25153 4303 1 5 . 1 1 103 103 MET HA H 103 4.254 4.254 4.250 0.004 25153 4304 1 5 . 1 1 103 103 MET C C 103 179.688 179.688 178.629 1.059 25153 4305 1 5 . 1 1 103 103 MET CA C 103 59.615 59.615 59.642 -0.028 25153 4306 1 5 . 1 1 103 103 MET CB C 103 33.290 33.290 32.633 0.657 25153 4307 1 5 . 1 1 103 103 MET H H 103 8.407 8.407 8.119 0.288 25153 4308 1 5 . 1 1 104 104 LEU N N 104 123.450 123.450 119.838 3.612 25153 4309 1 5 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.690 0.506 25153 4310 1 5 . 1 1 104 104 LEU C C 104 177.620 177.620 178.770 -1.150 25153 4311 1 5 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.948 0.022 25153 4312 1 5 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.255 0.044 25153 4313 1 5 . 1 1 104 104 LEU H H 104 8.330 8.330 8.692 -0.362 25153 4314 1 5 . 1 1 105 105 HIS N N 105 119.040 119.040 119.249 -0.209 25153 4315 1 5 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.073 -0.196 25153 4316 1 5 . 1 1 105 105 HIS C C 105 177.100 177.100 177.041 0.059 25153 4317 1 5 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.839 0.131 25153 4318 1 5 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.877 -1.284 25153 4319 1 5 . 1 1 105 105 HIS H H 105 8.050 8.050 8.469 -0.419 25153 4320 1 5 . 1 1 106 106 ASP N N 106 119.950 119.950 119.169 0.781 25153 4321 1 5 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.389 -0.059 25153 4322 1 5 . 1 1 106 106 ASP C C 106 179.300 179.300 178.408 0.892 25153 4323 1 5 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.292 0.518 25153 4324 1 5 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.166 -0.766 25153 4325 1 5 . 1 1 107 107 LYS N N 107 122.060 122.060 120.016 2.044 25153 4326 1 5 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.057 0.076 25153 4327 1 5 . 1 1 107 107 LYS C C 107 178.100 178.100 179.445 -1.345 25153 4328 1 5 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.705 -0.505 25153 4329 1 5 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.160 0.200 25153 4330 1 5 . 1 1 108 108 LEU N N 108 115.610 115.610 117.753 -2.143 25153 4331 1 5 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.131 -0.063 25153 4332 1 5 . 1 1 108 108 LEU C C 108 178.866 178.866 178.230 0.636 25153 4333 1 5 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.769 -0.815 25153 4334 1 5 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.531 0.629 25153 4335 1 5 . 1 1 108 108 LEU H H 108 7.828 7.828 8.440 -0.612 25153 4336 1 5 . 1 1 109 109 SER N N 109 116.362 116.362 114.902 1.460 25153 4337 1 5 . 1 1 109 109 SER HA H 109 4.299 4.299 4.305 -0.006 25153 4338 1 5 . 1 1 109 109 SER C C 109 175.660 175.660 176.768 -1.108 25153 4339 1 5 . 1 1 109 109 SER CA C 109 62.350 62.350 61.447 0.903 25153 4340 1 5 . 1 1 109 109 SER CB C 109 62.815 62.815 63.127 -0.312 25153 4341 1 5 . 1 1 109 109 SER H H 109 8.278 8.278 8.528 -0.250 25153 4342 1 5 . 1 1 110 110 THR N N 110 110.230 110.230 115.812 -5.582 25153 4343 1 5 . 1 1 110 110 THR HA H 110 4.615 4.615 4.278 0.337 25153 4344 1 5 . 1 1 110 110 THR C C 110 175.990 175.990 175.457 0.533 25153 4345 1 5 . 1 1 110 110 THR CA C 110 62.090 62.090 64.277 -2.187 25153 4346 1 5 . 1 1 110 110 THR CB C 110 68.800 68.800 68.494 0.306 25153 4347 1 5 . 1 1 110 110 THR H H 110 7.211 7.211 7.824 -0.613 25153 4348 1 5 . 1 1 111 111 LYS N N 111 119.900 119.900 119.668 0.232 25153 4349 1 5 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.569 -0.057 25153 4350 1 5 . 1 1 111 111 LYS C C 111 176.916 176.916 176.428 0.488 25153 4351 1 5 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.076 0.578 25153 4352 1 5 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.168 -1.325 25153 4353 1 5 . 1 1 112 112 GLY N N 112 107.910 107.910 108.236 -0.326 25153 4354 1 5 . 1 1 112 112 GLY C C 112 176.250 176.250 174.027 2.223 25153 4355 1 5 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.750 1.290 25153 4356 1 5 . 1 1 112 112 GLY H H 112 8.366 8.366 7.665 0.701 25153 4357 1 5 . 1 1 113 113 VAL N N 113 113.530 113.530 114.319 -0.789 25153 4358 1 5 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.616 -0.142 25153 4359 1 5 . 1 1 113 113 VAL C C 113 174.630 174.630 174.886 -0.256 25153 4360 1 5 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.403 -0.952 25153 4361 1 5 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.987 -0.437 25153 4362 1 5 . 1 1 113 113 VAL H H 113 6.903 6.903 6.891 0.012 25153 4363 1 5 . 1 1 114 114 LYS N N 114 123.020 123.020 118.835 4.185 25153 4364 1 5 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.574 -0.069 25153 4365 1 5 . 1 1 114 114 LYS C C 114 175.000 175.000 174.821 0.179 25153 4366 1 5 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.298 -0.098 25153 4367 1 5 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.372 -1.032 25153 4368 1 5 . 1 1 115 115 PHE N N 115 123.290 123.290 120.442 2.848 25153 4369 1 5 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.710 0.003 25153 4370 1 5 . 1 1 115 115 PHE C C 115 177.605 177.605 176.379 1.226 25153 4371 1 5 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.959 1.651 25153 4372 1 5 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.906 -0.905 25153 4373 1 5 . 1 1 115 115 PHE H H 115 8.494 8.494 8.428 0.066 25153 4374 1 5 . 1 1 116 116 VAL N N 116 115.790 115.790 114.747 1.043 25153 4375 1 5 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.414 0.078 25153 4376 1 5 . 1 1 116 116 VAL C C 116 175.414 175.414 176.034 -0.620 25153 4377 1 5 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.456 -0.470 25153 4378 1 5 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.593 -0.493 25153 4379 1 5 . 1 1 116 116 VAL H H 116 8.889 8.889 8.338 0.551 25153 4380 1 5 . 1 1 117 117 GLY N N 117 108.300 108.300 107.135 1.165 25153 4381 1 5 . 1 1 117 117 GLY C C 117 176.180 176.180 174.743 1.437 25153 4382 1 5 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.525 2.275 25153 4383 1 5 . 1 1 117 117 GLY H H 117 9.810 9.810 8.570 1.240 25153 4384 1 5 . 1 1 118 118 TYR N N 118 120.050 120.050 119.754 0.296 25153 4385 1 5 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.741 0.213 25153 4386 1 5 . 1 1 118 118 TYR C C 118 177.450 177.450 176.056 1.394 25153 4387 1 5 . 1 1 118 118 TYR CA C 118 56.240 56.240 58.199 -1.959 25153 4388 1 5 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.055 -2.945 25153 4389 1 5 . 1 1 118 118 TYR H H 118 8.592 8.592 7.425 1.167 25153 4390 1 5 . 1 1 119 119 TRP N N 119 125.500 125.500 122.106 3.394 25153 4391 1 5 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.146 0.882 25153 4392 1 5 . 1 1 119 119 TRP C C 119 173.090 173.090 174.266 -1.176 25153 4393 1 5 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.349 -0.449 25153 4394 1 5 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.116 3.134 25153 4395 1 5 . 1 1 119 119 TRP H H 119 7.926 7.926 8.243 -0.317 25153 4396 1 5 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.734 0.076 25153 4397 1 5 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.938 0.742 25153 4398 1 5 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.210 0.040 25153 4399 1 5 . 1 1 121 121 THR N N 121 109.114 109.114 112.625 -3.511 25153 4400 1 5 . 1 1 121 121 THR HA H 121 4.142 4.142 3.432 0.710 25153 4401 1 5 . 1 1 121 121 THR C C 121 176.300 176.300 175.263 1.037 25153 4402 1 5 . 1 1 121 121 THR CA C 121 61.230 61.230 62.351 -1.121 25153 4403 1 5 . 1 1 121 121 THR CB C 121 69.890 69.890 68.415 1.475 25153 4404 1 5 . 1 1 121 121 THR H H 121 7.356 7.356 8.365 -1.009 25153 4405 1 5 . 1 1 122 122 GLU N N 122 123.980 123.980 122.212 1.768 25153 4406 1 5 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.045 0.193 25153 4407 1 5 . 1 1 122 122 GLU C C 122 177.830 177.830 177.901 -0.071 25153 4408 1 5 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.743 0.487 25153 4409 1 5 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.461 0.309 25153 4410 1 5 . 1 1 123 123 GLY N N 123 114.570 114.570 113.351 1.219 25153 4411 1 5 . 1 1 123 123 GLY C C 123 173.700 173.700 174.545 -0.845 25153 4412 1 5 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.556 -0.156 25153 4413 1 5 . 1 1 123 123 GLY H H 123 9.181 9.181 8.659 0.522 25153 4414 1 5 . 1 1 124 124 TYR N N 124 118.923 118.923 120.678 -1.755 25153 4415 1 5 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.602 0.708 25153 4416 1 5 . 1 1 124 124 TYR C C 124 175.680 175.680 175.449 0.231 25153 4417 1 5 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.778 -2.308 25153 4418 1 5 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.415 0.585 25153 4419 1 5 . 1 1 124 124 TYR H H 124 7.877 7.877 7.792 0.085 25153 4420 1 5 . 1 1 125 125 GLU N N 125 124.890 124.890 120.909 3.981 25153 4421 1 5 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.608 0.092 25153 4422 1 5 . 1 1 125 125 GLU C C 125 172.880 172.880 175.251 -2.371 25153 4423 1 5 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.791 -0.361 25153 4424 1 5 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.127 -0.707 25153 4425 1 5 . 1 1 126 126 PHE N N 126 119.166 119.166 119.292 -0.126 25153 4426 1 5 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.502 0.307 25153 4427 1 5 . 1 1 126 126 PHE C C 126 173.750 173.750 174.689 -0.939 25153 4428 1 5 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.095 -1.305 25153 4429 1 5 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.220 0.830 25153 4430 1 5 . 1 1 126 126 PHE H H 126 7.716 7.716 7.951 -0.235 25153 4431 1 5 . 1 1 127 127 THR N N 127 106.800 106.800 115.763 -8.963 25153 4432 1 5 . 1 1 127 127 THR HA H 127 4.400 4.400 3.474 0.926 25153 4433 1 5 . 1 1 127 127 THR C C 127 175.300 175.300 173.810 1.490 25153 4434 1 5 . 1 1 127 127 THR CA C 127 61.100 61.100 63.181 -2.081 25153 4435 1 5 . 1 1 127 127 THR CB C 127 70.600 70.600 67.733 2.867 25153 4436 1 5 . 1 1 127 127 THR H H 127 7.220 7.220 6.778 0.442 25153 4437 1 5 . 1 1 128 128 SER N N 128 118.360 118.360 116.216 2.144 25153 4438 1 5 . 1 1 128 128 SER HA H 128 4.680 4.680 4.724 -0.044 25153 4439 1 5 . 1 1 128 128 SER C C 128 175.720 175.720 173.718 2.002 25153 4440 1 5 . 1 1 128 128 SER CA C 128 56.250 56.250 56.517 -0.267 25153 4441 1 5 . 1 1 128 128 SER CB C 128 65.635 65.635 64.513 1.122 25153 4442 1 5 . 1 1 128 128 SER H H 128 7.411 7.411 7.973 -0.562 25153 4443 1 5 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.564 0.211 25153 4444 1 5 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.041 -1.541 25153 4445 1 5 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.426 -0.026 25153 4446 1 5 . 1 1 130 130 LYS N N 130 122.014 122.014 119.768 2.246 25153 4447 1 5 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.374 -0.141 25153 4448 1 5 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.813 2.886 25153 4449 1 5 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.393 0.177 25153 4450 1 5 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.555 -0.037 25153 4451 1 5 . 1 1 131 131 PRO C C 131 174.000 174.000 175.080 -1.080 25153 4452 1 5 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.490 2.210 25153 4453 1 5 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.229 0.971 25153 4454 1 5 . 1 1 132 132 VAL N N 132 113.260 113.260 116.866 -3.606 25153 4455 1 5 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.862 0.338 25153 4456 1 5 . 1 1 132 132 VAL C C 132 175.210 175.210 174.894 0.316 25153 4457 1 5 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.911 -0.291 25153 4458 1 5 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.926 -0.946 25153 4459 1 5 . 1 1 132 132 VAL H H 132 6.697 6.697 7.614 -0.917 25153 4460 1 5 . 1 1 133 133 ILE N N 133 119.940 119.940 116.955 2.985 25153 4461 1 5 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.487 -0.107 25153 4462 1 5 . 1 1 133 133 ILE C C 133 175.440 175.440 175.150 0.290 25153 4463 1 5 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.974 1.476 25153 4464 1 5 . 1 1 133 133 ILE CB C 133 42.100 42.100 39.983 2.117 25153 4465 1 5 . 1 1 133 133 ILE H H 133 8.756 8.756 8.677 0.079 25153 4466 1 5 . 1 1 134 134 ALA N N 134 122.632 122.632 123.872 -1.240 25153 4467 1 5 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.879 0.081 25153 4468 1 5 . 1 1 134 134 ALA C C 134 178.312 178.312 177.196 1.116 25153 4469 1 5 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.562 -1.482 25153 4470 1 5 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.199 -0.363 25153 4471 1 5 . 1 1 134 134 ALA H H 134 8.523 8.523 8.445 0.078 25153 4472 1 5 . 1 1 135 135 ASP N N 135 117.366 117.366 122.715 -5.349 25153 4473 1 5 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.655 -0.403 25153 4474 1 5 . 1 1 135 135 ASP C C 135 176.387 176.387 176.631 -0.244 25153 4475 1 5 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.340 1.870 25153 4476 1 5 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.228 -1.528 25153 4477 1 5 . 1 1 136 136 GLY N N 136 104.310 104.310 108.065 -3.755 25153 4478 1 5 . 1 1 136 136 GLY C C 136 174.922 174.922 174.927 -0.005 25153 4479 1 5 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.378 -0.278 25153 4480 1 5 . 1 1 136 136 GLY H H 136 7.610 7.610 8.308 -0.698 25153 4481 1 5 . 1 1 137 137 GLN N N 137 118.784 118.784 117.750 1.034 25153 4482 1 5 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.408 -0.353 25153 4483 1 5 . 1 1 137 137 GLN C C 137 176.390 176.390 175.442 0.948 25153 4484 1 5 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.861 1.779 25153 4485 1 5 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.198 0.031 25153 4486 1 5 . 1 1 137 137 GLN H H 137 7.870 7.870 7.868 0.002 25153 4487 1 5 . 1 1 138 138 LEU N N 138 118.040 118.040 115.895 2.145 25153 4488 1 5 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.005 -0.018 25153 4489 1 5 . 1 1 138 138 LEU C C 138 175.913 175.913 175.140 0.773 25153 4490 1 5 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.150 0.450 25153 4491 1 5 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.843 1.557 25153 4492 1 5 . 1 1 138 138 LEU H H 138 7.356 7.356 7.175 0.181 25153 4493 1 5 . 1 1 139 139 PHE N N 139 119.060 119.060 119.237 -0.177 25153 4494 1 5 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.895 0.415 25153 4495 1 5 . 1 1 139 139 PHE C C 139 178.780 178.780 177.781 0.999 25153 4496 1 5 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.497 -0.647 25153 4497 1 5 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.723 3.737 25153 4498 1 5 . 1 1 139 139 PHE H H 139 10.094 10.094 8.876 1.218 25153 4499 1 5 . 1 1 140 140 VAL N N 140 109.690 109.690 115.201 -5.511 25153 4500 1 5 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.659 -0.178 25153 4501 1 5 . 1 1 140 140 VAL C C 140 172.790 172.790 175.736 -2.946 25153 4502 1 5 . 1 1 140 140 VAL CA C 140 62.000 62.000 64.136 -2.136 25153 4503 1 5 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.568 -1.018 25153 4504 1 5 . 1 1 140 140 VAL H H 140 7.470 7.470 8.200 -0.730 25153 4505 1 5 . 1 1 141 141 GLY N N 141 107.060 107.060 105.190 1.870 25153 4506 1 5 . 1 1 141 141 GLY C C 141 171.513 171.513 172.567 -1.054 25153 4507 1 5 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.365 1.065 25153 4508 1 5 . 1 1 141 141 GLY H H 141 7.137 7.137 7.384 -0.247 25153 4509 1 5 . 1 1 142 142 LEU N N 142 117.863 117.863 120.112 -2.249 25153 4510 1 5 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.206 -1.231 25153 4511 1 5 . 1 1 142 142 LEU C C 142 173.640 173.640 175.143 -1.503 25153 4512 1 5 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.712 1.208 25153 4513 1 5 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.386 -4.836 25153 4514 1 5 . 1 1 142 142 LEU H H 142 7.517 7.517 7.562 -0.045 25153 4515 1 5 . 1 1 143 143 ALA N N 143 126.990 126.990 129.600 -2.610 25153 4516 1 5 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.450 -0.173 25153 4517 1 5 . 1 1 143 143 ALA C C 143 175.730 175.730 175.930 -0.200 25153 4518 1 5 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.251 -0.811 25153 4519 1 5 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.036 4.274 25153 4520 1 5 . 1 1 143 143 ALA H H 143 5.186 5.186 8.263 -3.077 25153 4521 1 5 . 1 1 144 144 LEU N N 144 125.477 125.477 125.092 0.385 25153 4522 1 5 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.731 0.049 25153 4523 1 5 . 1 1 144 144 LEU C C 144 174.473 174.473 175.447 -0.974 25153 4524 1 5 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.956 -0.716 25153 4525 1 5 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.495 0.805 25153 4526 1 5 . 1 1 144 144 LEU H H 144 8.758 8.758 8.332 0.426 25153 4527 1 5 . 1 1 145 145 ASP N N 145 118.915 118.915 118.692 0.223 25153 4528 1 5 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.020 0.512 25153 4529 1 5 . 1 1 145 145 ASP C C 145 176.470 176.470 175.562 0.908 25153 4530 1 5 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.666 -0.036 25153 4531 1 5 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.524 -1.524 25153 4532 1 5 . 1 1 146 146 GLU N N 146 124.813 124.813 121.319 3.494 25153 4533 1 5 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.562 -0.186 25153 4534 1 5 . 1 1 146 146 GLU C C 146 177.290 177.290 175.828 1.462 25153 4535 1 5 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.654 0.466 25153 4536 1 5 . 1 1 146 146 GLU CB C 146 30.150 30.150 28.871 1.279 25153 4537 1 5 . 1 1 147 147 THR N N 147 118.328 118.328 113.233 5.095 25153 4538 1 5 . 1 1 147 147 THR HA H 147 4.200 4.200 4.354 -0.154 25153 4539 1 5 . 1 1 147 147 THR C C 147 175.683 175.683 175.452 0.231 25153 4540 1 5 . 1 1 147 147 THR CA C 147 66.250 66.250 62.866 3.384 25153 4541 1 5 . 1 1 147 147 THR CB C 147 69.600 69.600 69.971 -0.371 25153 4542 1 5 . 1 1 147 147 THR H H 147 8.562 8.562 8.333 0.229 25153 4543 1 5 . 1 1 148 148 ASN N N 148 115.550 115.550 119.977 -4.427 25153 4544 1 5 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.915 0.072 25153 4545 1 5 . 1 1 148 148 ASN C C 148 175.870 175.870 176.093 -0.223 25153 4546 1 5 . 1 1 148 148 ASN CA C 148 53.700 53.700 55.931 -2.231 25153 4547 1 5 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.272 2.608 25153 4548 1 5 . 1 1 148 148 ASN H H 148 9.118 9.118 9.203 -0.085 25153 4549 1 5 . 1 1 149 149 GLN N N 149 117.400 117.400 118.936 -1.536 25153 4550 1 5 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.459 0.384 25153 4551 1 5 . 1 1 149 149 GLN C C 149 177.780 177.780 176.516 1.264 25153 4552 1 5 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.370 -1.470 25153 4553 1 5 . 1 1 149 149 GLN CB C 149 29.300 29.300 29.020 0.280 25153 4554 1 5 . 1 1 149 149 GLN H H 149 7.555 7.555 8.233 -0.678 25153 4555 1 5 . 1 1 150 150 TYR N N 150 120.674 120.674 118.826 1.848 25153 4556 1 5 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.412 0.116 25153 4557 1 5 . 1 1 150 150 TYR C C 150 177.830 177.830 176.212 1.618 25153 4558 1 5 . 1 1 150 150 TYR CA C 150 58.487 58.487 59.165 -0.678 25153 4559 1 5 . 1 1 150 150 TYR CB C 150 36.600 36.600 37.281 -0.681 25153 4560 1 5 . 1 1 150 150 TYR H H 150 6.983 6.983 8.396 -1.413 25153 4561 1 5 . 1 1 151 151 ASP N N 151 120.810 120.810 118.364 2.446 25153 4562 1 5 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.226 0.289 25153 4563 1 5 . 1 1 151 151 ASP C C 151 176.400 176.400 176.898 -0.498 25153 4564 1 5 . 1 1 151 151 ASP CA C 151 55.400 55.400 54.990 0.410 25153 4565 1 5 . 1 1 151 151 ASP CB C 151 39.080 39.080 40.968 -1.889 25153 4566 1 5 . 1 1 152 152 LEU N N 152 118.083 118.083 113.164 4.919 25153 4567 1 5 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.749 -0.073 25153 4568 1 5 . 1 1 152 152 LEU C C 152 178.470 178.470 177.648 0.822 25153 4569 1 5 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.094 -0.494 25153 4570 1 5 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.242 -0.642 25153 4571 1 5 . 1 1 152 152 LEU H H 152 7.453 7.453 7.332 0.121 25153 4572 1 5 . 1 1 153 153 SER N N 153 116.407 116.407 117.824 -1.417 25153 4573 1 5 . 1 1 153 153 SER HA H 153 3.960 3.960 3.995 -0.035 25153 4574 1 5 . 1 1 153 153 SER C C 153 174.590 174.590 175.890 -1.300 25153 4575 1 5 . 1 1 153 153 SER CA C 153 63.400 63.400 62.282 1.118 25153 4576 1 5 . 1 1 153 153 SER CB C 153 63.100 63.100 62.623 0.477 25153 4577 1 5 . 1 1 153 153 SER H H 153 7.360 7.360 8.246 -0.886 25153 4578 1 5 . 1 1 154 154 ASP N N 154 121.960 121.960 121.711 0.249 25153 4579 1 5 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.331 -0.021 25153 4580 1 5 . 1 1 154 154 ASP C C 154 178.640 178.640 177.754 0.886 25153 4581 1 5 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.364 1.635 25153 4582 1 5 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.947 -1.377 25153 4583 1 5 . 1 1 155 155 GLU N N 155 121.310 121.310 119.160 2.150 25153 4584 1 5 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.104 0.081 25153 4585 1 5 . 1 1 155 155 GLU C C 155 179.600 179.600 178.957 0.643 25153 4586 1 5 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.898 0.552 25153 4587 1 5 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.681 -0.281 25153 4588 1 5 . 1 1 156 156 ARG N N 156 121.394 121.394 120.597 0.797 25153 4589 1 5 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.268 0.032 25153 4590 1 5 . 1 1 156 156 ARG C C 156 177.330 177.330 178.948 -1.618 25153 4591 1 5 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.315 2.145 25153 4592 1 5 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.780 0.980 25153 4593 1 5 . 1 1 157 157 ILE N N 157 118.390 118.390 120.716 -2.326 25153 4594 1 5 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.730 -0.296 25153 4595 1 5 . 1 1 157 157 ILE C C 157 178.814 178.814 177.745 1.069 25153 4596 1 5 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.866 0.828 25153 4597 1 5 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.907 0.946 25153 4598 1 5 . 1 1 157 157 ILE H H 157 8.966 8.966 8.131 0.835 25153 4599 1 5 . 1 1 158 158 GLN N N 158 120.060 120.060 119.088 0.972 25153 4600 1 5 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.985 -0.029 25153 4601 1 5 . 1 1 158 158 GLN C C 158 178.843 178.843 178.515 0.328 25153 4602 1 5 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.364 1.236 25153 4603 1 5 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.262 0.128 25153 4604 1 5 . 1 1 158 158 GLN H H 158 8.394 8.394 7.998 0.396 25153 4605 1 5 . 1 1 159 159 SER N N 159 115.613 115.613 117.129 -1.516 25153 4606 1 5 . 1 1 159 159 SER HA H 159 4.455 4.455 4.332 0.123 25153 4607 1 5 . 1 1 159 159 SER C C 159 177.330 177.330 176.581 0.749 25153 4608 1 5 . 1 1 159 159 SER CA C 159 62.400 62.400 62.261 0.139 25153 4609 1 5 . 1 1 159 159 SER CB C 159 63.760 63.760 62.950 0.809 25153 4610 1 5 . 1 1 159 159 SER H H 159 8.460 8.460 8.374 0.086 25153 4611 1 5 . 1 1 160 160 TRP N N 160 126.820 126.820 124.680 2.140 25153 4612 1 5 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.037 0.428 25153 4613 1 5 . 1 1 160 160 TRP C C 160 178.050 178.050 177.368 0.682 25153 4614 1 5 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.571 1.129 25153 4615 1 5 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.238 0.122 25153 4616 1 5 . 1 1 160 160 TRP H H 160 9.318 9.318 8.064 1.254 25153 4617 1 5 . 1 1 161 161 CYS N N 161 116.750 116.750 117.915 -1.165 25153 4618 1 5 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.744 0.139 25153 4619 1 5 . 1 1 161 161 CYS C C 161 176.270 176.270 176.830 -0.560 25153 4620 1 5 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.041 1.319 25153 4621 1 5 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.833 1.047 25153 4622 1 5 . 1 1 161 161 CYS H H 161 8.950 8.950 8.967 -0.017 25153 4623 1 5 . 1 1 162 162 GLU N N 162 118.096 118.096 120.134 -2.038 25153 4624 1 5 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.122 -0.192 25153 4625 1 5 . 1 1 162 162 GLU C C 162 178.680 178.680 177.395 1.285 25153 4626 1 5 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.057 0.673 25153 4627 1 5 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.371 0.059 25153 4628 1 5 . 1 1 163 163 GLN N N 163 120.790 120.790 117.810 2.980 25153 4629 1 5 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.094 0.083 25153 4630 1 5 . 1 1 163 163 GLN C C 163 179.690 179.690 178.086 1.604 25153 4631 1 5 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.831 1.710 25153 4632 1 5 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.806 0.194 25153 4633 1 5 . 1 1 163 163 GLN H H 163 8.205 8.205 7.517 0.688 25153 4634 1 5 . 1 1 164 164 ILE N N 164 114.860 114.860 118.941 -4.081 25153 4635 1 5 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.858 0.185 25153 4636 1 5 . 1 1 164 164 ILE C C 164 178.680 178.680 177.368 1.312 25153 4637 1 5 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.021 2.189 25153 4638 1 5 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.583 0.117 25153 4639 1 5 . 1 1 164 164 ILE H H 164 9.005 9.005 7.962 1.044 25153 4640 1 5 . 1 1 165 165 LEU N N 165 123.900 123.900 117.121 6.779 25153 4641 1 5 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.190 -0.040 25153 4642 1 5 . 1 1 165 165 LEU C C 165 180.520 180.520 177.632 2.888 25153 4643 1 5 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.277 1.023 25153 4644 1 5 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.363 -0.313 25153 4645 1 5 . 1 1 165 165 LEU H H 165 7.825 7.825 7.991 -0.166 25153 4646 1 5 . 1 1 166 166 ASN N N 166 120.112 120.112 118.584 1.528 25153 4647 1 5 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.735 -0.152 25153 4648 1 5 . 1 1 166 166 ASN C C 166 178.440 178.440 177.161 1.279 25153 4649 1 5 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.815 0.605 25153 4650 1 5 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.487 -1.067 25153 4651 1 5 . 1 1 166 166 ASN H H 166 7.760 7.760 7.998 -0.238 25153 4652 1 5 . 1 1 167 167 GLU N N 167 121.370 121.370 122.138 -0.768 25153 4653 1 5 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.975 0.128 25153 4654 1 5 . 1 1 167 167 GLU C C 167 180.332 180.332 179.303 1.029 25153 4655 1 5 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.961 0.189 25153 4656 1 5 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.702 1.318 25153 4657 1 5 . 1 1 168 168 MET N N 168 118.532 118.532 117.616 0.916 25153 4658 1 5 . 1 1 168 168 MET HA H 168 4.015 4.015 4.241 -0.226 25153 4659 1 5 . 1 1 168 168 MET C C 168 176.600 176.600 178.356 -1.756 25153 4660 1 5 . 1 1 168 168 MET CA C 168 59.300 59.300 59.452 -0.152 25153 4661 1 5 . 1 1 168 168 MET CB C 168 33.400 33.400 32.624 0.776 25153 4662 1 5 . 1 1 168 168 MET H H 168 8.718 8.718 8.491 0.227 25153 4663 1 5 . 1 1 169 169 ALA N N 169 121.922 121.922 122.453 -0.531 25153 4664 1 5 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.146 0.028 25153 4665 1 5 . 1 1 169 169 ALA C C 169 179.410 179.410 179.637 -0.227 25153 4666 1 5 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.824 -0.424 25153 4667 1 5 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.312 0.098 25153 4668 1 5 . 1 1 169 169 ALA H H 169 7.448 7.448 8.145 -0.697 25153 4669 1 5 . 1 1 170 170 GLU N N 170 117.300 117.300 116.795 0.505 25153 4670 1 5 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.077 0.018 25153 4671 1 5 . 1 1 170 170 GLU C C 170 177.470 177.470 179.422 -1.952 25153 4672 1 5 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.953 -1.003 25153 4673 1 5 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.389 0.386 25153 4674 1 5 . 1 1 171 171 HIS N N 171 117.944 117.944 119.870 -1.926 25153 4675 1 5 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.384 0.116 25153 4676 1 5 . 1 1 171 171 HIS C C 171 175.120 175.120 176.837 -1.717 25153 4677 1 5 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.111 -1.911 25153 4678 1 5 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.043 0.557 25153 4679 1 5 . 1 1 171 171 HIS H H 171 7.788 7.788 8.069 -0.281 25153 4680 1 5 . 1 1 172 172 TYR N N 172 120.040 120.040 118.004 2.036 25153 4681 1 5 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.488 0.105 25153 4682 1 5 . 1 1 172 172 TYR C C 172 174.612 174.612 175.397 -0.785 25153 4683 1 5 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.557 -0.577 25153 4684 1 5 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.616 0.364 25153 4685 1 5 . 1 1 172 172 TYR H H 172 7.820 7.820 8.132 -0.312 25153 4686 1 6 . 1 1 2 2 ASN N N 2 123.320 123.320 119.829 3.491 25153 4687 1 6 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.190 0.018 25153 4688 1 6 . 1 1 2 2 ASN C C 2 174.590 174.590 174.571 0.019 25153 4689 1 6 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.744 0.256 25153 4690 1 6 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.365 -0.395 25153 4691 1 6 . 1 1 2 2 ASN H H 2 9.428 9.428 8.663 0.765 25153 4692 1 6 . 1 1 3 3 MET N N 3 120.920 120.920 119.299 1.621 25153 4693 1 6 . 1 1 3 3 MET HA H 3 5.530 5.530 5.346 0.184 25153 4694 1 6 . 1 1 3 3 MET C C 3 174.400 174.400 175.128 -0.728 25153 4695 1 6 . 1 1 3 3 MET CA C 3 54.643 54.643 54.173 0.470 25153 4696 1 6 . 1 1 3 3 MET CB C 3 34.637 34.637 37.276 -2.639 25153 4697 1 6 . 1 1 3 3 MET H H 3 8.751 8.751 9.184 -0.433 25153 4698 1 6 . 1 1 4 4 GLY N N 4 115.542 115.542 109.154 6.388 25153 4699 1 6 . 1 1 4 4 GLY C C 4 170.413 170.413 172.172 -1.759 25153 4700 1 6 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.817 -0.715 25153 4701 1 6 . 1 1 4 4 GLY H H 4 8.927 8.927 8.969 -0.042 25153 4702 1 6 . 1 1 5 5 LEU N N 5 131.030 131.030 128.078 2.952 25153 4703 1 6 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.337 1.065 25153 4704 1 6 . 1 1 5 5 LEU C C 5 175.952 175.952 174.529 1.423 25153 4705 1 6 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.991 0.459 25153 4706 1 6 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.014 2.578 25153 4707 1 6 . 1 1 5 5 LEU H H 5 8.928 8.928 8.647 0.281 25153 4708 1 6 . 1 1 6 6 PHE N N 6 125.790 125.790 126.306 -0.516 25153 4709 1 6 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.798 -0.058 25153 4710 1 6 . 1 1 6 6 PHE C C 6 174.300 174.300 175.853 -1.553 25153 4711 1 6 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.359 -1.039 25153 4712 1 6 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.585 -0.355 25153 4713 1 6 . 1 1 6 6 PHE H H 6 9.237 9.237 9.418 -0.181 25153 4714 1 6 . 1 1 7 7 TYR N N 7 117.289 117.289 117.101 0.188 25153 4715 1 6 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.943 0.022 25153 4716 1 6 . 1 1 7 7 TYR C C 7 171.262 171.262 173.352 -2.090 25153 4717 1 6 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.319 -0.919 25153 4718 1 6 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.222 0.018 25153 4719 1 6 . 1 1 7 7 TYR H H 7 8.125 8.125 8.337 -0.212 25153 4720 1 6 . 1 1 8 8 GLY N N 8 107.420 107.420 106.085 1.335 25153 4721 1 6 . 1 1 8 8 GLY C C 8 172.000 172.000 172.742 -0.742 25153 4722 1 6 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.933 -0.989 25153 4723 1 6 . 1 1 8 8 GLY H H 8 7.031 7.031 8.422 -1.391 25153 4724 1 6 . 1 1 9 9 SER N N 9 118.150 118.150 116.716 1.434 25153 4725 1 6 . 1 1 9 9 SER HA H 9 5.200 5.200 4.993 0.207 25153 4726 1 6 . 1 1 9 9 SER C C 9 175.000 175.000 174.199 0.801 25153 4727 1 6 . 1 1 9 9 SER CA C 9 57.570 57.570 57.210 0.360 25153 4728 1 6 . 1 1 9 9 SER CB C 9 66.700 66.700 64.821 1.879 25153 4729 1 6 . 1 1 9 9 SER H H 9 9.604 9.604 8.454 1.150 25153 4730 1 6 . 1 1 10 10 SER N N 10 131.193 131.193 122.517 8.676 25153 4731 1 6 . 1 1 10 10 SER HA H 10 4.775 4.775 4.497 0.278 25153 4732 1 6 . 1 1 10 10 SER C C 10 175.730 175.730 175.536 0.194 25153 4733 1 6 . 1 1 10 10 SER CA C 10 61.750 61.750 60.357 1.393 25153 4734 1 6 . 1 1 10 10 SER CB C 10 64.400 64.400 63.713 0.687 25153 4735 1 6 . 1 1 10 10 SER H H 10 11.636 11.636 9.042 2.594 25153 4736 1 6 . 1 1 11 11 THR N N 11 115.848 115.848 115.181 0.667 25153 4737 1 6 . 1 1 11 11 THR HA H 11 4.770 4.770 4.293 0.477 25153 4738 1 6 . 1 1 11 11 THR C C 11 173.700 173.700 174.873 -1.173 25153 4739 1 6 . 1 1 11 11 THR CA C 11 60.700 60.700 63.112 -2.412 25153 4740 1 6 . 1 1 11 11 THR CB C 11 67.430 67.430 69.459 -2.029 25153 4741 1 6 . 1 1 11 11 THR H H 11 9.550 9.550 8.546 1.004 25153 4742 1 6 . 1 1 12 12 CYS N N 12 109.780 109.780 116.477 -6.697 25153 4743 1 6 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.709 -0.639 25153 4744 1 6 . 1 1 12 12 CYS C C 12 176.220 176.220 175.591 0.629 25153 4745 1 6 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.890 4.710 25153 4746 1 6 . 1 1 12 12 CYS CB C 12 26.400 26.400 28.358 -1.958 25153 4747 1 6 . 1 1 12 12 CYS H H 12 7.437 7.437 7.716 -0.279 25153 4748 1 6 . 1 1 13 13 TYR N N 13 127.830 127.830 123.581 4.249 25153 4749 1 6 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.337 -0.234 25153 4750 1 6 . 1 1 13 13 TYR C C 13 180.880 180.880 177.926 2.954 25153 4751 1 6 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.149 3.951 25153 4752 1 6 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.167 -0.332 25153 4753 1 6 . 1 1 13 13 TYR H H 13 10.886 10.886 7.205 3.681 25153 4754 1 6 . 1 1 14 14 THR N N 14 124.428 124.428 114.657 9.771 25153 4755 1 6 . 1 1 14 14 THR HA H 14 4.160 4.160 4.138 0.022 25153 4756 1 6 . 1 1 14 14 THR C C 14 177.760 177.760 176.324 1.436 25153 4757 1 6 . 1 1 14 14 THR CA C 14 67.823 67.823 66.392 1.431 25153 4758 1 6 . 1 1 14 14 THR CB C 14 68.040 68.040 68.600 -0.560 25153 4759 1 6 . 1 1 14 14 THR H H 14 11.405 11.405 8.594 2.811 25153 4760 1 6 . 1 1 15 15 GLU N N 15 123.050 123.050 123.218 -0.168 25153 4761 1 6 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.345 -0.455 25153 4762 1 6 . 1 1 15 15 GLU C C 15 176.392 176.392 178.458 -2.066 25153 4763 1 6 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.326 -0.126 25153 4764 1 6 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.382 1.068 25153 4765 1 6 . 1 1 16 16 MET N N 16 120.173 120.173 118.288 1.885 25153 4766 1 6 . 1 1 16 16 MET HA H 16 4.050 4.050 4.187 -0.137 25153 4767 1 6 . 1 1 16 16 MET C C 16 179.940 179.940 178.645 1.295 25153 4768 1 6 . 1 1 16 16 MET CA C 16 59.240 59.240 59.150 0.090 25153 4769 1 6 . 1 1 16 16 MET CB C 16 32.970 32.970 32.909 0.061 25153 4770 1 6 . 1 1 16 16 MET H H 16 8.469 8.469 8.617 -0.148 25153 4771 1 6 . 1 1 17 17 ALA N N 17 121.930 121.930 121.948 -0.018 25153 4772 1 6 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.870 -0.034 25153 4773 1 6 . 1 1 17 17 ALA C C 17 177.900 177.900 178.747 -0.847 25153 4774 1 6 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.157 0.043 25153 4775 1 6 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.109 -0.109 25153 4776 1 6 . 1 1 17 17 ALA H H 17 7.880 7.880 8.229 -0.349 25153 4777 1 6 . 1 1 18 18 ALA N N 18 121.477 121.477 121.328 0.149 25153 4778 1 6 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.842 -0.105 25153 4779 1 6 . 1 1 18 18 ALA C C 18 179.380 179.380 179.549 -0.169 25153 4780 1 6 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.211 -0.211 25153 4781 1 6 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.767 1.063 25153 4782 1 6 . 1 1 18 18 ALA H H 18 7.374 7.374 8.070 -0.696 25153 4783 1 6 . 1 1 19 19 GLU N N 19 116.650 116.650 118.040 -1.390 25153 4784 1 6 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.879 -0.263 25153 4785 1 6 . 1 1 19 19 GLU C C 19 178.479 178.479 179.571 -1.092 25153 4786 1 6 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.431 0.299 25153 4787 1 6 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.361 -0.061 25153 4788 1 6 . 1 1 20 20 LYS N N 20 119.470 119.470 120.367 -0.897 25153 4789 1 6 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.027 0.023 25153 4790 1 6 . 1 1 20 20 LYS C C 20 179.116 179.116 178.931 0.185 25153 4791 1 6 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.429 0.401 25153 4792 1 6 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.474 0.376 25153 4793 1 6 . 1 1 21 21 ILE N N 21 121.030 121.030 120.722 0.308 25153 4794 1 6 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.681 -0.291 25153 4795 1 6 . 1 1 21 21 ILE C C 21 177.580 177.580 178.203 -0.623 25153 4796 1 6 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.773 0.047 25153 4797 1 6 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.907 0.441 25153 4798 1 6 . 1 1 21 21 ILE H H 21 8.100 8.100 8.611 -0.511 25153 4799 1 6 . 1 1 22 22 ARG N N 22 119.720 119.720 119.455 0.265 25153 4800 1 6 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.854 -0.299 25153 4801 1 6 . 1 1 22 22 ARG C C 22 177.320 177.320 178.103 -0.783 25153 4802 1 6 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.752 -0.032 25153 4803 1 6 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.736 -0.804 25153 4804 1 6 . 1 1 23 23 ASP N N 23 118.730 118.730 119.303 -0.573 25153 4805 1 6 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.421 -0.058 25153 4806 1 6 . 1 1 23 23 ASP C C 23 178.330 178.330 178.796 -0.466 25153 4807 1 6 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.359 -0.409 25153 4808 1 6 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.870 -0.630 25153 4809 1 6 . 1 1 24 24 ILE N N 24 121.090 121.090 119.423 1.667 25153 4810 1 6 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.795 0.001 25153 4811 1 6 . 1 1 24 24 ILE C C 24 178.250 178.250 177.883 0.367 25153 4812 1 6 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.760 -0.610 25153 4813 1 6 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.291 0.189 25153 4814 1 6 . 1 1 24 24 ILE H H 24 7.910 7.910 8.225 -0.315 25153 4815 1 6 . 1 1 25 25 ILE N N 25 121.406 121.406 117.382 4.024 25153 4816 1 6 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.872 -0.226 25153 4817 1 6 . 1 1 25 25 ILE C C 25 176.800 176.800 176.781 0.019 25153 4818 1 6 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.043 2.657 25153 4819 1 6 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.950 -0.760 25153 4820 1 6 . 1 1 25 25 ILE H H 25 8.476 8.476 8.063 0.413 25153 4821 1 6 . 1 1 26 26 GLY N N 26 108.900 108.900 105.195 3.705 25153 4822 1 6 . 1 1 26 26 GLY C C 26 173.710 173.710 172.271 1.439 25153 4823 1 6 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.662 -0.332 25153 4824 1 6 . 1 1 26 26 GLY H H 26 8.016 8.016 7.811 0.205 25153 4825 1 6 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.684 -0.346 25153 4826 1 6 . 1 1 27 27 PRO C C 27 177.200 177.200 177.386 -0.186 25153 4827 1 6 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.530 1.156 25153 4828 1 6 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.108 0.092 25153 4829 1 6 . 1 1 28 28 GLU N N 28 116.295 116.295 118.273 -1.978 25153 4830 1 6 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.183 0.087 25153 4831 1 6 . 1 1 28 28 GLU C C 28 176.980 176.980 177.350 -0.370 25153 4832 1 6 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.600 -0.860 25153 4833 1 6 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.439 -0.769 25153 4834 1 6 . 1 1 29 29 LEU N N 29 120.250 120.250 111.192 9.058 25153 4835 1 6 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.694 -0.058 25153 4836 1 6 . 1 1 29 29 LEU C C 29 175.770 175.770 175.613 0.157 25153 4837 1 6 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.330 0.470 25153 4838 1 6 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.075 1.025 25153 4839 1 6 . 1 1 29 29 LEU H H 29 7.940 7.940 7.597 0.343 25153 4840 1 6 . 1 1 30 30 VAL N N 30 118.693 118.693 121.147 -2.454 25153 4841 1 6 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.980 -0.332 25153 4842 1 6 . 1 1 30 30 VAL C C 30 174.347 174.347 176.117 -1.770 25153 4843 1 6 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.355 -0.486 25153 4844 1 6 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.660 1.921 25153 4845 1 6 . 1 1 30 30 VAL H H 30 7.434 7.434 8.034 -0.600 25153 4846 1 6 . 1 1 31 31 THR N N 31 123.800 123.800 121.482 2.318 25153 4847 1 6 . 1 1 31 31 THR HA H 31 4.362 4.362 4.550 -0.188 25153 4848 1 6 . 1 1 31 31 THR C C 31 172.964 172.964 173.337 -0.373 25153 4849 1 6 . 1 1 31 31 THR CA C 31 61.720 61.720 60.852 0.868 25153 4850 1 6 . 1 1 31 31 THR CB C 31 70.485 70.485 71.115 -0.630 25153 4851 1 6 . 1 1 31 31 THR H H 31 7.844 7.844 8.220 -0.376 25153 4852 1 6 . 1 1 32 32 LEU N N 32 127.800 127.800 126.839 0.961 25153 4853 1 6 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.602 0.082 25153 4854 1 6 . 1 1 32 32 LEU C C 32 176.600 176.600 176.518 0.082 25153 4855 1 6 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.060 0.095 25153 4856 1 6 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.751 1.099 25153 4857 1 6 . 1 1 32 32 LEU H H 32 8.660 8.660 8.594 0.066 25153 4858 1 6 . 1 1 33 33 HIS N N 33 119.670 119.670 120.138 -0.468 25153 4859 1 6 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.809 -0.409 25153 4860 1 6 . 1 1 33 33 HIS C C 33 171.667 171.667 173.239 -1.572 25153 4861 1 6 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.115 0.085 25153 4862 1 6 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.765 0.435 25153 4863 1 6 . 1 1 33 33 HIS H H 33 9.060 9.060 8.725 0.335 25153 4864 1 6 . 1 1 34 34 ASN N N 34 124.068 124.068 123.182 0.886 25153 4865 1 6 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.150 -0.716 25153 4866 1 6 . 1 1 34 34 ASN C C 34 178.000 178.000 175.910 2.090 25153 4867 1 6 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.960 -0.531 25153 4868 1 6 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.234 -0.674 25153 4869 1 6 . 1 1 34 34 ASN H H 34 8.780 8.780 8.565 0.215 25153 4870 1 6 . 1 1 35 35 LEU N N 35 129.040 129.040 126.508 2.532 25153 4871 1 6 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.225 0.090 25153 4872 1 6 . 1 1 35 35 LEU C C 35 177.700 177.700 177.899 -0.199 25153 4873 1 6 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.316 0.163 25153 4874 1 6 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.827 1.473 25153 4875 1 6 . 1 1 35 35 LEU H H 35 8.821 8.821 8.412 0.409 25153 4876 1 6 . 1 1 36 36 LYS N N 36 121.043 121.043 116.978 4.065 25153 4877 1 6 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.982 -0.102 25153 4878 1 6 . 1 1 36 36 LYS C C 36 176.230 176.230 177.095 -0.865 25153 4879 1 6 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.530 0.890 25153 4880 1 6 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.510 0.760 25153 4881 1 6 . 1 1 37 37 ASP N N 37 114.965 114.965 118.058 -3.093 25153 4882 1 6 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.801 -0.024 25153 4883 1 6 . 1 1 37 37 ASP C C 37 175.440 175.440 175.963 -0.523 25153 4884 1 6 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.481 0.230 25153 4885 1 6 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.574 1.126 25153 4886 1 6 . 1 1 38 38 ASP N N 38 121.650 121.650 121.723 -0.073 25153 4887 1 6 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.884 -0.014 25153 4888 1 6 . 1 1 38 38 ASP C C 38 174.852 174.852 175.976 -1.124 25153 4889 1 6 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.615 -1.535 25153 4890 1 6 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.296 -0.186 25153 4891 1 6 . 1 1 39 39 SER N N 39 115.207 115.207 118.014 -2.807 25153 4892 1 6 . 1 1 39 39 SER HA H 39 4.585 4.585 4.708 -0.123 25153 4893 1 6 . 1 1 39 39 SER C C 39 175.040 175.040 174.340 0.700 25153 4894 1 6 . 1 1 39 39 SER CA C 39 54.960 54.960 56.266 -1.306 25153 4895 1 6 . 1 1 39 39 SER CB C 39 64.720 64.720 63.669 1.051 25153 4896 1 6 . 1 1 39 39 SER H H 39 8.351 8.351 8.605 -0.254 25153 4897 1 6 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.225 -0.220 25153 4898 1 6 . 1 1 40 40 PRO C C 40 176.730 176.730 177.837 -1.107 25153 4899 1 6 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.079 -0.179 25153 4900 1 6 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.734 -0.334 25153 4901 1 6 . 1 1 41 41 LYS N N 41 121.150 121.150 119.885 1.265 25153 4902 1 6 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.016 -0.104 25153 4903 1 6 . 1 1 41 41 LYS C C 41 179.600 179.600 178.695 0.905 25153 4904 1 6 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.443 -1.242 25153 4905 1 6 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.637 0.363 25153 4906 1 6 . 1 1 42 42 LEU N N 42 118.103 118.103 116.416 1.687 25153 4907 1 6 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.162 -0.125 25153 4908 1 6 . 1 1 42 42 LEU C C 42 178.760 178.760 178.834 -0.074 25153 4909 1 6 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.299 -0.119 25153 4910 1 6 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.784 1.189 25153 4911 1 6 . 1 1 42 42 LEU H H 42 7.600 7.600 7.538 0.062 25153 4912 1 6 . 1 1 43 43 MET N N 43 118.917 118.917 116.856 2.061 25153 4913 1 6 . 1 1 43 43 MET HA H 43 3.750 3.750 4.461 -0.711 25153 4914 1 6 . 1 1 43 43 MET C C 43 177.680 177.680 176.789 0.891 25153 4915 1 6 . 1 1 43 43 MET CA C 43 59.730 59.730 57.996 1.734 25153 4916 1 6 . 1 1 43 43 MET CB C 43 32.700 32.700 31.916 0.784 25153 4917 1 6 . 1 1 43 43 MET H H 43 8.202 8.202 8.023 0.179 25153 4918 1 6 . 1 1 44 44 GLU N N 44 110.924 110.924 117.490 -6.566 25153 4919 1 6 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.270 -0.530 25153 4920 1 6 . 1 1 44 44 GLU C C 44 178.130 178.130 178.947 -0.817 25153 4921 1 6 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.094 1.306 25153 4922 1 6 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.995 -0.445 25153 4923 1 6 . 1 1 45 45 GLN N N 45 115.756 115.756 119.024 -3.268 25153 4924 1 6 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.051 0.132 25153 4925 1 6 . 1 1 45 45 GLN C C 45 175.414 175.414 177.263 -1.849 25153 4926 1 6 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.686 -1.506 25153 4927 1 6 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.082 -0.482 25153 4928 1 6 . 1 1 45 45 GLN H H 45 7.516 7.516 7.508 0.008 25153 4929 1 6 . 1 1 46 46 TYR N N 46 117.860 117.860 119.378 -1.518 25153 4930 1 6 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.387 0.276 25153 4931 1 6 . 1 1 46 46 TYR C C 46 175.500 175.500 176.976 -1.476 25153 4932 1 6 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.462 -0.976 25153 4933 1 6 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.290 3.180 25153 4934 1 6 . 1 1 46 46 TYR H H 46 6.996 6.996 7.302 -0.306 25153 4935 1 6 . 1 1 47 47 ASP N N 47 121.683 121.683 120.959 0.724 25153 4936 1 6 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.675 0.025 25153 4937 1 6 . 1 1 47 47 ASP C C 47 175.610 175.610 175.434 0.176 25153 4938 1 6 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.537 -0.837 25153 4939 1 6 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.145 0.855 25153 4940 1 6 . 1 1 48 48 VAL N N 48 118.628 118.628 116.419 2.209 25153 4941 1 6 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.858 0.176 25153 4942 1 6 . 1 1 48 48 VAL C C 48 174.190 174.190 173.876 0.314 25153 4943 1 6 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.111 -0.921 25153 4944 1 6 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.889 0.211 25153 4945 1 6 . 1 1 48 48 VAL H H 48 7.628 7.628 7.428 0.200 25153 4946 1 6 . 1 1 49 49 LEU N N 49 128.190 128.190 124.603 3.587 25153 4947 1 6 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.508 0.095 25153 4948 1 6 . 1 1 49 49 LEU C C 49 174.880 174.880 175.778 -0.898 25153 4949 1 6 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.614 -0.373 25153 4950 1 6 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.488 -0.148 25153 4951 1 6 . 1 1 49 49 LEU H H 49 9.407 9.407 9.167 0.240 25153 4952 1 6 . 1 1 50 50 ILE N N 50 124.550 124.550 120.733 3.817 25153 4953 1 6 . 1 1 50 50 ILE HA H 50 5.700 5.700 4.984 0.716 25153 4954 1 6 . 1 1 50 50 ILE C C 50 175.300 175.300 174.678 0.622 25153 4955 1 6 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.093 -1.229 25153 4956 1 6 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.788 -0.538 25153 4957 1 6 . 1 1 50 50 ILE H H 50 9.238 9.238 9.195 0.043 25153 4958 1 6 . 1 1 51 51 LEU N N 51 127.460 127.460 128.382 -0.922 25153 4959 1 6 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.852 0.333 25153 4960 1 6 . 1 1 51 51 LEU C C 51 174.544 174.544 175.848 -1.304 25153 4961 1 6 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.581 -0.761 25153 4962 1 6 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.286 -2.649 25153 4963 1 6 . 1 1 51 51 LEU H H 51 9.228 9.228 9.223 0.005 25153 4964 1 6 . 1 1 52 52 GLY N N 52 107.760 107.760 111.198 -3.438 25153 4965 1 6 . 1 1 52 52 GLY C C 52 174.710 174.710 172.375 2.335 25153 4966 1 6 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.870 0.000 25153 4967 1 6 . 1 1 52 52 GLY H H 52 8.860 8.860 8.945 -0.085 25153 4968 1 6 . 1 1 53 53 ILE N N 53 123.890 123.890 120.070 3.820 25153 4969 1 6 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.841 0.429 25153 4970 1 6 . 1 1 53 53 ILE C C 53 172.630 172.630 173.225 -0.595 25153 4971 1 6 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.658 0.022 25153 4972 1 6 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.377 3.783 25153 4973 1 6 . 1 1 53 53 ILE H H 53 8.458 8.458 8.035 0.423 25153 4974 1 6 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.911 0.477 25153 4975 1 6 . 1 1 54 54 PRO C C 54 175.000 175.000 176.505 -1.505 25153 4976 1 6 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.897 -0.297 25153 4977 1 6 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.976 -0.676 25153 4978 1 6 . 1 1 55 55 THR N N 55 112.754 112.754 118.303 -5.549 25153 4979 1 6 . 1 1 55 55 THR HA H 55 4.452 4.452 4.778 -0.326 25153 4980 1 6 . 1 1 55 55 THR C C 55 172.480 172.480 174.122 -1.642 25153 4981 1 6 . 1 1 55 55 THR CA C 55 62.350 62.350 62.783 -0.433 25153 4982 1 6 . 1 1 55 55 THR CB C 55 70.230 70.230 70.248 -0.018 25153 4983 1 6 . 1 1 55 55 THR H H 55 6.523 6.523 8.281 -1.758 25153 4984 1 6 . 1 1 56 56 TRP N N 56 130.044 130.044 126.479 3.565 25153 4985 1 6 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.887 -2.172 25153 4986 1 6 . 1 1 56 56 TRP C C 56 172.890 172.890 175.425 -2.535 25153 4987 1 6 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.941 -0.291 25153 4988 1 6 . 1 1 56 56 TRP CB C 56 33.000 33.000 33.063 -0.063 25153 4989 1 6 . 1 1 56 56 TRP H H 56 8.450 8.450 8.862 -0.412 25153 4990 1 6 . 1 1 57 57 ASP N N 57 115.275 115.275 120.911 -5.636 25153 4991 1 6 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.180 0.172 25153 4992 1 6 . 1 1 57 57 ASP C C 57 173.660 173.660 174.967 -1.307 25153 4993 1 6 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.432 0.798 25153 4994 1 6 . 1 1 57 57 ASP CB C 57 40.170 40.170 40.036 0.134 25153 4995 1 6 . 1 1 58 58 PHE N N 58 112.840 112.840 116.706 -3.866 25153 4996 1 6 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.895 -0.571 25153 4997 1 6 . 1 1 58 58 PHE C C 58 175.730 175.730 176.218 -0.488 25153 4998 1 6 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.385 1.438 25153 4999 1 6 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.940 -2.186 25153 5000 1 6 . 1 1 58 58 PHE H H 58 7.640 7.640 8.000 -0.360 25153 5001 1 6 . 1 1 59 59 GLY N N 59 104.940 104.940 107.058 -2.118 25153 5002 1 6 . 1 1 59 59 GLY C C 59 173.750 173.750 174.378 -0.628 25153 5003 1 6 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.109 1.181 25153 5004 1 6 . 1 1 59 59 GLY H H 59 8.024 8.024 8.695 -0.671 25153 5005 1 6 . 1 1 60 60 GLU N N 60 120.045 120.045 119.362 0.683 25153 5006 1 6 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.426 -0.013 25153 5007 1 6 . 1 1 60 60 GLU C C 60 176.050 176.050 175.914 0.136 25153 5008 1 6 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.531 -0.911 25153 5009 1 6 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.076 -0.466 25153 5010 1 6 . 1 1 61 61 ILE N N 61 120.790 120.790 120.329 0.461 25153 5011 1 6 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.241 -0.774 25153 5012 1 6 . 1 1 61 61 ILE C C 61 175.130 175.130 176.067 -0.937 25153 5013 1 6 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.758 0.789 25153 5014 1 6 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.404 -0.554 25153 5015 1 6 . 1 1 61 61 ILE H H 61 8.200 8.200 8.413 -0.213 25153 5016 1 6 . 1 1 62 62 GLN N N 62 124.520 124.520 124.507 0.013 25153 5017 1 6 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.179 -0.223 25153 5018 1 6 . 1 1 62 62 GLN C C 62 177.160 177.160 176.964 0.196 25153 5019 1 6 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.720 1.890 25153 5020 1 6 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.262 -2.612 25153 5021 1 6 . 1 1 62 62 GLN H H 62 5.667 5.667 8.857 -3.190 25153 5022 1 6 . 1 1 63 63 GLU N N 63 124.570 124.570 125.807 -1.237 25153 5023 1 6 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.198 -0.212 25153 5024 1 6 . 1 1 63 63 GLU C C 63 177.300 177.300 177.174 0.126 25153 5025 1 6 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.951 1.769 25153 5026 1 6 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.223 0.897 25153 5027 1 6 . 1 1 64 64 ASP N N 64 119.060 119.060 119.642 -0.582 25153 5028 1 6 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.418 0.202 25153 5029 1 6 . 1 1 64 64 ASP C C 64 179.180 179.180 177.247 1.933 25153 5030 1 6 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.970 0.980 25153 5031 1 6 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.179 0.771 25153 5032 1 6 . 1 1 65 65 TRP N N 65 121.070 121.070 120.865 0.205 25153 5033 1 6 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.540 -0.200 25153 5034 1 6 . 1 1 65 65 TRP C C 65 178.970 178.970 178.097 0.873 25153 5035 1 6 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.661 0.159 25153 5036 1 6 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.593 -0.193 25153 5037 1 6 . 1 1 65 65 TRP H H 65 7.350 7.350 8.074 -0.724 25153 5038 1 6 . 1 1 66 66 GLU N N 66 120.900 120.900 119.079 1.821 25153 5039 1 6 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.889 -0.049 25153 5040 1 6 . 1 1 66 66 GLU C C 66 178.750 178.750 179.115 -0.365 25153 5041 1 6 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.489 0.511 25153 5042 1 6 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.275 -0.415 25153 5043 1 6 . 1 1 67 67 ALA N N 67 119.130 119.130 119.976 -0.846 25153 5044 1 6 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.243 0.010 25153 5045 1 6 . 1 1 67 67 ALA C C 67 179.410 179.410 179.048 0.362 25153 5046 1 6 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.719 -0.139 25153 5047 1 6 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.880 -0.070 25153 5048 1 6 . 1 1 67 67 ALA H H 67 7.640 7.640 8.126 -0.486 25153 5049 1 6 . 1 1 68 68 VAL N N 68 106.845 106.845 111.114 -4.269 25153 5050 1 6 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.513 0.297 25153 5051 1 6 . 1 1 68 68 VAL C C 68 176.750 176.750 177.219 -0.469 25153 5052 1 6 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.401 -2.791 25153 5053 1 6 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.694 -0.074 25153 5054 1 6 . 1 1 68 68 VAL H H 68 7.219 7.219 7.572 -0.353 25153 5055 1 6 . 1 1 69 69 TRP N N 69 127.630 127.630 124.180 3.450 25153 5056 1 6 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.322 -0.084 25153 5057 1 6 . 1 1 69 69 TRP C C 69 178.670 178.670 177.200 1.470 25153 5058 1 6 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.307 -1.087 25153 5059 1 6 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.569 2.061 25153 5060 1 6 . 1 1 69 69 TRP H H 69 7.832 7.832 8.701 -0.869 25153 5061 1 6 . 1 1 70 70 ASP N N 70 114.544 114.544 118.441 -3.897 25153 5062 1 6 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.447 0.075 25153 5063 1 6 . 1 1 70 70 ASP C C 70 178.670 178.670 178.964 -0.294 25153 5064 1 6 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.314 -1.314 25153 5065 1 6 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.956 -1.106 25153 5066 1 6 . 1 1 71 71 GLN N N 71 120.040 120.040 119.363 0.677 25153 5067 1 6 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.123 0.061 25153 5068 1 6 . 1 1 71 71 GLN C C 71 178.910 178.910 178.800 0.110 25153 5069 1 6 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.321 -0.711 25153 5070 1 6 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.851 0.249 25153 5071 1 6 . 1 1 71 71 GLN H H 71 7.995 7.995 7.706 0.289 25153 5072 1 6 . 1 1 72 72 LEU N N 72 117.400 117.400 119.708 -2.308 25153 5073 1 6 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.937 -0.124 25153 5074 1 6 . 1 1 72 72 LEU C C 72 178.650 178.650 178.238 0.412 25153 5075 1 6 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.305 -0.105 25153 5076 1 6 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.228 0.182 25153 5077 1 6 . 1 1 72 72 LEU H H 72 7.450 7.450 7.756 -0.306 25153 5078 1 6 . 1 1 73 73 ASP N N 73 115.750 115.750 118.319 -2.569 25153 5079 1 6 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.392 -0.224 25153 5080 1 6 . 1 1 73 73 ASP C C 73 177.560 177.560 177.627 -0.067 25153 5081 1 6 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.621 0.779 25153 5082 1 6 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.081 -0.981 25153 5083 1 6 . 1 1 74 74 ASP N N 74 117.223 117.223 119.885 -2.662 25153 5084 1 6 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.576 0.127 25153 5085 1 6 . 1 1 74 74 ASP C C 74 176.388 176.388 177.090 -0.702 25153 5086 1 6 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.147 -0.647 25153 5087 1 6 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.542 0.158 25153 5088 1 6 . 1 1 75 75 LEU N N 75 118.316 118.316 119.174 -0.858 25153 5089 1 6 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.356 -0.071 25153 5090 1 6 . 1 1 75 75 LEU C C 75 176.820 176.820 175.707 1.113 25153 5091 1 6 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.521 -0.121 25153 5092 1 6 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.540 0.740 25153 5093 1 6 . 1 1 75 75 LEU H H 75 6.960 6.960 7.311 -0.351 25153 5094 1 6 . 1 1 76 76 ASN N N 76 123.045 123.045 117.614 5.431 25153 5095 1 6 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.849 0.041 25153 5096 1 6 . 1 1 76 76 ASN C C 76 174.950 174.950 174.759 0.191 25153 5097 1 6 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.448 -0.398 25153 5098 1 6 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.666 -1.165 25153 5099 1 6 . 1 1 76 76 ASN H H 76 9.890 9.890 8.678 1.212 25153 5100 1 6 . 1 1 77 77 LEU N N 77 123.494 123.494 123.341 0.153 25153 5101 1 6 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.545 -0.175 25153 5102 1 6 . 1 1 77 77 LEU C C 77 175.040 175.040 176.367 -1.327 25153 5103 1 6 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.803 -1.553 25153 5104 1 6 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.184 0.716 25153 5105 1 6 . 1 1 77 77 LEU H H 77 8.730 8.730 8.356 0.374 25153 5106 1 6 . 1 1 78 78 GLU N N 78 120.870 120.870 121.669 -0.799 25153 5107 1 6 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.354 -0.454 25153 5108 1 6 . 1 1 78 78 GLU C C 78 178.660 178.660 177.786 0.874 25153 5109 1 6 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.733 1.027 25153 5110 1 6 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.153 0.247 25153 5111 1 6 . 1 1 79 79 GLY N N 79 113.240 113.240 113.653 -0.413 25153 5112 1 6 . 1 1 79 79 GLY C C 79 174.460 174.460 174.544 -0.084 25153 5113 1 6 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.259 0.171 25153 5114 1 6 . 1 1 79 79 GLY H H 79 8.474 8.474 8.944 -0.470 25153 5115 1 6 . 1 1 80 80 LYS N N 80 120.295 120.295 121.026 -0.731 25153 5116 1 6 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.416 -0.058 25153 5117 1 6 . 1 1 80 80 LYS C C 80 175.360 175.360 175.962 -0.602 25153 5118 1 6 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.610 0.360 25153 5119 1 6 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.669 -0.469 25153 5120 1 6 . 1 1 81 81 ILE N N 81 122.400 122.400 120.844 1.556 25153 5121 1 6 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.693 0.100 25153 5122 1 6 . 1 1 81 81 ILE C C 81 174.760 174.760 175.564 -0.804 25153 5123 1 6 . 1 1 81 81 ILE CA C 81 59.830 59.830 60.999 -1.169 25153 5124 1 6 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.097 -0.397 25153 5125 1 6 . 1 1 81 81 ILE H H 81 7.400 7.400 7.730 -0.330 25153 5126 1 6 . 1 1 82 82 VAL N N 82 127.840 127.840 125.267 2.573 25153 5127 1 6 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.114 0.148 25153 5128 1 6 . 1 1 82 82 VAL C C 82 172.724 172.724 174.353 -1.629 25153 5129 1 6 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.226 0.184 25153 5130 1 6 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.535 -0.135 25153 5131 1 6 . 1 1 82 82 VAL H H 82 8.790 8.790 8.695 0.095 25153 5132 1 6 . 1 1 83 83 ALA N N 83 131.347 131.347 129.970 1.377 25153 5133 1 6 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.348 0.034 25153 5134 1 6 . 1 1 83 83 ALA C C 83 175.750 175.750 176.498 -0.748 25153 5135 1 6 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.112 -0.242 25153 5136 1 6 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.007 2.443 25153 5137 1 6 . 1 1 83 83 ALA H H 83 9.300 9.300 8.898 0.402 25153 5138 1 6 . 1 1 84 84 LEU N N 84 124.200 124.200 126.653 -2.453 25153 5139 1 6 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.647 -0.127 25153 5140 1 6 . 1 1 84 84 LEU C C 84 175.760 175.760 176.869 -1.109 25153 5141 1 6 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.989 -0.489 25153 5142 1 6 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.312 1.589 25153 5143 1 6 . 1 1 84 84 LEU H H 84 10.287 10.287 9.079 1.208 25153 5144 1 6 . 1 1 85 85 TYR N N 85 115.912 115.912 118.775 -2.863 25153 5145 1 6 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.295 -0.335 25153 5146 1 6 . 1 1 85 85 TYR C C 85 172.372 172.372 173.825 -1.453 25153 5147 1 6 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.155 0.945 25153 5148 1 6 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.476 1.554 25153 5149 1 6 . 1 1 85 85 TYR H H 85 9.257 9.257 8.832 0.425 25153 5150 1 6 . 1 1 86 86 GLY N N 86 107.800 107.800 105.558 2.242 25153 5151 1 6 . 1 1 86 86 GLY C C 86 170.330 170.330 171.510 -1.180 25153 5152 1 6 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.849 -0.479 25153 5153 1 6 . 1 1 86 86 GLY H H 86 9.027 9.027 8.647 0.380 25153 5154 1 6 . 1 1 87 87 LEU N N 87 123.458 123.458 118.629 4.829 25153 5155 1 6 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.383 0.082 25153 5156 1 6 . 1 1 87 87 LEU C C 87 178.100 178.100 176.212 1.888 25153 5157 1 6 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.812 0.778 25153 5158 1 6 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.271 0.069 25153 5159 1 6 . 1 1 87 87 LEU H H 87 6.580 6.580 7.826 -1.246 25153 5160 1 6 . 1 1 88 88 GLY N N 88 108.966 108.966 107.278 1.688 25153 5161 1 6 . 1 1 88 88 GLY C C 88 172.820 172.820 171.522 1.298 25153 5162 1 6 . 1 1 88 88 GLY CA C 88 46.660 46.660 46.068 0.592 25153 5163 1 6 . 1 1 88 88 GLY H H 88 8.070 8.070 8.362 -0.292 25153 5164 1 6 . 1 1 89 89 ASP N N 89 121.150 121.150 117.578 3.572 25153 5165 1 6 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.049 0.197 25153 5166 1 6 . 1 1 89 89 ASP C C 89 176.220 176.220 175.912 0.308 25153 5167 1 6 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.712 -0.242 25153 5168 1 6 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.454 -0.974 25153 5169 1 6 . 1 1 90 90 GLN N N 90 123.970 123.970 120.923 3.047 25153 5170 1 6 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.036 -0.548 25153 5171 1 6 . 1 1 90 90 GLN C C 90 173.646 173.646 175.848 -2.202 25153 5172 1 6 . 1 1 90 90 GLN CA C 90 58.310 58.310 56.805 1.505 25153 5173 1 6 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.436 -0.226 25153 5174 1 6 . 1 1 90 90 GLN H H 90 8.623 8.623 8.467 0.156 25153 5175 1 6 . 1 1 91 91 LEU N N 91 118.017 118.017 119.438 -1.421 25153 5176 1 6 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.010 0.365 25153 5177 1 6 . 1 1 91 91 LEU C C 91 180.160 180.160 178.825 1.335 25153 5178 1 6 . 1 1 91 91 LEU CA C 91 56.060 56.060 55.894 0.166 25153 5179 1 6 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.911 -0.361 25153 5180 1 6 . 1 1 91 91 LEU H H 91 7.046 7.046 8.477 -1.431 25153 5181 1 6 . 1 1 92 92 GLY N N 92 110.028 110.028 105.123 4.905 25153 5182 1 6 . 1 1 92 92 GLY C C 92 174.912 174.912 173.936 0.976 25153 5183 1 6 . 1 1 92 92 GLY CA C 92 46.180 46.180 46.040 0.140 25153 5184 1 6 . 1 1 92 92 GLY H H 92 9.238 9.238 8.172 1.066 25153 5185 1 6 . 1 1 93 93 TYR N N 93 115.910 115.910 114.883 1.027 25153 5186 1 6 . 1 1 93 93 TYR HA H 93 5.009 5.009 4.214 0.795 25153 5187 1 6 . 1 1 93 93 TYR C C 93 176.850 176.850 176.064 0.786 25153 5188 1 6 . 1 1 93 93 TYR CA C 93 56.730 56.730 57.191 -0.461 25153 5189 1 6 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.502 -0.372 25153 5190 1 6 . 1 1 93 93 TYR H H 93 6.962 6.962 6.729 0.233 25153 5191 1 6 . 1 1 94 94 GLY N N 94 111.630 111.630 107.536 4.094 25153 5192 1 6 . 1 1 94 94 GLY C C 94 177.777 177.777 175.375 2.402 25153 5193 1 6 . 1 1 94 94 GLY CA C 94 50.030 50.030 45.613 4.417 25153 5194 1 6 . 1 1 94 94 GLY H H 94 7.835 7.835 8.517 -0.682 25153 5195 1 6 . 1 1 95 95 GLU N N 95 122.450 122.450 120.681 1.769 25153 5196 1 6 . 1 1 95 95 GLU HA H 95 3.918 3.918 4.285 -0.367 25153 5197 1 6 . 1 1 95 95 GLU C C 95 175.300 175.300 178.730 -3.430 25153 5198 1 6 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.614 -0.514 25153 5199 1 6 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.312 -1.801 25153 5200 1 6 . 1 1 96 96 TRP N N 96 118.790 118.790 118.426 0.364 25153 5201 1 6 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.442 1.002 25153 5202 1 6 . 1 1 96 96 TRP C C 96 179.280 179.280 176.622 2.658 25153 5203 1 6 . 1 1 96 96 TRP CA C 96 57.015 57.015 56.019 0.996 25153 5204 1 6 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.240 0.780 25153 5205 1 6 . 1 1 96 96 TRP H H 96 8.070 8.070 7.787 0.283 25153 5206 1 6 . 1 1 97 97 PHE N N 97 128.067 128.067 120.265 7.802 25153 5207 1 6 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.335 0.970 25153 5208 1 6 . 1 1 97 97 PHE C C 97 173.227 173.227 176.036 -2.809 25153 5209 1 6 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.061 -2.341 25153 5210 1 6 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.435 0.505 25153 5211 1 6 . 1 1 97 97 PHE H H 97 7.165 7.165 7.953 -0.788 25153 5212 1 6 . 1 1 98 98 LEU N N 98 114.306 114.306 123.155 -8.849 25153 5213 1 6 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.685 -0.195 25153 5214 1 6 . 1 1 98 98 LEU C C 98 179.365 179.365 177.436 1.929 25153 5215 1 6 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.590 -0.130 25153 5216 1 6 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.773 -0.543 25153 5217 1 6 . 1 1 98 98 LEU H H 98 7.453 7.453 8.480 -1.027 25153 5218 1 6 . 1 1 99 99 ASP N N 99 122.354 122.354 120.380 1.974 25153 5219 1 6 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.275 -0.342 25153 5220 1 6 . 1 1 99 99 ASP C C 99 178.800 178.800 177.100 1.700 25153 5221 1 6 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.720 1.460 25153 5222 1 6 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.327 -0.897 25153 5223 1 6 . 1 1 100 100 ALA N N 100 118.568 118.568 121.898 -3.330 25153 5224 1 6 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.039 -0.199 25153 5225 1 6 . 1 1 100 100 ALA C C 100 178.500 178.500 179.208 -0.708 25153 5226 1 6 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.918 -0.002 25153 5227 1 6 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.396 1.264 25153 5228 1 6 . 1 1 100 100 ALA H H 100 8.682 8.682 7.786 0.896 25153 5229 1 6 . 1 1 101 101 LEU N N 101 118.815 118.815 120.640 -1.825 25153 5230 1 6 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.958 -0.278 25153 5231 1 6 . 1 1 101 101 LEU C C 101 178.930 178.930 178.786 0.144 25153 5232 1 6 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.815 -0.114 25153 5233 1 6 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.538 0.862 25153 5234 1 6 . 1 1 101 101 LEU H H 101 6.637 6.637 7.556 -0.919 25153 5235 1 6 . 1 1 102 102 GLY N N 102 103.700 103.700 106.347 -2.647 25153 5236 1 6 . 1 1 102 102 GLY C C 102 175.530 175.530 176.141 -0.611 25153 5237 1 6 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.259 0.741 25153 5238 1 6 . 1 1 102 102 GLY H H 102 7.330 7.330 7.873 -0.543 25153 5239 1 6 . 1 1 103 103 MET N N 103 120.330 120.330 121.511 -1.181 25153 5240 1 6 . 1 1 103 103 MET HA H 103 4.254 4.254 4.220 0.034 25153 5241 1 6 . 1 1 103 103 MET C C 103 179.688 179.688 178.641 1.047 25153 5242 1 6 . 1 1 103 103 MET CA C 103 59.615 59.615 59.506 0.109 25153 5243 1 6 . 1 1 103 103 MET CB C 103 33.290 33.290 32.589 0.701 25153 5244 1 6 . 1 1 103 103 MET H H 103 8.407 8.407 7.883 0.524 25153 5245 1 6 . 1 1 104 104 LEU N N 104 123.450 123.450 119.793 3.657 25153 5246 1 6 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.678 0.518 25153 5247 1 6 . 1 1 104 104 LEU C C 104 177.620 177.620 178.801 -1.181 25153 5248 1 6 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.902 0.068 25153 5249 1 6 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.290 0.010 25153 5250 1 6 . 1 1 104 104 LEU H H 104 8.330 8.330 8.630 -0.300 25153 5251 1 6 . 1 1 105 105 HIS N N 105 119.040 119.040 119.190 -0.150 25153 5252 1 6 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.108 -0.231 25153 5253 1 6 . 1 1 105 105 HIS C C 105 177.100 177.100 176.981 0.119 25153 5254 1 6 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.625 0.345 25153 5255 1 6 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.753 -1.160 25153 5256 1 6 . 1 1 105 105 HIS H H 105 8.050 8.050 8.309 -0.259 25153 5257 1 6 . 1 1 106 106 ASP N N 106 119.950 119.950 119.231 0.719 25153 5258 1 6 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.529 -0.199 25153 5259 1 6 . 1 1 106 106 ASP C C 106 179.300 179.300 178.547 0.753 25153 5260 1 6 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.552 1.258 25153 5261 1 6 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.053 -0.652 25153 5262 1 6 . 1 1 107 107 LYS N N 107 122.060 122.060 119.611 2.449 25153 5263 1 6 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.073 0.060 25153 5264 1 6 . 1 1 107 107 LYS C C 107 178.100 178.100 179.380 -1.280 25153 5265 1 6 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.827 -0.627 25153 5266 1 6 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.382 -0.022 25153 5267 1 6 . 1 1 108 108 LEU N N 108 115.610 115.610 117.721 -2.111 25153 5268 1 6 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.135 -0.067 25153 5269 1 6 . 1 1 108 108 LEU C C 108 178.866 178.866 178.338 0.528 25153 5270 1 6 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.683 -0.729 25153 5271 1 6 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.408 0.752 25153 5272 1 6 . 1 1 108 108 LEU H H 108 7.828 7.828 8.454 -0.626 25153 5273 1 6 . 1 1 109 109 SER N N 109 116.362 116.362 114.867 1.495 25153 5274 1 6 . 1 1 109 109 SER HA H 109 4.299 4.299 4.239 0.060 25153 5275 1 6 . 1 1 109 109 SER C C 109 175.660 175.660 176.744 -1.084 25153 5276 1 6 . 1 1 109 109 SER CA C 109 62.350 62.350 61.135 1.215 25153 5277 1 6 . 1 1 109 109 SER CB C 109 62.815 62.815 62.848 -0.033 25153 5278 1 6 . 1 1 109 109 SER H H 109 8.278 8.278 8.558 -0.280 25153 5279 1 6 . 1 1 110 110 THR N N 110 110.230 110.230 116.742 -6.512 25153 5280 1 6 . 1 1 110 110 THR HA H 110 4.615 4.615 4.238 0.377 25153 5281 1 6 . 1 1 110 110 THR C C 110 175.990 175.990 175.336 0.654 25153 5282 1 6 . 1 1 110 110 THR CA C 110 62.090 62.090 64.366 -2.276 25153 5283 1 6 . 1 1 110 110 THR CB C 110 68.800 68.800 68.919 -0.119 25153 5284 1 6 . 1 1 110 110 THR H H 110 7.211 7.211 7.719 -0.508 25153 5285 1 6 . 1 1 111 111 LYS N N 111 119.900 119.900 119.525 0.375 25153 5286 1 6 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.331 0.181 25153 5287 1 6 . 1 1 111 111 LYS C C 111 176.916 176.916 176.562 0.354 25153 5288 1 6 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.580 0.074 25153 5289 1 6 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.910 -1.067 25153 5290 1 6 . 1 1 112 112 GLY N N 112 107.910 107.910 108.065 -0.155 25153 5291 1 6 . 1 1 112 112 GLY C C 112 176.250 176.250 174.246 2.004 25153 5292 1 6 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.714 1.326 25153 5293 1 6 . 1 1 112 112 GLY H H 112 8.366 8.366 7.586 0.780 25153 5294 1 6 . 1 1 113 113 VAL N N 113 113.530 113.530 116.634 -3.104 25153 5295 1 6 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.607 -0.133 25153 5296 1 6 . 1 1 113 113 VAL C C 113 174.630 174.630 174.933 -0.303 25153 5297 1 6 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.477 -1.027 25153 5298 1 6 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.731 -0.181 25153 5299 1 6 . 1 1 113 113 VAL H H 113 6.903 6.903 7.002 -0.099 25153 5300 1 6 . 1 1 114 114 LYS N N 114 123.020 123.020 118.961 4.059 25153 5301 1 6 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.392 0.113 25153 5302 1 6 . 1 1 114 114 LYS C C 114 175.000 175.000 174.393 0.607 25153 5303 1 6 . 1 1 114 114 LYS CA C 114 54.200 54.200 53.956 0.244 25153 5304 1 6 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.950 -1.610 25153 5305 1 6 . 1 1 115 115 PHE N N 115 123.290 123.290 119.656 3.634 25153 5306 1 6 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.702 0.011 25153 5307 1 6 . 1 1 115 115 PHE C C 115 177.605 177.605 176.317 1.288 25153 5308 1 6 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.747 1.863 25153 5309 1 6 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.854 -0.854 25153 5310 1 6 . 1 1 115 115 PHE H H 115 8.494 8.494 8.473 0.021 25153 5311 1 6 . 1 1 116 116 VAL N N 116 115.790 115.790 115.266 0.524 25153 5312 1 6 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.368 0.124 25153 5313 1 6 . 1 1 116 116 VAL C C 116 175.414 175.414 176.028 -0.614 25153 5314 1 6 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.388 -0.402 25153 5315 1 6 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.446 -0.346 25153 5316 1 6 . 1 1 116 116 VAL H H 116 8.889 8.889 8.480 0.409 25153 5317 1 6 . 1 1 117 117 GLY N N 117 108.300 108.300 107.818 0.482 25153 5318 1 6 . 1 1 117 117 GLY C C 117 176.180 176.180 174.782 1.398 25153 5319 1 6 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.582 2.218 25153 5320 1 6 . 1 1 117 117 GLY H H 117 9.810 9.810 8.648 1.162 25153 5321 1 6 . 1 1 118 118 TYR N N 118 120.050 120.050 119.746 0.304 25153 5322 1 6 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.783 0.171 25153 5323 1 6 . 1 1 118 118 TYR C C 118 177.450 177.450 176.099 1.351 25153 5324 1 6 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.607 -1.367 25153 5325 1 6 . 1 1 118 118 TYR CB C 118 36.110 36.110 38.978 -2.868 25153 5326 1 6 . 1 1 118 118 TYR H H 118 8.592 8.592 7.449 1.143 25153 5327 1 6 . 1 1 119 119 TRP N N 119 125.500 125.500 122.489 3.011 25153 5328 1 6 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.149 0.879 25153 5329 1 6 . 1 1 119 119 TRP C C 119 173.090 173.090 174.310 -1.220 25153 5330 1 6 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.346 -0.446 25153 5331 1 6 . 1 1 119 119 TRP CB C 119 36.250 36.250 32.987 3.263 25153 5332 1 6 . 1 1 119 119 TRP H H 119 7.926 7.926 8.222 -0.296 25153 5333 1 6 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.702 0.108 25153 5334 1 6 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.826 0.854 25153 5335 1 6 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.626 -0.376 25153 5336 1 6 . 1 1 121 121 THR N N 121 109.114 109.114 111.466 -2.352 25153 5337 1 6 . 1 1 121 121 THR HA H 121 4.142 4.142 3.489 0.653 25153 5338 1 6 . 1 1 121 121 THR C C 121 176.300 176.300 175.553 0.747 25153 5339 1 6 . 1 1 121 121 THR CA C 121 61.230 61.230 62.556 -1.326 25153 5340 1 6 . 1 1 121 121 THR CB C 121 69.890 69.890 68.616 1.274 25153 5341 1 6 . 1 1 121 121 THR H H 121 7.356 7.356 8.393 -1.037 25153 5342 1 6 . 1 1 122 122 GLU N N 122 123.980 123.980 121.964 2.016 25153 5343 1 6 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.027 0.211 25153 5344 1 6 . 1 1 122 122 GLU C C 122 177.830 177.830 177.863 -0.033 25153 5345 1 6 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.660 0.570 25153 5346 1 6 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.865 -0.095 25153 5347 1 6 . 1 1 123 123 GLY N N 123 114.570 114.570 113.221 1.349 25153 5348 1 6 . 1 1 123 123 GLY C C 123 173.700 173.700 174.597 -0.897 25153 5349 1 6 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.426 -0.026 25153 5350 1 6 . 1 1 123 123 GLY H H 123 9.181 9.181 8.740 0.441 25153 5351 1 6 . 1 1 124 124 TYR N N 124 118.923 118.923 120.682 -1.759 25153 5352 1 6 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.566 0.744 25153 5353 1 6 . 1 1 124 124 TYR C C 124 175.680 175.680 175.572 0.108 25153 5354 1 6 . 1 1 124 124 TYR CA C 124 56.470 56.470 59.042 -2.572 25153 5355 1 6 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.172 0.828 25153 5356 1 6 . 1 1 124 124 TYR H H 124 7.877 7.877 7.826 0.051 25153 5357 1 6 . 1 1 125 125 GLU N N 125 124.890 124.890 120.832 4.058 25153 5358 1 6 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.624 0.076 25153 5359 1 6 . 1 1 125 125 GLU C C 125 172.880 172.880 175.479 -2.599 25153 5360 1 6 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.928 -0.498 25153 5361 1 6 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.742 -0.322 25153 5362 1 6 . 1 1 126 126 PHE N N 126 119.166 119.166 119.366 -0.200 25153 5363 1 6 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.765 0.044 25153 5364 1 6 . 1 1 126 126 PHE C C 126 173.750 173.750 174.809 -1.059 25153 5365 1 6 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.766 -1.976 25153 5366 1 6 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.513 0.537 25153 5367 1 6 . 1 1 126 126 PHE H H 126 7.716 7.716 8.001 -0.285 25153 5368 1 6 . 1 1 127 127 THR N N 127 106.800 106.800 111.819 -5.019 25153 5369 1 6 . 1 1 127 127 THR HA H 127 4.400 4.400 3.263 1.137 25153 5370 1 6 . 1 1 127 127 THR C C 127 175.300 175.300 174.803 0.497 25153 5371 1 6 . 1 1 127 127 THR CA C 127 61.100 61.100 63.049 -1.949 25153 5372 1 6 . 1 1 127 127 THR CB C 127 70.600 70.600 67.933 2.667 25153 5373 1 6 . 1 1 127 127 THR H H 127 7.220 7.220 6.488 0.732 25153 5374 1 6 . 1 1 128 128 SER N N 128 118.360 118.360 115.870 2.490 25153 5375 1 6 . 1 1 128 128 SER HA H 128 4.680 4.680 4.574 0.106 25153 5376 1 6 . 1 1 128 128 SER C C 128 175.720 175.720 174.548 1.172 25153 5377 1 6 . 1 1 128 128 SER CA C 128 56.250 56.250 56.824 -0.574 25153 5378 1 6 . 1 1 128 128 SER CB C 128 65.635 65.635 64.369 1.266 25153 5379 1 6 . 1 1 128 128 SER H H 128 7.411 7.411 8.091 -0.680 25153 5380 1 6 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.680 0.095 25153 5381 1 6 . 1 1 129 129 PRO CA C 129 62.500 62.500 63.823 -1.323 25153 5382 1 6 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.526 -0.126 25153 5383 1 6 . 1 1 130 130 LYS N N 130 122.014 122.014 120.669 1.345 25153 5384 1 6 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.312 -0.079 25153 5385 1 6 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.697 3.003 25153 5386 1 6 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.029 -0.459 25153 5387 1 6 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.524 -0.006 25153 5388 1 6 . 1 1 131 131 PRO C C 131 174.000 174.000 175.106 -1.106 25153 5389 1 6 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.237 2.463 25153 5390 1 6 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.190 1.010 25153 5391 1 6 . 1 1 132 132 VAL N N 132 113.260 113.260 116.993 -3.733 25153 5392 1 6 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.798 0.402 25153 5393 1 6 . 1 1 132 132 VAL C C 132 175.210 175.210 174.880 0.330 25153 5394 1 6 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.911 -0.291 25153 5395 1 6 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.963 -0.983 25153 5396 1 6 . 1 1 132 132 VAL H H 132 6.697 6.697 7.567 -0.870 25153 5397 1 6 . 1 1 133 133 ILE N N 133 119.940 119.940 116.869 3.071 25153 5398 1 6 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.516 -0.136 25153 5399 1 6 . 1 1 133 133 ILE C C 133 175.440 175.440 175.183 0.257 25153 5400 1 6 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.986 1.464 25153 5401 1 6 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.008 2.092 25153 5402 1 6 . 1 1 133 133 ILE H H 133 8.756 8.756 8.668 0.088 25153 5403 1 6 . 1 1 134 134 ALA N N 134 122.632 122.632 123.915 -1.283 25153 5404 1 6 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.919 0.041 25153 5405 1 6 . 1 1 134 134 ALA C C 134 178.312 178.312 177.211 1.101 25153 5406 1 6 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.589 -1.509 25153 5407 1 6 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.235 -0.399 25153 5408 1 6 . 1 1 134 134 ALA H H 134 8.523 8.523 8.494 0.029 25153 5409 1 6 . 1 1 135 135 ASP N N 135 117.366 117.366 122.787 -5.421 25153 5410 1 6 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.670 -0.418 25153 5411 1 6 . 1 1 135 135 ASP C C 135 176.387 176.387 176.640 -0.253 25153 5412 1 6 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.345 1.865 25153 5413 1 6 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.219 -1.519 25153 5414 1 6 . 1 1 136 136 GLY N N 136 104.310 104.310 108.091 -3.781 25153 5415 1 6 . 1 1 136 136 GLY C C 136 174.922 174.922 174.926 -0.004 25153 5416 1 6 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.397 -0.297 25153 5417 1 6 . 1 1 136 136 GLY H H 136 7.610 7.610 8.315 -0.705 25153 5418 1 6 . 1 1 137 137 GLN N N 137 118.784 118.784 117.678 1.106 25153 5419 1 6 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.407 -0.352 25153 5420 1 6 . 1 1 137 137 GLN C C 137 176.390 176.390 175.400 0.990 25153 5421 1 6 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.896 1.744 25153 5422 1 6 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.216 0.014 25153 5423 1 6 . 1 1 137 137 GLN H H 137 7.870 7.870 7.880 -0.010 25153 5424 1 6 . 1 1 138 138 LEU N N 138 118.040 118.040 115.836 2.204 25153 5425 1 6 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.999 -0.012 25153 5426 1 6 . 1 1 138 138 LEU C C 138 175.913 175.913 175.096 0.817 25153 5427 1 6 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.185 0.415 25153 5428 1 6 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.863 1.537 25153 5429 1 6 . 1 1 138 138 LEU H H 138 7.356 7.356 7.181 0.175 25153 5430 1 6 . 1 1 139 139 PHE N N 139 119.060 119.060 119.746 -0.686 25153 5431 1 6 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.829 0.481 25153 5432 1 6 . 1 1 139 139 PHE C C 139 178.780 178.780 177.537 1.243 25153 5433 1 6 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.116 -0.266 25153 5434 1 6 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.796 3.664 25153 5435 1 6 . 1 1 139 139 PHE H H 139 10.094 10.094 8.932 1.162 25153 5436 1 6 . 1 1 140 140 VAL N N 140 109.690 109.690 114.669 -4.979 25153 5437 1 6 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.429 0.052 25153 5438 1 6 . 1 1 140 140 VAL C C 140 172.790 172.790 175.492 -2.702 25153 5439 1 6 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.441 -1.442 25153 5440 1 6 . 1 1 140 140 VAL CB C 140 30.550 30.550 30.920 -0.370 25153 5441 1 6 . 1 1 140 140 VAL H H 140 7.470 7.470 8.049 -0.579 25153 5442 1 6 . 1 1 141 141 GLY N N 141 107.060 107.060 105.273 1.787 25153 5443 1 6 . 1 1 141 141 GLY C C 141 171.513 171.513 172.506 -0.993 25153 5444 1 6 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.504 0.926 25153 5445 1 6 . 1 1 141 141 GLY H H 141 7.137 7.137 7.319 -0.182 25153 5446 1 6 . 1 1 142 142 LEU N N 142 117.863 117.863 120.260 -2.397 25153 5447 1 6 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.198 -1.223 25153 5448 1 6 . 1 1 142 142 LEU C C 142 173.640 173.640 175.128 -1.488 25153 5449 1 6 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.667 1.253 25153 5450 1 6 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.428 -4.878 25153 5451 1 6 . 1 1 142 142 LEU H H 142 7.517 7.517 7.556 -0.039 25153 5452 1 6 . 1 1 143 143 ALA N N 143 126.990 126.990 129.150 -2.160 25153 5453 1 6 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.420 -0.143 25153 5454 1 6 . 1 1 143 143 ALA C C 143 175.730 175.730 176.046 -0.316 25153 5455 1 6 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.293 -0.853 25153 5456 1 6 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.245 4.064 25153 5457 1 6 . 1 1 143 143 ALA H H 143 5.186 5.186 8.260 -3.074 25153 5458 1 6 . 1 1 144 144 LEU N N 144 125.477 125.477 124.848 0.629 25153 5459 1 6 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.740 0.040 25153 5460 1 6 . 1 1 144 144 LEU C C 144 174.473 174.473 175.118 -0.645 25153 5461 1 6 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.670 -0.430 25153 5462 1 6 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.993 0.307 25153 5463 1 6 . 1 1 144 144 LEU H H 144 8.758 8.758 8.176 0.582 25153 5464 1 6 . 1 1 145 145 ASP N N 145 118.915 118.915 119.024 -0.109 25153 5465 1 6 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.142 0.390 25153 5466 1 6 . 1 1 145 145 ASP C C 145 176.470 176.470 175.856 0.614 25153 5467 1 6 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.008 -0.378 25153 5468 1 6 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.140 -1.140 25153 5469 1 6 . 1 1 146 146 GLU N N 146 124.813 124.813 123.064 1.749 25153 5470 1 6 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.596 -0.220 25153 5471 1 6 . 1 1 146 146 GLU C C 146 177.290 177.290 176.269 1.021 25153 5472 1 6 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.160 -0.041 25153 5473 1 6 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.427 0.723 25153 5474 1 6 . 1 1 147 147 THR N N 147 118.328 118.328 114.166 4.162 25153 5475 1 6 . 1 1 147 147 THR HA H 147 4.200 4.200 4.676 -0.476 25153 5476 1 6 . 1 1 147 147 THR C C 147 175.683 175.683 174.623 1.060 25153 5477 1 6 . 1 1 147 147 THR CA C 147 66.250 66.250 63.055 3.195 25153 5478 1 6 . 1 1 147 147 THR CB C 147 69.600 69.600 70.080 -0.480 25153 5479 1 6 . 1 1 147 147 THR H H 147 8.562 8.562 8.481 0.081 25153 5480 1 6 . 1 1 148 148 ASN N N 148 115.550 115.550 118.160 -2.610 25153 5481 1 6 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.758 0.229 25153 5482 1 6 . 1 1 148 148 ASN C C 148 175.870 175.870 175.359 0.511 25153 5483 1 6 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.452 -0.752 25153 5484 1 6 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.169 1.711 25153 5485 1 6 . 1 1 148 148 ASN H H 148 9.118 9.118 8.968 0.150 25153 5486 1 6 . 1 1 149 149 GLN N N 149 117.400 117.400 119.047 -1.647 25153 5487 1 6 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.295 0.548 25153 5488 1 6 . 1 1 149 149 GLN C C 149 177.780 177.780 176.266 1.514 25153 5489 1 6 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.375 -1.475 25153 5490 1 6 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.696 0.604 25153 5491 1 6 . 1 1 149 149 GLN H H 149 7.555 7.555 7.949 -0.394 25153 5492 1 6 . 1 1 150 150 TYR N N 150 120.674 120.674 117.586 3.088 25153 5493 1 6 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.378 0.150 25153 5494 1 6 . 1 1 150 150 TYR C C 150 177.830 177.830 176.464 1.366 25153 5495 1 6 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.370 0.117 25153 5496 1 6 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.938 -0.338 25153 5497 1 6 . 1 1 150 150 TYR H H 150 6.983 6.983 7.815 -0.832 25153 5498 1 6 . 1 1 151 151 ASP N N 151 120.810 120.810 119.367 1.443 25153 5499 1 6 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.682 -0.167 25153 5500 1 6 . 1 1 151 151 ASP C C 151 176.400 176.400 177.102 -0.702 25153 5501 1 6 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.717 -0.316 25153 5502 1 6 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.431 -2.351 25153 5503 1 6 . 1 1 152 152 LEU N N 152 118.083 118.083 114.010 4.073 25153 5504 1 6 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.771 -0.095 25153 5505 1 6 . 1 1 152 152 LEU C C 152 178.470 178.470 178.260 0.210 25153 5506 1 6 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.432 -0.832 25153 5507 1 6 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.401 -0.801 25153 5508 1 6 . 1 1 152 152 LEU H H 152 7.453 7.453 7.416 0.037 25153 5509 1 6 . 1 1 153 153 SER N N 153 116.407 116.407 117.983 -1.576 25153 5510 1 6 . 1 1 153 153 SER HA H 153 3.960 3.960 4.009 -0.049 25153 5511 1 6 . 1 1 153 153 SER C C 153 174.590 174.590 175.843 -1.253 25153 5512 1 6 . 1 1 153 153 SER CA C 153 63.400 63.400 62.077 1.323 25153 5513 1 6 . 1 1 153 153 SER CB C 153 63.100 63.100 62.629 0.471 25153 5514 1 6 . 1 1 153 153 SER H H 153 7.360 7.360 8.365 -1.005 25153 5515 1 6 . 1 1 154 154 ASP N N 154 121.960 121.960 121.816 0.144 25153 5516 1 6 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.342 -0.032 25153 5517 1 6 . 1 1 154 154 ASP C C 154 178.640 178.640 177.808 0.832 25153 5518 1 6 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.292 1.708 25153 5519 1 6 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.945 -1.375 25153 5520 1 6 . 1 1 155 155 GLU N N 155 121.310 121.310 118.909 2.401 25153 5521 1 6 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.112 0.073 25153 5522 1 6 . 1 1 155 155 GLU C C 155 179.600 179.600 178.853 0.747 25153 5523 1 6 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.968 0.482 25153 5524 1 6 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.618 -0.218 25153 5525 1 6 . 1 1 156 156 ARG N N 156 121.394 121.394 120.243 1.151 25153 5526 1 6 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.318 -0.018 25153 5527 1 6 . 1 1 156 156 ARG C C 156 177.330 177.330 178.975 -1.645 25153 5528 1 6 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.956 1.504 25153 5529 1 6 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.338 0.422 25153 5530 1 6 . 1 1 157 157 ILE N N 157 118.390 118.390 121.119 -2.729 25153 5531 1 6 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.727 -0.293 25153 5532 1 6 . 1 1 157 157 ILE C C 157 178.814 178.814 177.599 1.215 25153 5533 1 6 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.246 0.448 25153 5534 1 6 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.956 0.897 25153 5535 1 6 . 1 1 157 157 ILE H H 157 8.966 8.966 8.196 0.770 25153 5536 1 6 . 1 1 158 158 GLN N N 158 120.060 120.060 118.929 1.131 25153 5537 1 6 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.988 -0.032 25153 5538 1 6 . 1 1 158 158 GLN C C 158 178.843 178.843 178.512 0.331 25153 5539 1 6 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.380 1.220 25153 5540 1 6 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.240 0.150 25153 5541 1 6 . 1 1 158 158 GLN H H 158 8.394 8.394 7.994 0.400 25153 5542 1 6 . 1 1 159 159 SER N N 159 115.613 115.613 117.203 -1.590 25153 5543 1 6 . 1 1 159 159 SER HA H 159 4.455 4.455 4.381 0.074 25153 5544 1 6 . 1 1 159 159 SER C C 159 177.330 177.330 176.533 0.797 25153 5545 1 6 . 1 1 159 159 SER CA C 159 62.400 62.400 62.408 -0.008 25153 5546 1 6 . 1 1 159 159 SER CB C 159 63.760 63.760 63.146 0.614 25153 5547 1 6 . 1 1 159 159 SER H H 159 8.460 8.460 8.293 0.167 25153 5548 1 6 . 1 1 160 160 TRP N N 160 126.820 126.820 124.701 2.119 25153 5549 1 6 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.090 0.375 25153 5550 1 6 . 1 1 160 160 TRP C C 160 178.050 178.050 177.344 0.706 25153 5551 1 6 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.651 1.049 25153 5552 1 6 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.291 0.069 25153 5553 1 6 . 1 1 160 160 TRP H H 160 9.318 9.318 8.341 0.977 25153 5554 1 6 . 1 1 161 161 CYS N N 161 116.750 116.750 118.000 -1.250 25153 5555 1 6 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.728 0.155 25153 5556 1 6 . 1 1 161 161 CYS C C 161 176.270 176.270 177.039 -0.769 25153 5557 1 6 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.248 1.113 25153 5558 1 6 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.961 0.919 25153 5559 1 6 . 1 1 161 161 CYS H H 161 8.950 8.950 9.029 -0.079 25153 5560 1 6 . 1 1 162 162 GLU N N 162 118.096 118.096 118.889 -0.793 25153 5561 1 6 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.056 -0.126 25153 5562 1 6 . 1 1 162 162 GLU C C 162 178.680 178.680 177.853 0.827 25153 5563 1 6 . 1 1 162 162 GLU CA C 162 59.730 59.730 58.865 0.865 25153 5564 1 6 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.502 -0.072 25153 5565 1 6 . 1 1 163 163 GLN N N 163 120.790 120.790 118.074 2.716 25153 5566 1 6 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.130 0.047 25153 5567 1 6 . 1 1 163 163 GLN C C 163 179.690 179.690 178.012 1.678 25153 5568 1 6 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.200 1.340 25153 5569 1 6 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.953 0.047 25153 5570 1 6 . 1 1 163 163 GLN H H 163 8.205 8.205 7.538 0.667 25153 5571 1 6 . 1 1 164 164 ILE N N 164 114.860 114.860 119.062 -4.202 25153 5572 1 6 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.865 0.178 25153 5573 1 6 . 1 1 164 164 ILE C C 164 178.680 178.680 177.377 1.303 25153 5574 1 6 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.041 2.169 25153 5575 1 6 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.605 0.095 25153 5576 1 6 . 1 1 164 164 ILE H H 164 9.005 9.005 7.985 1.020 25153 5577 1 6 . 1 1 165 165 LEU N N 165 123.900 123.900 116.195 7.705 25153 5578 1 6 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.208 -0.058 25153 5579 1 6 . 1 1 165 165 LEU C C 165 180.520 180.520 177.399 3.121 25153 5580 1 6 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.281 1.020 25153 5581 1 6 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.277 -0.227 25153 5582 1 6 . 1 1 165 165 LEU H H 165 7.825 7.825 8.086 -0.261 25153 5583 1 6 . 1 1 166 166 ASN N N 166 120.112 120.112 117.851 2.261 25153 5584 1 6 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.768 -0.185 25153 5585 1 6 . 1 1 166 166 ASN C C 166 178.440 178.440 177.171 1.269 25153 5586 1 6 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.838 0.582 25153 5587 1 6 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.766 -1.346 25153 5588 1 6 . 1 1 166 166 ASN H H 166 7.760 7.760 7.937 -0.177 25153 5589 1 6 . 1 1 167 167 GLU N N 167 121.370 121.370 122.023 -0.653 25153 5590 1 6 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.979 0.124 25153 5591 1 6 . 1 1 167 167 GLU C C 167 180.332 180.332 179.337 0.995 25153 5592 1 6 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.882 0.268 25153 5593 1 6 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.696 1.324 25153 5594 1 6 . 1 1 168 168 MET N N 168 118.532 118.532 117.261 1.271 25153 5595 1 6 . 1 1 168 168 MET HA H 168 4.015 4.015 4.250 -0.235 25153 5596 1 6 . 1 1 168 168 MET C C 168 176.600 176.600 178.112 -1.512 25153 5597 1 6 . 1 1 168 168 MET CA C 168 59.300 59.300 59.493 -0.193 25153 5598 1 6 . 1 1 168 168 MET CB C 168 33.400 33.400 32.757 0.643 25153 5599 1 6 . 1 1 168 168 MET H H 168 8.718 8.718 8.519 0.199 25153 5600 1 6 . 1 1 169 169 ALA N N 169 121.922 121.922 122.505 -0.583 25153 5601 1 6 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.168 0.006 25153 5602 1 6 . 1 1 169 169 ALA C C 169 179.410 179.410 179.779 -0.369 25153 5603 1 6 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.875 -0.475 25153 5604 1 6 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.434 -0.024 25153 5605 1 6 . 1 1 169 169 ALA H H 169 7.448 7.448 7.936 -0.488 25153 5606 1 6 . 1 1 170 170 GLU N N 170 117.300 117.300 116.601 0.699 25153 5607 1 6 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.079 0.016 25153 5608 1 6 . 1 1 170 170 GLU C C 170 177.470 177.470 178.967 -1.497 25153 5609 1 6 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.838 -0.888 25153 5610 1 6 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.369 0.406 25153 5611 1 6 . 1 1 171 171 HIS N N 171 117.944 117.944 118.745 -0.801 25153 5612 1 6 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.347 0.153 25153 5613 1 6 . 1 1 171 171 HIS C C 171 175.120 175.120 176.772 -1.652 25153 5614 1 6 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.947 -1.747 25153 5615 1 6 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.293 0.307 25153 5616 1 6 . 1 1 171 171 HIS H H 171 7.788 7.788 7.674 0.114 25153 5617 1 6 . 1 1 172 172 TYR N N 172 120.040 120.040 117.797 2.243 25153 5618 1 6 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.506 0.087 25153 5619 1 6 . 1 1 172 172 TYR C C 172 174.612 174.612 175.680 -1.068 25153 5620 1 6 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.455 -0.475 25153 5621 1 6 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.610 0.370 25153 5622 1 6 . 1 1 172 172 TYR H H 172 7.820 7.820 8.021 -0.201 25153 5623 1 7 . 1 1 2 2 ASN N N 2 123.320 123.320 119.977 3.343 25153 5624 1 7 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.112 0.096 25153 5625 1 7 . 1 1 2 2 ASN C C 2 174.590 174.590 174.326 0.264 25153 5626 1 7 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.771 0.229 25153 5627 1 7 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.383 -0.413 25153 5628 1 7 . 1 1 2 2 ASN H H 2 9.428 9.428 8.341 1.087 25153 5629 1 7 . 1 1 3 3 MET N N 3 120.920 120.920 119.041 1.879 25153 5630 1 7 . 1 1 3 3 MET HA H 3 5.530 5.530 5.288 0.242 25153 5631 1 7 . 1 1 3 3 MET C C 3 174.400 174.400 175.028 -0.628 25153 5632 1 7 . 1 1 3 3 MET CA C 3 54.643 54.643 54.250 0.393 25153 5633 1 7 . 1 1 3 3 MET CB C 3 34.637 34.637 37.458 -2.821 25153 5634 1 7 . 1 1 3 3 MET H H 3 8.751 8.751 9.208 -0.457 25153 5635 1 7 . 1 1 4 4 GLY N N 4 115.542 115.542 109.295 6.247 25153 5636 1 7 . 1 1 4 4 GLY C C 4 170.413 170.413 172.230 -1.817 25153 5637 1 7 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.802 -0.700 25153 5638 1 7 . 1 1 4 4 GLY H H 4 8.927 8.927 8.862 0.065 25153 5639 1 7 . 1 1 5 5 LEU N N 5 131.030 131.030 128.154 2.876 25153 5640 1 7 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.333 1.069 25153 5641 1 7 . 1 1 5 5 LEU C C 5 175.952 175.952 174.553 1.399 25153 5642 1 7 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.074 0.376 25153 5643 1 7 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.007 2.585 25153 5644 1 7 . 1 1 5 5 LEU H H 5 8.928 8.928 8.661 0.267 25153 5645 1 7 . 1 1 6 6 PHE N N 6 125.790 125.790 126.195 -0.405 25153 5646 1 7 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.777 -0.037 25153 5647 1 7 . 1 1 6 6 PHE C C 6 174.300 174.300 175.792 -1.492 25153 5648 1 7 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.297 -0.977 25153 5649 1 7 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.660 -0.430 25153 5650 1 7 . 1 1 6 6 PHE H H 6 9.237 9.237 9.485 -0.248 25153 5651 1 7 . 1 1 7 7 TYR N N 7 117.289 117.289 117.283 0.006 25153 5652 1 7 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.945 0.020 25153 5653 1 7 . 1 1 7 7 TYR C C 7 171.262 171.262 173.308 -2.046 25153 5654 1 7 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.211 -0.810 25153 5655 1 7 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.297 -0.057 25153 5656 1 7 . 1 1 7 7 TYR H H 7 8.125 8.125 8.438 -0.313 25153 5657 1 7 . 1 1 8 8 GLY N N 8 107.420 107.420 106.548 0.872 25153 5658 1 7 . 1 1 8 8 GLY C C 8 172.000 172.000 172.312 -0.312 25153 5659 1 7 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.328 -0.384 25153 5660 1 7 . 1 1 8 8 GLY H H 8 7.031 7.031 8.494 -1.463 25153 5661 1 7 . 1 1 9 9 SER N N 9 118.150 118.150 117.678 0.472 25153 5662 1 7 . 1 1 9 9 SER HA H 9 5.200 5.200 5.207 -0.007 25153 5663 1 7 . 1 1 9 9 SER C C 9 175.000 175.000 174.513 0.487 25153 5664 1 7 . 1 1 9 9 SER CA C 9 57.570 57.570 57.603 -0.033 25153 5665 1 7 . 1 1 9 9 SER CB C 9 66.700 66.700 66.299 0.401 25153 5666 1 7 . 1 1 9 9 SER H H 9 9.604 9.604 8.418 1.186 25153 5667 1 7 . 1 1 10 10 SER N N 10 131.193 131.193 120.180 11.013 25153 5668 1 7 . 1 1 10 10 SER HA H 10 4.775 4.775 4.463 0.312 25153 5669 1 7 . 1 1 10 10 SER C C 10 175.730 175.730 175.189 0.541 25153 5670 1 7 . 1 1 10 10 SER CA C 10 61.750 61.750 60.504 1.246 25153 5671 1 7 . 1 1 10 10 SER CB C 10 64.400 64.400 63.608 0.792 25153 5672 1 7 . 1 1 10 10 SER H H 10 11.636 11.636 9.113 2.523 25153 5673 1 7 . 1 1 11 11 THR N N 11 115.848 115.848 114.948 0.900 25153 5674 1 7 . 1 1 11 11 THR HA H 11 4.770 4.770 4.396 0.374 25153 5675 1 7 . 1 1 11 11 THR C C 11 173.700 173.700 174.750 -1.050 25153 5676 1 7 . 1 1 11 11 THR CA C 11 60.700 60.700 62.357 -1.657 25153 5677 1 7 . 1 1 11 11 THR CB C 11 67.430 67.430 69.956 -2.526 25153 5678 1 7 . 1 1 11 11 THR H H 11 9.550 9.550 8.604 0.946 25153 5679 1 7 . 1 1 12 12 CYS N N 12 109.780 109.780 115.720 -5.940 25153 5680 1 7 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.692 -0.622 25153 5681 1 7 . 1 1 12 12 CYS C C 12 176.220 176.220 174.992 1.228 25153 5682 1 7 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.454 5.146 25153 5683 1 7 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.241 -0.841 25153 5684 1 7 . 1 1 12 12 CYS H H 12 7.437 7.437 8.061 -0.624 25153 5685 1 7 . 1 1 13 13 TYR N N 13 127.830 127.830 122.557 5.273 25153 5686 1 7 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.278 -0.175 25153 5687 1 7 . 1 1 13 13 TYR C C 13 180.880 180.880 177.910 2.970 25153 5688 1 7 . 1 1 13 13 TYR CA C 13 65.100 65.100 63.028 2.072 25153 5689 1 7 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.822 -0.987 25153 5690 1 7 . 1 1 13 13 TYR H H 13 10.886 10.886 7.222 3.664 25153 5691 1 7 . 1 1 14 14 THR N N 14 124.428 124.428 113.248 11.180 25153 5692 1 7 . 1 1 14 14 THR HA H 14 4.160 4.160 4.123 0.037 25153 5693 1 7 . 1 1 14 14 THR C C 14 177.760 177.760 176.071 1.689 25153 5694 1 7 . 1 1 14 14 THR CA C 14 67.823 67.823 67.486 0.337 25153 5695 1 7 . 1 1 14 14 THR CB C 14 68.040 68.040 68.200 -0.160 25153 5696 1 7 . 1 1 14 14 THR H H 14 11.405 11.405 8.757 2.648 25153 5697 1 7 . 1 1 15 15 GLU N N 15 123.050 123.050 122.897 0.153 25153 5698 1 7 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.141 -0.251 25153 5699 1 7 . 1 1 15 15 GLU C C 15 176.392 176.392 177.966 -1.574 25153 5700 1 7 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.445 -0.245 25153 5701 1 7 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.364 1.086 25153 5702 1 7 . 1 1 16 16 MET N N 16 120.173 120.173 118.436 1.737 25153 5703 1 7 . 1 1 16 16 MET HA H 16 4.050 4.050 4.135 -0.085 25153 5704 1 7 . 1 1 16 16 MET C C 16 179.940 179.940 178.754 1.186 25153 5705 1 7 . 1 1 16 16 MET CA C 16 59.240 59.240 59.226 0.014 25153 5706 1 7 . 1 1 16 16 MET CB C 16 32.970 32.970 32.856 0.114 25153 5707 1 7 . 1 1 16 16 MET H H 16 8.469 8.469 8.364 0.105 25153 5708 1 7 . 1 1 17 17 ALA N N 17 121.930 121.930 121.660 0.270 25153 5709 1 7 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.867 -0.031 25153 5710 1 7 . 1 1 17 17 ALA C C 17 177.900 177.900 178.759 -0.859 25153 5711 1 7 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.141 0.059 25153 5712 1 7 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.129 -0.129 25153 5713 1 7 . 1 1 17 17 ALA H H 17 7.880 7.880 8.378 -0.498 25153 5714 1 7 . 1 1 18 18 ALA N N 18 121.477 121.477 121.489 -0.012 25153 5715 1 7 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.862 -0.125 25153 5716 1 7 . 1 1 18 18 ALA C C 18 179.380 179.380 179.600 -0.220 25153 5717 1 7 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.184 -0.184 25153 5718 1 7 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.837 0.993 25153 5719 1 7 . 1 1 18 18 ALA H H 18 7.374 7.374 8.108 -0.734 25153 5720 1 7 . 1 1 19 19 GLU N N 19 116.650 116.650 118.064 -1.414 25153 5721 1 7 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.849 -0.233 25153 5722 1 7 . 1 1 19 19 GLU C C 19 178.479 178.479 179.302 -0.823 25153 5723 1 7 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.540 0.190 25153 5724 1 7 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.380 -0.080 25153 5725 1 7 . 1 1 20 20 LYS N N 20 119.470 119.470 119.900 -0.430 25153 5726 1 7 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.025 0.025 25153 5727 1 7 . 1 1 20 20 LYS C C 20 179.116 179.116 179.053 0.063 25153 5728 1 7 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.447 0.383 25153 5729 1 7 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.436 0.414 25153 5730 1 7 . 1 1 21 21 ILE N N 21 121.030 121.030 120.782 0.248 25153 5731 1 7 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.675 -0.285 25153 5732 1 7 . 1 1 21 21 ILE C C 21 177.580 177.580 178.217 -0.637 25153 5733 1 7 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.781 0.039 25153 5734 1 7 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.918 0.430 25153 5735 1 7 . 1 1 21 21 ILE H H 21 8.100 8.100 8.618 -0.518 25153 5736 1 7 . 1 1 22 22 ARG N N 22 119.720 119.720 119.462 0.258 25153 5737 1 7 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.858 -0.303 25153 5738 1 7 . 1 1 22 22 ARG C C 22 177.320 177.320 178.099 -0.779 25153 5739 1 7 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.736 -0.016 25153 5740 1 7 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.759 -0.827 25153 5741 1 7 . 1 1 23 23 ASP N N 23 118.730 118.730 119.416 -0.686 25153 5742 1 7 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.417 -0.054 25153 5743 1 7 . 1 1 23 23 ASP C C 23 178.330 178.330 178.802 -0.472 25153 5744 1 7 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.358 -0.408 25153 5745 1 7 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.867 -0.627 25153 5746 1 7 . 1 1 24 24 ILE N N 24 121.090 121.090 119.451 1.639 25153 5747 1 7 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.783 0.013 25153 5748 1 7 . 1 1 24 24 ILE C C 24 178.250 178.250 177.896 0.354 25153 5749 1 7 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.770 -0.620 25153 5750 1 7 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.289 0.191 25153 5751 1 7 . 1 1 24 24 ILE H H 24 7.910 7.910 8.223 -0.313 25153 5752 1 7 . 1 1 25 25 ILE N N 25 121.406 121.406 117.323 4.083 25153 5753 1 7 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.873 -0.227 25153 5754 1 7 . 1 1 25 25 ILE C C 25 176.800 176.800 176.759 0.041 25153 5755 1 7 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.021 2.679 25153 5756 1 7 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.968 -0.778 25153 5757 1 7 . 1 1 25 25 ILE H H 25 8.476 8.476 8.061 0.415 25153 5758 1 7 . 1 1 26 26 GLY N N 26 108.900 108.900 105.220 3.680 25153 5759 1 7 . 1 1 26 26 GLY C C 26 173.710 173.710 172.264 1.446 25153 5760 1 7 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.674 -0.344 25153 5761 1 7 . 1 1 26 26 GLY H H 26 8.016 8.016 7.830 0.186 25153 5762 1 7 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.706 -0.368 25153 5763 1 7 . 1 1 27 27 PRO C C 27 177.200 177.200 177.147 0.053 25153 5764 1 7 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.508 1.178 25153 5765 1 7 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.026 0.174 25153 5766 1 7 . 1 1 28 28 GLU N N 28 116.295 116.295 118.219 -1.924 25153 5767 1 7 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.199 0.071 25153 5768 1 7 . 1 1 28 28 GLU C C 28 176.980 176.980 177.170 -0.190 25153 5769 1 7 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.459 -0.719 25153 5770 1 7 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.549 -0.878 25153 5771 1 7 . 1 1 29 29 LEU N N 29 120.250 120.250 111.361 8.889 25153 5772 1 7 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.691 -0.055 25153 5773 1 7 . 1 1 29 29 LEU C C 29 175.770 175.770 175.688 0.082 25153 5774 1 7 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.407 0.393 25153 5775 1 7 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.023 1.077 25153 5776 1 7 . 1 1 29 29 LEU H H 29 7.940 7.940 7.602 0.338 25153 5777 1 7 . 1 1 30 30 VAL N N 30 118.693 118.693 121.141 -2.448 25153 5778 1 7 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.948 -0.300 25153 5779 1 7 . 1 1 30 30 VAL C C 30 174.347 174.347 176.088 -1.741 25153 5780 1 7 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.434 -0.566 25153 5781 1 7 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.489 2.091 25153 5782 1 7 . 1 1 30 30 VAL H H 30 7.434 7.434 8.053 -0.619 25153 5783 1 7 . 1 1 31 31 THR N N 31 123.800 123.800 121.953 1.847 25153 5784 1 7 . 1 1 31 31 THR HA H 31 4.362 4.362 4.533 -0.171 25153 5785 1 7 . 1 1 31 31 THR C C 31 172.964 172.964 173.294 -0.330 25153 5786 1 7 . 1 1 31 31 THR CA C 31 61.720 61.720 60.795 0.924 25153 5787 1 7 . 1 1 31 31 THR CB C 31 70.485 70.485 71.004 -0.519 25153 5788 1 7 . 1 1 31 31 THR H H 31 7.844 7.844 8.299 -0.455 25153 5789 1 7 . 1 1 32 32 LEU N N 32 127.800 127.800 126.792 1.008 25153 5790 1 7 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.559 0.125 25153 5791 1 7 . 1 1 32 32 LEU C C 32 176.600 176.600 176.433 0.167 25153 5792 1 7 . 1 1 32 32 LEU CA C 32 55.155 55.155 54.991 0.164 25153 5793 1 7 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.723 1.127 25153 5794 1 7 . 1 1 32 32 LEU H H 32 8.660 8.660 8.581 0.079 25153 5795 1 7 . 1 1 33 33 HIS N N 33 119.670 119.670 119.930 -0.260 25153 5796 1 7 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.812 -0.412 25153 5797 1 7 . 1 1 33 33 HIS C C 33 171.667 171.667 173.295 -1.628 25153 5798 1 7 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.985 0.215 25153 5799 1 7 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.510 0.690 25153 5800 1 7 . 1 1 33 33 HIS H H 33 9.060 9.060 8.724 0.336 25153 5801 1 7 . 1 1 34 34 ASN N N 34 124.068 124.068 123.176 0.892 25153 5802 1 7 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.142 -0.708 25153 5803 1 7 . 1 1 34 34 ASN C C 34 178.000 178.000 175.947 2.053 25153 5804 1 7 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.912 -0.483 25153 5805 1 7 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.168 -0.608 25153 5806 1 7 . 1 1 34 34 ASN H H 34 8.780 8.780 8.458 0.322 25153 5807 1 7 . 1 1 35 35 LEU N N 35 129.040 129.040 126.499 2.541 25153 5808 1 7 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.193 0.122 25153 5809 1 7 . 1 1 35 35 LEU C C 35 177.700 177.700 177.827 -0.127 25153 5810 1 7 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.364 0.116 25153 5811 1 7 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.786 1.514 25153 5812 1 7 . 1 1 35 35 LEU H H 35 8.821 8.821 8.468 0.353 25153 5813 1 7 . 1 1 36 36 LYS N N 36 121.043 121.043 116.556 4.487 25153 5814 1 7 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.074 -0.194 25153 5815 1 7 . 1 1 36 36 LYS C C 36 176.230 176.230 176.961 -0.731 25153 5816 1 7 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.396 1.024 25153 5817 1 7 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.552 0.718 25153 5818 1 7 . 1 1 37 37 ASP N N 37 114.965 114.965 118.103 -3.138 25153 5819 1 7 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.789 -0.012 25153 5820 1 7 . 1 1 37 37 ASP C C 37 175.440 175.440 175.931 -0.491 25153 5821 1 7 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.530 0.181 25153 5822 1 7 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.519 1.181 25153 5823 1 7 . 1 1 38 38 ASP N N 38 121.650 121.650 121.713 -0.063 25153 5824 1 7 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.869 0.001 25153 5825 1 7 . 1 1 38 38 ASP C C 38 174.852 174.852 176.001 -1.149 25153 5826 1 7 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.670 -1.590 25153 5827 1 7 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.280 -0.170 25153 5828 1 7 . 1 1 39 39 SER N N 39 115.207 115.207 118.000 -2.793 25153 5829 1 7 . 1 1 39 39 SER HA H 39 4.585 4.585 4.701 -0.116 25153 5830 1 7 . 1 1 39 39 SER C C 39 175.040 175.040 174.319 0.721 25153 5831 1 7 . 1 1 39 39 SER CA C 39 54.960 54.960 56.352 -1.392 25153 5832 1 7 . 1 1 39 39 SER CB C 39 64.720 64.720 63.617 1.103 25153 5833 1 7 . 1 1 39 39 SER H H 39 8.351 8.351 8.597 -0.246 25153 5834 1 7 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.330 -0.325 25153 5835 1 7 . 1 1 40 40 PRO C C 40 176.730 176.730 177.793 -1.063 25153 5836 1 7 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.984 -0.084 25153 5837 1 7 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.768 -0.368 25153 5838 1 7 . 1 1 41 41 LYS N N 41 121.150 121.150 119.933 1.217 25153 5839 1 7 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.016 -0.104 25153 5840 1 7 . 1 1 41 41 LYS C C 41 179.600 179.600 178.451 1.149 25153 5841 1 7 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.351 -1.151 25153 5842 1 7 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.714 0.286 25153 5843 1 7 . 1 1 42 42 LEU N N 42 118.103 118.103 116.617 1.486 25153 5844 1 7 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.246 -0.209 25153 5845 1 7 . 1 1 42 42 LEU C C 42 178.760 178.760 178.826 -0.066 25153 5846 1 7 . 1 1 42 42 LEU CA C 42 57.180 57.180 56.971 0.209 25153 5847 1 7 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.702 1.271 25153 5848 1 7 . 1 1 42 42 LEU H H 42 7.600 7.600 7.507 0.093 25153 5849 1 7 . 1 1 43 43 MET N N 43 118.917 118.917 118.296 0.621 25153 5850 1 7 . 1 1 43 43 MET HA H 43 3.750 3.750 4.247 -0.497 25153 5851 1 7 . 1 1 43 43 MET C C 43 177.680 177.680 176.759 0.921 25153 5852 1 7 . 1 1 43 43 MET CA C 43 59.730 59.730 58.080 1.650 25153 5853 1 7 . 1 1 43 43 MET CB C 43 32.700 32.700 32.070 0.630 25153 5854 1 7 . 1 1 43 43 MET H H 43 8.202 8.202 7.957 0.245 25153 5855 1 7 . 1 1 44 44 GLU N N 44 110.924 110.924 116.418 -5.494 25153 5856 1 7 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.247 -0.507 25153 5857 1 7 . 1 1 44 44 GLU C C 44 178.130 178.130 178.870 -0.740 25153 5858 1 7 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.390 1.010 25153 5859 1 7 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.986 -0.436 25153 5860 1 7 . 1 1 45 45 GLN N N 45 115.756 115.756 118.393 -2.637 25153 5861 1 7 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.036 0.147 25153 5862 1 7 . 1 1 45 45 GLN C C 45 175.414 175.414 177.214 -1.800 25153 5863 1 7 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.465 -1.286 25153 5864 1 7 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.138 -0.538 25153 5865 1 7 . 1 1 45 45 GLN H H 45 7.516 7.516 7.490 0.026 25153 5866 1 7 . 1 1 46 46 TYR N N 46 117.860 117.860 118.864 -1.004 25153 5867 1 7 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.349 0.314 25153 5868 1 7 . 1 1 46 46 TYR C C 46 175.500 175.500 176.844 -1.344 25153 5869 1 7 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.426 -0.940 25153 5870 1 7 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.380 3.091 25153 5871 1 7 . 1 1 46 46 TYR H H 46 6.996 6.996 7.178 -0.182 25153 5872 1 7 . 1 1 47 47 ASP N N 47 121.683 121.683 122.325 -0.642 25153 5873 1 7 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.660 0.040 25153 5874 1 7 . 1 1 47 47 ASP C C 47 175.610 175.610 175.020 0.590 25153 5875 1 7 . 1 1 47 47 ASP CA C 47 56.700 56.700 55.743 0.957 25153 5876 1 7 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.695 1.305 25153 5877 1 7 . 1 1 48 48 VAL N N 48 118.628 118.628 115.663 2.965 25153 5878 1 7 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.737 0.297 25153 5879 1 7 . 1 1 48 48 VAL C C 48 174.190 174.190 173.922 0.268 25153 5880 1 7 . 1 1 48 48 VAL CA C 48 60.190 60.190 60.911 -0.721 25153 5881 1 7 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.966 0.134 25153 5882 1 7 . 1 1 48 48 VAL H H 48 7.628 7.628 7.371 0.257 25153 5883 1 7 . 1 1 49 49 LEU N N 49 128.190 128.190 123.220 4.970 25153 5884 1 7 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.398 0.205 25153 5885 1 7 . 1 1 49 49 LEU C C 49 174.880 174.880 175.483 -0.603 25153 5886 1 7 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.817 -1.577 25153 5887 1 7 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.155 -0.815 25153 5888 1 7 . 1 1 49 49 LEU H H 49 9.407 9.407 8.945 0.462 25153 5889 1 7 . 1 1 50 50 ILE N N 50 124.550 124.550 120.941 3.609 25153 5890 1 7 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.077 0.623 25153 5891 1 7 . 1 1 50 50 ILE C C 50 175.300 175.300 174.569 0.731 25153 5892 1 7 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.885 -1.021 25153 5893 1 7 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.151 -0.901 25153 5894 1 7 . 1 1 50 50 ILE H H 50 9.238 9.238 9.205 0.033 25153 5895 1 7 . 1 1 51 51 LEU N N 51 127.460 127.460 128.403 -0.943 25153 5896 1 7 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.867 0.318 25153 5897 1 7 . 1 1 51 51 LEU C C 51 174.544 174.544 175.933 -1.389 25153 5898 1 7 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.572 -0.752 25153 5899 1 7 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.974 -2.337 25153 5900 1 7 . 1 1 51 51 LEU H H 51 9.228 9.228 9.168 0.060 25153 5901 1 7 . 1 1 52 52 GLY N N 52 107.760 107.760 111.559 -3.799 25153 5902 1 7 . 1 1 52 52 GLY C C 52 174.710 174.710 172.439 2.271 25153 5903 1 7 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.720 0.150 25153 5904 1 7 . 1 1 52 52 GLY H H 52 8.860 8.860 9.187 -0.327 25153 5905 1 7 . 1 1 53 53 ILE N N 53 123.890 123.890 120.268 3.622 25153 5906 1 7 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.876 0.394 25153 5907 1 7 . 1 1 53 53 ILE C C 53 172.630 172.630 173.195 -0.565 25153 5908 1 7 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.689 -0.009 25153 5909 1 7 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.347 3.813 25153 5910 1 7 . 1 1 53 53 ILE H H 53 8.458 8.458 8.256 0.202 25153 5911 1 7 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.979 0.409 25153 5912 1 7 . 1 1 54 54 PRO C C 54 175.000 175.000 176.506 -1.506 25153 5913 1 7 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.741 -0.141 25153 5914 1 7 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.357 -1.057 25153 5915 1 7 . 1 1 55 55 THR N N 55 112.754 112.754 117.901 -5.147 25153 5916 1 7 . 1 1 55 55 THR HA H 55 4.452 4.452 4.679 -0.227 25153 5917 1 7 . 1 1 55 55 THR C C 55 172.480 172.480 173.960 -1.480 25153 5918 1 7 . 1 1 55 55 THR CA C 55 62.350 62.350 63.178 -0.828 25153 5919 1 7 . 1 1 55 55 THR CB C 55 70.230 70.230 69.749 0.481 25153 5920 1 7 . 1 1 55 55 THR H H 55 6.523 6.523 8.223 -1.700 25153 5921 1 7 . 1 1 56 56 TRP N N 56 130.044 130.044 125.963 4.081 25153 5922 1 7 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.680 -1.965 25153 5923 1 7 . 1 1 56 56 TRP C C 56 172.890 172.890 175.172 -2.282 25153 5924 1 7 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.551 0.099 25153 5925 1 7 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.964 1.036 25153 5926 1 7 . 1 1 56 56 TRP H H 56 8.450 8.450 8.795 -0.345 25153 5927 1 7 . 1 1 57 57 ASP N N 57 115.275 115.275 120.290 -5.015 25153 5928 1 7 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.139 0.213 25153 5929 1 7 . 1 1 57 57 ASP C C 57 173.660 173.660 175.053 -1.393 25153 5930 1 7 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.277 0.953 25153 5931 1 7 . 1 1 57 57 ASP CB C 57 40.170 40.170 40.042 0.128 25153 5932 1 7 . 1 1 58 58 PHE N N 58 112.840 112.840 115.142 -2.302 25153 5933 1 7 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.863 -0.539 25153 5934 1 7 . 1 1 58 58 PHE C C 58 175.730 175.730 176.073 -0.343 25153 5935 1 7 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.948 0.875 25153 5936 1 7 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.145 -2.391 25153 5937 1 7 . 1 1 58 58 PHE H H 58 7.640 7.640 7.462 0.178 25153 5938 1 7 . 1 1 59 59 GLY N N 59 104.940 104.940 106.003 -1.063 25153 5939 1 7 . 1 1 59 59 GLY C C 59 173.750 173.750 174.951 -1.201 25153 5940 1 7 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.537 0.753 25153 5941 1 7 . 1 1 59 59 GLY H H 59 8.024 8.024 8.753 -0.729 25153 5942 1 7 . 1 1 60 60 GLU N N 60 120.045 120.045 119.378 0.667 25153 5943 1 7 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.514 -0.101 25153 5944 1 7 . 1 1 60 60 GLU C C 60 176.050 176.050 176.014 0.036 25153 5945 1 7 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.382 -0.762 25153 5946 1 7 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.055 -0.445 25153 5947 1 7 . 1 1 61 61 ILE N N 61 120.790 120.790 120.559 0.231 25153 5948 1 7 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.139 -0.672 25153 5949 1 7 . 1 1 61 61 ILE C C 61 175.130 175.130 176.031 -0.901 25153 5950 1 7 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.036 0.511 25153 5951 1 7 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.122 -0.272 25153 5952 1 7 . 1 1 61 61 ILE H H 61 8.200 8.200 8.429 -0.229 25153 5953 1 7 . 1 1 62 62 GLN N N 62 124.520 124.520 122.702 1.818 25153 5954 1 7 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.125 -0.169 25153 5955 1 7 . 1 1 62 62 GLN C C 62 177.160 177.160 177.174 -0.014 25153 5956 1 7 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.792 0.818 25153 5957 1 7 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.029 -2.379 25153 5958 1 7 . 1 1 62 62 GLN H H 62 5.667 5.667 8.637 -2.970 25153 5959 1 7 . 1 1 63 63 GLU N N 63 124.570 124.570 125.628 -1.058 25153 5960 1 7 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.258 -0.272 25153 5961 1 7 . 1 1 63 63 GLU C C 63 177.300 177.300 177.696 -0.396 25153 5962 1 7 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.895 1.825 25153 5963 1 7 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.341 0.779 25153 5964 1 7 . 1 1 64 64 ASP N N 64 119.060 119.060 118.970 0.090 25153 5965 1 7 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.517 0.103 25153 5966 1 7 . 1 1 64 64 ASP C C 64 179.180 179.180 177.415 1.765 25153 5967 1 7 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.649 1.301 25153 5968 1 7 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.498 0.452 25153 5969 1 7 . 1 1 65 65 TRP N N 65 121.070 121.070 121.588 -0.518 25153 5970 1 7 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.526 -0.186 25153 5971 1 7 . 1 1 65 65 TRP C C 65 178.970 178.970 178.262 0.708 25153 5972 1 7 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.536 0.284 25153 5973 1 7 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.240 0.160 25153 5974 1 7 . 1 1 65 65 TRP H H 65 7.350 7.350 7.903 -0.553 25153 5975 1 7 . 1 1 66 66 GLU N N 66 120.900 120.900 118.497 2.403 25153 5976 1 7 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.866 -0.026 25153 5977 1 7 . 1 1 66 66 GLU C C 66 178.750 178.750 179.115 -0.365 25153 5978 1 7 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.465 0.535 25153 5979 1 7 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.250 -0.390 25153 5980 1 7 . 1 1 67 67 ALA N N 67 119.130 119.130 119.707 -0.577 25153 5981 1 7 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.248 0.005 25153 5982 1 7 . 1 1 67 67 ALA C C 67 179.410 179.410 179.005 0.405 25153 5983 1 7 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.629 -0.049 25153 5984 1 7 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.881 -0.071 25153 5985 1 7 . 1 1 67 67 ALA H H 67 7.640 7.640 7.746 -0.106 25153 5986 1 7 . 1 1 68 68 VAL N N 68 106.845 106.845 110.908 -4.063 25153 5987 1 7 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.532 0.278 25153 5988 1 7 . 1 1 68 68 VAL C C 68 176.750 176.750 177.227 -0.477 25153 5989 1 7 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.303 -2.693 25153 5990 1 7 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.709 -0.089 25153 5991 1 7 . 1 1 68 68 VAL H H 68 7.219 7.219 7.582 -0.362 25153 5992 1 7 . 1 1 69 69 TRP N N 69 127.630 127.630 124.235 3.395 25153 5993 1 7 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.289 -0.051 25153 5994 1 7 . 1 1 69 69 TRP C C 69 178.670 178.670 177.132 1.538 25153 5995 1 7 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.569 -1.349 25153 5996 1 7 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.900 1.730 25153 5997 1 7 . 1 1 69 69 TRP H H 69 7.832 7.832 8.635 -0.803 25153 5998 1 7 . 1 1 70 70 ASP N N 70 114.544 114.544 118.300 -3.756 25153 5999 1 7 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.445 0.077 25153 6000 1 7 . 1 1 70 70 ASP C C 70 178.670 178.670 178.999 -0.329 25153 6001 1 7 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.271 -1.271 25153 6002 1 7 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.969 -1.119 25153 6003 1 7 . 1 1 71 71 GLN N N 71 120.040 120.040 119.363 0.677 25153 6004 1 7 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.120 0.063 25153 6005 1 7 . 1 1 71 71 GLN C C 71 178.910 178.910 178.834 0.076 25153 6006 1 7 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.364 -0.754 25153 6007 1 7 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.845 0.255 25153 6008 1 7 . 1 1 71 71 GLN H H 71 7.995 7.995 7.723 0.272 25153 6009 1 7 . 1 1 72 72 LEU N N 72 117.400 117.400 118.131 -0.731 25153 6010 1 7 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.980 -0.167 25153 6011 1 7 . 1 1 72 72 LEU C C 72 178.650 178.650 178.059 0.591 25153 6012 1 7 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.027 0.173 25153 6013 1 7 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.426 -0.016 25153 6014 1 7 . 1 1 72 72 LEU H H 72 7.450 7.450 7.619 -0.169 25153 6015 1 7 . 1 1 73 73 ASP N N 73 115.750 115.750 117.484 -1.734 25153 6016 1 7 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.425 -0.257 25153 6017 1 7 . 1 1 73 73 ASP C C 73 177.560 177.560 177.387 0.173 25153 6018 1 7 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.405 0.995 25153 6019 1 7 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.504 -1.404 25153 6020 1 7 . 1 1 74 74 ASP N N 74 117.223 117.223 119.957 -2.734 25153 6021 1 7 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.578 0.125 25153 6022 1 7 . 1 1 74 74 ASP C C 74 176.388 176.388 177.070 -0.682 25153 6023 1 7 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.070 -0.570 25153 6024 1 7 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.551 0.149 25153 6025 1 7 . 1 1 75 75 LEU N N 75 118.316 118.316 119.608 -1.292 25153 6026 1 7 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.417 -0.132 25153 6027 1 7 . 1 1 75 75 LEU C C 75 176.820 176.820 175.915 0.905 25153 6028 1 7 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.407 -0.007 25153 6029 1 7 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.460 0.820 25153 6030 1 7 . 1 1 75 75 LEU H H 75 6.960 6.960 7.314 -0.354 25153 6031 1 7 . 1 1 76 76 ASN N N 76 123.045 123.045 118.268 4.777 25153 6032 1 7 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.777 0.113 25153 6033 1 7 . 1 1 76 76 ASN C C 76 174.950 174.950 174.821 0.129 25153 6034 1 7 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.605 -0.555 25153 6035 1 7 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.373 -0.873 25153 6036 1 7 . 1 1 76 76 ASN H H 76 9.890 9.890 8.811 1.079 25153 6037 1 7 . 1 1 77 77 LEU N N 77 123.494 123.494 123.349 0.145 25153 6038 1 7 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.496 -0.126 25153 6039 1 7 . 1 1 77 77 LEU C C 77 175.040 175.040 176.240 -1.200 25153 6040 1 7 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.797 -1.547 25153 6041 1 7 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.142 0.758 25153 6042 1 7 . 1 1 77 77 LEU H H 77 8.730 8.730 7.965 0.765 25153 6043 1 7 . 1 1 78 78 GLU N N 78 120.870 120.870 120.810 0.060 25153 6044 1 7 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.404 -0.504 25153 6045 1 7 . 1 1 78 78 GLU C C 78 178.660 178.660 177.801 0.859 25153 6046 1 7 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.354 1.406 25153 6047 1 7 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.482 -0.082 25153 6048 1 7 . 1 1 79 79 GLY N N 79 113.240 113.240 113.800 -0.560 25153 6049 1 7 . 1 1 79 79 GLY C C 79 174.460 174.460 173.181 1.279 25153 6050 1 7 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.658 -0.228 25153 6051 1 7 . 1 1 79 79 GLY H H 79 8.474 8.474 8.788 -0.314 25153 6052 1 7 . 1 1 80 80 LYS N N 80 120.295 120.295 116.832 3.463 25153 6053 1 7 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.889 -0.531 25153 6054 1 7 . 1 1 80 80 LYS C C 80 175.360 175.360 175.032 0.328 25153 6055 1 7 . 1 1 80 80 LYS CA C 80 56.970 56.970 53.847 3.123 25153 6056 1 7 . 1 1 80 80 LYS CB C 80 33.200 33.200 35.664 -2.464 25153 6057 1 7 . 1 1 81 81 ILE N N 81 122.400 122.400 120.700 1.700 25153 6058 1 7 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.759 0.034 25153 6059 1 7 . 1 1 81 81 ILE C C 81 174.760 174.760 175.361 -0.601 25153 6060 1 7 . 1 1 81 81 ILE CA C 81 59.830 59.830 60.810 -0.980 25153 6061 1 7 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.487 -0.787 25153 6062 1 7 . 1 1 81 81 ILE H H 81 7.400 7.400 7.908 -0.508 25153 6063 1 7 . 1 1 82 82 VAL N N 82 127.840 127.840 124.139 3.701 25153 6064 1 7 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.968 0.294 25153 6065 1 7 . 1 1 82 82 VAL C C 82 172.724 172.724 174.269 -1.545 25153 6066 1 7 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.261 0.149 25153 6067 1 7 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.053 0.347 25153 6068 1 7 . 1 1 82 82 VAL H H 82 8.790 8.790 8.687 0.103 25153 6069 1 7 . 1 1 83 83 ALA N N 83 131.347 131.347 130.064 1.283 25153 6070 1 7 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.240 0.142 25153 6071 1 7 . 1 1 83 83 ALA C C 83 175.750 175.750 176.333 -0.583 25153 6072 1 7 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.078 -0.208 25153 6073 1 7 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.236 2.214 25153 6074 1 7 . 1 1 83 83 ALA H H 83 9.300 9.300 8.929 0.371 25153 6075 1 7 . 1 1 84 84 LEU N N 84 124.200 124.200 126.442 -2.242 25153 6076 1 7 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.670 -0.150 25153 6077 1 7 . 1 1 84 84 LEU C C 84 175.760 175.760 176.803 -1.043 25153 6078 1 7 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.716 -0.216 25153 6079 1 7 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.467 1.433 25153 6080 1 7 . 1 1 84 84 LEU H H 84 10.287 10.287 8.974 1.313 25153 6081 1 7 . 1 1 85 85 TYR N N 85 115.912 115.912 118.900 -2.988 25153 6082 1 7 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.306 -0.346 25153 6083 1 7 . 1 1 85 85 TYR C C 85 172.372 172.372 173.820 -1.448 25153 6084 1 7 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.095 1.005 25153 6085 1 7 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.533 1.497 25153 6086 1 7 . 1 1 85 85 TYR H H 85 9.257 9.257 8.864 0.393 25153 6087 1 7 . 1 1 86 86 GLY N N 86 107.800 107.800 106.217 1.583 25153 6088 1 7 . 1 1 86 86 GLY C C 86 170.330 170.330 171.504 -1.174 25153 6089 1 7 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.943 -0.573 25153 6090 1 7 . 1 1 86 86 GLY H H 86 9.027 9.027 8.800 0.227 25153 6091 1 7 . 1 1 87 87 LEU N N 87 123.458 123.458 118.237 5.221 25153 6092 1 7 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.469 -0.004 25153 6093 1 7 . 1 1 87 87 LEU C C 87 178.100 178.100 176.205 1.895 25153 6094 1 7 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.682 0.908 25153 6095 1 7 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.460 -0.120 25153 6096 1 7 . 1 1 87 87 LEU H H 87 6.580 6.580 7.815 -1.235 25153 6097 1 7 . 1 1 88 88 GLY N N 88 108.966 108.966 106.706 2.260 25153 6098 1 7 . 1 1 88 88 GLY C C 88 172.820 172.820 171.288 1.532 25153 6099 1 7 . 1 1 88 88 GLY CA C 88 46.660 46.660 46.360 0.300 25153 6100 1 7 . 1 1 88 88 GLY H H 88 8.070 8.070 8.140 -0.070 25153 6101 1 7 . 1 1 89 89 ASP N N 89 121.150 121.150 117.957 3.193 25153 6102 1 7 . 1 1 89 89 ASP HA H 89 5.246 5.246 4.634 0.612 25153 6103 1 7 . 1 1 89 89 ASP C C 89 176.220 176.220 174.349 1.871 25153 6104 1 7 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.701 -0.231 25153 6105 1 7 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.307 -0.827 25153 6106 1 7 . 1 1 90 90 GLN N N 90 123.970 123.970 120.422 3.548 25153 6107 1 7 . 1 1 90 90 GLN HA H 90 3.488 3.488 3.925 -0.437 25153 6108 1 7 . 1 1 90 90 GLN C C 90 173.646 173.646 176.089 -2.443 25153 6109 1 7 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.563 0.747 25153 6110 1 7 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.708 -0.498 25153 6111 1 7 . 1 1 90 90 GLN H H 90 8.623 8.623 8.084 0.539 25153 6112 1 7 . 1 1 91 91 LEU N N 91 118.017 118.017 118.831 -0.814 25153 6113 1 7 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.147 0.228 25153 6114 1 7 . 1 1 91 91 LEU C C 91 180.160 180.160 178.868 1.292 25153 6115 1 7 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.142 -0.082 25153 6116 1 7 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.971 -0.421 25153 6117 1 7 . 1 1 91 91 LEU H H 91 7.046 7.046 8.572 -1.526 25153 6118 1 7 . 1 1 92 92 GLY N N 92 110.028 110.028 104.880 5.148 25153 6119 1 7 . 1 1 92 92 GLY C C 92 174.912 174.912 173.944 0.968 25153 6120 1 7 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.907 0.273 25153 6121 1 7 . 1 1 92 92 GLY H H 92 9.238 9.238 8.745 0.493 25153 6122 1 7 . 1 1 93 93 TYR N N 93 115.910 115.910 119.076 -3.166 25153 6123 1 7 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.203 -0.194 25153 6124 1 7 . 1 1 93 93 TYR C C 93 176.850 176.850 178.022 -1.172 25153 6125 1 7 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.473 -1.743 25153 6126 1 7 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.049 -1.919 25153 6127 1 7 . 1 1 93 93 TYR H H 93 6.962 6.962 7.347 -0.385 25153 6128 1 7 . 1 1 94 94 GLY N N 94 111.630 111.630 107.146 4.484 25153 6129 1 7 . 1 1 94 94 GLY C C 94 177.777 177.777 175.514 2.263 25153 6130 1 7 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.071 2.959 25153 6131 1 7 . 1 1 94 94 GLY H H 94 7.835 7.835 8.411 -0.576 25153 6132 1 7 . 1 1 95 95 GLU N N 95 122.450 122.450 120.928 1.522 25153 6133 1 7 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.982 -0.064 25153 6134 1 7 . 1 1 95 95 GLU C C 95 175.300 175.300 176.506 -1.206 25153 6135 1 7 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.510 -0.409 25153 6136 1 7 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.100 -1.589 25153 6137 1 7 . 1 1 96 96 TRP N N 96 118.790 118.790 115.305 3.485 25153 6138 1 7 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.962 0.482 25153 6139 1 7 . 1 1 96 96 TRP C C 96 179.280 179.280 175.956 3.324 25153 6140 1 7 . 1 1 96 96 TRP CA C 96 57.015 57.015 56.374 0.641 25153 6141 1 7 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.427 -0.406 25153 6142 1 7 . 1 1 96 96 TRP H H 96 8.070 8.070 8.185 -0.115 25153 6143 1 7 . 1 1 97 97 PHE N N 97 128.067 128.067 122.017 6.050 25153 6144 1 7 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.259 1.046 25153 6145 1 7 . 1 1 97 97 PHE C C 97 173.227 173.227 175.990 -2.763 25153 6146 1 7 . 1 1 97 97 PHE CA C 97 56.720 56.720 58.419 -1.699 25153 6147 1 7 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.003 0.937 25153 6148 1 7 . 1 1 97 97 PHE H H 97 7.165 7.165 8.307 -1.142 25153 6149 1 7 . 1 1 98 98 LEU N N 98 114.306 114.306 122.987 -8.681 25153 6150 1 7 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.798 -0.308 25153 6151 1 7 . 1 1 98 98 LEU C C 98 179.365 179.365 177.134 2.231 25153 6152 1 7 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.115 0.345 25153 6153 1 7 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.422 -0.192 25153 6154 1 7 . 1 1 98 98 LEU H H 98 7.453 7.453 8.854 -1.401 25153 6155 1 7 . 1 1 99 99 ASP N N 99 122.354 122.354 120.663 1.691 25153 6156 1 7 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.364 -0.431 25153 6157 1 7 . 1 1 99 99 ASP C C 99 178.800 178.800 177.248 1.552 25153 6158 1 7 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.499 1.681 25153 6159 1 7 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.346 -0.916 25153 6160 1 7 . 1 1 100 100 ALA N N 100 118.568 118.568 121.937 -3.369 25153 6161 1 7 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.075 -0.235 25153 6162 1 7 . 1 1 100 100 ALA C C 100 178.500 178.500 179.089 -0.589 25153 6163 1 7 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.153 -0.237 25153 6164 1 7 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.533 1.127 25153 6165 1 7 . 1 1 100 100 ALA H H 100 8.682 8.682 7.910 0.772 25153 6166 1 7 . 1 1 101 101 LEU N N 101 118.815 118.815 120.478 -1.663 25153 6167 1 7 . 1 1 101 101 LEU HA H 101 3.680 3.680 4.003 -0.323 25153 6168 1 7 . 1 1 101 101 LEU C C 101 178.930 178.930 178.890 0.040 25153 6169 1 7 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.684 0.017 25153 6170 1 7 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.557 0.843 25153 6171 1 7 . 1 1 101 101 LEU H H 101 6.637 6.637 7.292 -0.655 25153 6172 1 7 . 1 1 102 102 GLY N N 102 103.700 103.700 106.324 -2.624 25153 6173 1 7 . 1 1 102 102 GLY C C 102 175.530 175.530 176.152 -0.622 25153 6174 1 7 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.281 0.719 25153 6175 1 7 . 1 1 102 102 GLY H H 102 7.330 7.330 7.893 -0.563 25153 6176 1 7 . 1 1 103 103 MET N N 103 120.330 120.330 121.436 -1.106 25153 6177 1 7 . 1 1 103 103 MET HA H 103 4.254 4.254 4.249 0.005 25153 6178 1 7 . 1 1 103 103 MET C C 103 179.688 179.688 178.634 1.054 25153 6179 1 7 . 1 1 103 103 MET CA C 103 59.615 59.615 59.498 0.117 25153 6180 1 7 . 1 1 103 103 MET CB C 103 33.290 33.290 32.621 0.669 25153 6181 1 7 . 1 1 103 103 MET H H 103 8.407 8.407 7.758 0.649 25153 6182 1 7 . 1 1 104 104 LEU N N 104 123.450 123.450 119.786 3.664 25153 6183 1 7 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.709 0.487 25153 6184 1 7 . 1 1 104 104 LEU C C 104 177.620 177.620 178.757 -1.137 25153 6185 1 7 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.883 0.088 25153 6186 1 7 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.249 0.051 25153 6187 1 7 . 1 1 104 104 LEU H H 104 8.330 8.330 8.610 -0.280 25153 6188 1 7 . 1 1 105 105 HIS N N 105 119.040 119.040 119.195 -0.155 25153 6189 1 7 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.060 -0.183 25153 6190 1 7 . 1 1 105 105 HIS C C 105 177.100 177.100 176.987 0.113 25153 6191 1 7 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.791 0.179 25153 6192 1 7 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.845 -1.252 25153 6193 1 7 . 1 1 105 105 HIS H H 105 8.050 8.050 8.185 -0.135 25153 6194 1 7 . 1 1 106 106 ASP N N 106 119.950 119.950 119.655 0.295 25153 6195 1 7 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.511 -0.181 25153 6196 1 7 . 1 1 106 106 ASP C C 106 179.300 179.300 178.374 0.926 25153 6197 1 7 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.740 1.070 25153 6198 1 7 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.242 -0.842 25153 6199 1 7 . 1 1 107 107 LYS N N 107 122.060 122.060 120.160 1.900 25153 6200 1 7 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.063 0.070 25153 6201 1 7 . 1 1 107 107 LYS C C 107 178.100 178.100 178.354 -0.254 25153 6202 1 7 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.493 -0.293 25153 6203 1 7 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.164 0.196 25153 6204 1 7 . 1 1 108 108 LEU N N 108 115.610 115.610 115.712 -0.102 25153 6205 1 7 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.368 -0.300 25153 6206 1 7 . 1 1 108 108 LEU C C 108 178.866 178.866 178.850 0.016 25153 6207 1 7 . 1 1 108 108 LEU CA C 108 55.954 55.954 55.898 0.056 25153 6208 1 7 . 1 1 108 108 LEU CB C 108 42.160 42.160 42.278 -0.118 25153 6209 1 7 . 1 1 108 108 LEU H H 108 7.828 7.828 8.133 -0.305 25153 6210 1 7 . 1 1 109 109 SER N N 109 116.362 116.362 116.414 -0.052 25153 6211 1 7 . 1 1 109 109 SER HA H 109 4.299 4.299 4.335 -0.036 25153 6212 1 7 . 1 1 109 109 SER C C 109 175.660 175.660 176.469 -0.809 25153 6213 1 7 . 1 1 109 109 SER CA C 109 62.350 62.350 61.502 0.848 25153 6214 1 7 . 1 1 109 109 SER CB C 109 62.815 62.815 62.874 -0.059 25153 6215 1 7 . 1 1 109 109 SER H H 109 8.278 8.278 8.663 -0.385 25153 6216 1 7 . 1 1 110 110 THR N N 110 110.230 110.230 116.004 -5.774 25153 6217 1 7 . 1 1 110 110 THR HA H 110 4.615 4.615 4.265 0.350 25153 6218 1 7 . 1 1 110 110 THR C C 110 175.990 175.990 175.301 0.689 25153 6219 1 7 . 1 1 110 110 THR CA C 110 62.090 62.090 63.918 -1.828 25153 6220 1 7 . 1 1 110 110 THR CB C 110 68.800 68.800 68.737 0.063 25153 6221 1 7 . 1 1 110 110 THR H H 110 7.211 7.211 7.711 -0.500 25153 6222 1 7 . 1 1 111 111 LYS N N 111 119.900 119.900 119.898 0.002 25153 6223 1 7 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.370 0.142 25153 6224 1 7 . 1 1 111 111 LYS C C 111 176.916 176.916 176.528 0.388 25153 6225 1 7 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.429 0.225 25153 6226 1 7 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.183 -1.340 25153 6227 1 7 . 1 1 112 112 GLY N N 112 107.910 107.910 108.070 -0.160 25153 6228 1 7 . 1 1 112 112 GLY C C 112 176.250 176.250 173.872 2.378 25153 6229 1 7 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.592 1.448 25153 6230 1 7 . 1 1 112 112 GLY H H 112 8.366 8.366 7.696 0.670 25153 6231 1 7 . 1 1 113 113 VAL N N 113 113.530 113.530 115.766 -2.236 25153 6232 1 7 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.564 -0.090 25153 6233 1 7 . 1 1 113 113 VAL C C 113 174.630 174.630 174.898 -0.268 25153 6234 1 7 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.422 -0.972 25153 6235 1 7 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.422 -0.872 25153 6236 1 7 . 1 1 113 113 VAL H H 113 6.903 6.903 6.978 -0.075 25153 6237 1 7 . 1 1 114 114 LYS N N 114 123.020 123.020 118.846 4.174 25153 6238 1 7 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.555 -0.050 25153 6239 1 7 . 1 1 114 114 LYS C C 114 175.000 175.000 174.880 0.120 25153 6240 1 7 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.541 -0.341 25153 6241 1 7 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.781 -1.441 25153 6242 1 7 . 1 1 115 115 PHE N N 115 123.290 123.290 120.302 2.988 25153 6243 1 7 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.692 0.021 25153 6244 1 7 . 1 1 115 115 PHE C C 115 177.605 177.605 175.953 1.652 25153 6245 1 7 . 1 1 115 115 PHE CA C 115 58.610 58.610 57.090 1.520 25153 6246 1 7 . 1 1 115 115 PHE CB C 115 41.000 41.000 42.208 -1.208 25153 6247 1 7 . 1 1 115 115 PHE H H 115 8.494 8.494 8.761 -0.267 25153 6248 1 7 . 1 1 116 116 VAL N N 116 115.790 115.790 112.544 3.246 25153 6249 1 7 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.561 -0.069 25153 6250 1 7 . 1 1 116 116 VAL C C 116 175.414 175.414 175.937 -0.523 25153 6251 1 7 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.448 -0.462 25153 6252 1 7 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.622 -0.522 25153 6253 1 7 . 1 1 116 116 VAL H H 116 8.889 8.889 8.316 0.573 25153 6254 1 7 . 1 1 117 117 GLY N N 117 108.300 108.300 107.140 1.160 25153 6255 1 7 . 1 1 117 117 GLY C C 117 176.180 176.180 174.676 1.504 25153 6256 1 7 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.272 2.528 25153 6257 1 7 . 1 1 117 117 GLY H H 117 9.810 9.810 8.584 1.226 25153 6258 1 7 . 1 1 118 118 TYR N N 118 120.050 120.050 119.787 0.263 25153 6259 1 7 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.662 0.292 25153 6260 1 7 . 1 1 118 118 TYR C C 118 177.450 177.450 175.925 1.525 25153 6261 1 7 . 1 1 118 118 TYR CA C 118 56.240 56.240 59.390 -3.150 25153 6262 1 7 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.162 -3.052 25153 6263 1 7 . 1 1 118 118 TYR H H 118 8.592 8.592 7.342 1.250 25153 6264 1 7 . 1 1 119 119 TRP N N 119 125.500 125.500 121.723 3.777 25153 6265 1 7 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.099 0.929 25153 6266 1 7 . 1 1 119 119 TRP C C 119 173.090 173.090 174.124 -1.034 25153 6267 1 7 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.281 -0.381 25153 6268 1 7 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.328 2.922 25153 6269 1 7 . 1 1 119 119 TRP H H 119 7.926 7.926 8.190 -0.264 25153 6270 1 7 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.721 0.089 25153 6271 1 7 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.653 1.027 25153 6272 1 7 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.737 -0.487 25153 6273 1 7 . 1 1 121 121 THR N N 121 109.114 109.114 110.521 -1.407 25153 6274 1 7 . 1 1 121 121 THR HA H 121 4.142 4.142 3.417 0.725 25153 6275 1 7 . 1 1 121 121 THR C C 121 176.300 176.300 175.285 1.015 25153 6276 1 7 . 1 1 121 121 THR CA C 121 61.230 61.230 63.180 -1.950 25153 6277 1 7 . 1 1 121 121 THR CB C 121 69.890 69.890 68.510 1.380 25153 6278 1 7 . 1 1 121 121 THR H H 121 7.356 7.356 8.290 -0.934 25153 6279 1 7 . 1 1 122 122 GLU N N 122 123.980 123.980 122.328 1.652 25153 6280 1 7 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.047 0.191 25153 6281 1 7 . 1 1 122 122 GLU C C 122 177.830 177.830 177.645 0.185 25153 6282 1 7 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.494 0.736 25153 6283 1 7 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.954 -0.184 25153 6284 1 7 . 1 1 123 123 GLY N N 123 114.570 114.570 112.427 2.143 25153 6285 1 7 . 1 1 123 123 GLY C C 123 173.700 173.700 173.674 0.026 25153 6286 1 7 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.674 -0.274 25153 6287 1 7 . 1 1 123 123 GLY H H 123 9.181 9.181 8.940 0.241 25153 6288 1 7 . 1 1 124 124 TYR N N 124 118.923 118.923 119.792 -0.869 25153 6289 1 7 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.922 0.388 25153 6290 1 7 . 1 1 124 124 TYR C C 124 175.680 175.680 173.808 1.872 25153 6291 1 7 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.363 -0.893 25153 6292 1 7 . 1 1 124 124 TYR CB C 124 41.000 41.000 42.448 -1.448 25153 6293 1 7 . 1 1 124 124 TYR H H 124 7.877 7.877 7.629 0.248 25153 6294 1 7 . 1 1 125 125 GLU N N 125 124.890 124.890 121.580 3.310 25153 6295 1 7 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.764 -0.064 25153 6296 1 7 . 1 1 125 125 GLU C C 125 172.880 172.880 175.091 -2.211 25153 6297 1 7 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.782 -0.352 25153 6298 1 7 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.430 -1.010 25153 6299 1 7 . 1 1 126 126 PHE N N 126 119.166 119.166 119.126 0.040 25153 6300 1 7 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.891 -0.082 25153 6301 1 7 . 1 1 126 126 PHE C C 126 173.750 173.750 174.968 -1.218 25153 6302 1 7 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.532 -1.742 25153 6303 1 7 . 1 1 126 126 PHE CB C 126 40.050 40.050 38.922 1.127 25153 6304 1 7 . 1 1 126 126 PHE H H 126 7.716 7.716 8.189 -0.473 25153 6305 1 7 . 1 1 127 127 THR N N 127 106.800 106.800 115.628 -8.828 25153 6306 1 7 . 1 1 127 127 THR HA H 127 4.400 4.400 3.316 1.084 25153 6307 1 7 . 1 1 127 127 THR C C 127 175.300 175.300 174.148 1.152 25153 6308 1 7 . 1 1 127 127 THR CA C 127 61.100 61.100 63.337 -2.237 25153 6309 1 7 . 1 1 127 127 THR CB C 127 70.600 70.600 68.066 2.534 25153 6310 1 7 . 1 1 127 127 THR H H 127 7.220 7.220 6.537 0.683 25153 6311 1 7 . 1 1 128 128 SER N N 128 118.360 118.360 116.079 2.281 25153 6312 1 7 . 1 1 128 128 SER HA H 128 4.680 4.680 4.567 0.113 25153 6313 1 7 . 1 1 128 128 SER C C 128 175.720 175.720 174.061 1.659 25153 6314 1 7 . 1 1 128 128 SER CA C 128 56.250 56.250 56.979 -0.729 25153 6315 1 7 . 1 1 128 128 SER CB C 128 65.635 65.635 64.209 1.426 25153 6316 1 7 . 1 1 128 128 SER H H 128 7.411 7.411 8.136 -0.725 25153 6317 1 7 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.599 0.176 25153 6318 1 7 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.198 -1.698 25153 6319 1 7 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.228 0.172 25153 6320 1 7 . 1 1 130 130 LYS N N 130 122.014 122.014 119.826 2.188 25153 6321 1 7 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.385 -0.152 25153 6322 1 7 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.327 3.373 25153 6323 1 7 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.995 -0.425 25153 6324 1 7 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.548 -0.030 25153 6325 1 7 . 1 1 131 131 PRO C C 131 174.000 174.000 175.163 -1.163 25153 6326 1 7 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.490 2.210 25153 6327 1 7 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.071 1.129 25153 6328 1 7 . 1 1 132 132 VAL N N 132 113.260 113.260 116.206 -2.946 25153 6329 1 7 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.961 0.239 25153 6330 1 7 . 1 1 132 132 VAL C C 132 175.210 175.210 174.805 0.405 25153 6331 1 7 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.233 -0.614 25153 6332 1 7 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.147 -1.167 25153 6333 1 7 . 1 1 132 132 VAL H H 132 6.697 6.697 7.540 -0.843 25153 6334 1 7 . 1 1 133 133 ILE N N 133 119.940 119.940 117.836 2.104 25153 6335 1 7 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.540 -0.160 25153 6336 1 7 . 1 1 133 133 ILE C C 133 175.440 175.440 175.214 0.226 25153 6337 1 7 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.042 1.408 25153 6338 1 7 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.133 1.967 25153 6339 1 7 . 1 1 133 133 ILE H H 133 8.756 8.756 8.717 0.039 25153 6340 1 7 . 1 1 134 134 ALA N N 134 122.632 122.632 123.896 -1.264 25153 6341 1 7 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.874 0.086 25153 6342 1 7 . 1 1 134 134 ALA C C 134 178.312 178.312 177.202 1.110 25153 6343 1 7 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.575 -1.496 25153 6344 1 7 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.208 -0.372 25153 6345 1 7 . 1 1 134 134 ALA H H 134 8.523 8.523 8.475 0.048 25153 6346 1 7 . 1 1 135 135 ASP N N 135 117.366 117.366 122.683 -5.317 25153 6347 1 7 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.663 -0.411 25153 6348 1 7 . 1 1 135 135 ASP C C 135 176.387 176.387 176.644 -0.257 25153 6349 1 7 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.361 1.849 25153 6350 1 7 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.247 -1.547 25153 6351 1 7 . 1 1 136 136 GLY N N 136 104.310 104.310 108.062 -3.752 25153 6352 1 7 . 1 1 136 136 GLY C C 136 174.922 174.922 174.940 -0.018 25153 6353 1 7 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.391 -0.291 25153 6354 1 7 . 1 1 136 136 GLY H H 136 7.610 7.610 8.324 -0.714 25153 6355 1 7 . 1 1 137 137 GLN N N 137 118.784 118.784 117.783 1.001 25153 6356 1 7 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.427 -0.372 25153 6357 1 7 . 1 1 137 137 GLN C C 137 176.390 176.390 175.437 0.953 25153 6358 1 7 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.803 1.837 25153 6359 1 7 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.198 0.031 25153 6360 1 7 . 1 1 137 137 GLN H H 137 7.870 7.870 7.860 0.010 25153 6361 1 7 . 1 1 138 138 LEU N N 138 118.040 118.040 115.927 2.113 25153 6362 1 7 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.981 0.006 25153 6363 1 7 . 1 1 138 138 LEU C C 138 175.913 175.913 175.177 0.736 25153 6364 1 7 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.177 0.423 25153 6365 1 7 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.902 1.498 25153 6366 1 7 . 1 1 138 138 LEU H H 138 7.356 7.356 7.200 0.156 25153 6367 1 7 . 1 1 139 139 PHE N N 139 119.060 119.060 119.662 -0.602 25153 6368 1 7 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.946 0.364 25153 6369 1 7 . 1 1 139 139 PHE C C 139 178.780 178.780 177.787 0.993 25153 6370 1 7 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.997 -0.147 25153 6371 1 7 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.825 3.635 25153 6372 1 7 . 1 1 139 139 PHE H H 139 10.094 10.094 8.891 1.203 25153 6373 1 7 . 1 1 140 140 VAL N N 140 109.690 109.690 116.503 -6.813 25153 6374 1 7 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.834 -0.353 25153 6375 1 7 . 1 1 140 140 VAL C C 140 172.790 172.790 175.627 -2.837 25153 6376 1 7 . 1 1 140 140 VAL CA C 140 62.000 62.000 64.026 -2.026 25153 6377 1 7 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.281 -0.731 25153 6378 1 7 . 1 1 140 140 VAL H H 140 7.470 7.470 8.101 -0.631 25153 6379 1 7 . 1 1 141 141 GLY N N 141 107.060 107.060 105.351 1.709 25153 6380 1 7 . 1 1 141 141 GLY C C 141 171.513 171.513 172.525 -1.012 25153 6381 1 7 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.367 1.063 25153 6382 1 7 . 1 1 141 141 GLY H H 141 7.137 7.137 7.341 -0.204 25153 6383 1 7 . 1 1 142 142 LEU N N 142 117.863 117.863 120.424 -2.561 25153 6384 1 7 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.135 -1.160 25153 6385 1 7 . 1 1 142 142 LEU C C 142 173.640 173.640 175.045 -1.405 25153 6386 1 7 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.642 1.278 25153 6387 1 7 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.245 -4.695 25153 6388 1 7 . 1 1 142 142 LEU H H 142 7.517 7.517 7.676 -0.159 25153 6389 1 7 . 1 1 143 143 ALA N N 143 126.990 126.990 128.660 -1.670 25153 6390 1 7 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.807 -0.530 25153 6391 1 7 . 1 1 143 143 ALA C C 143 175.730 175.730 175.876 -0.146 25153 6392 1 7 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.096 -0.656 25153 6393 1 7 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.835 3.475 25153 6394 1 7 . 1 1 143 143 ALA H H 143 5.186 5.186 8.078 -2.892 25153 6395 1 7 . 1 1 144 144 LEU N N 144 125.477 125.477 123.047 2.430 25153 6396 1 7 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.942 -0.162 25153 6397 1 7 . 1 1 144 144 LEU C C 144 174.473 174.473 175.006 -0.533 25153 6398 1 7 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.389 -0.149 25153 6399 1 7 . 1 1 144 144 LEU CB C 144 45.300 45.300 46.918 -1.618 25153 6400 1 7 . 1 1 144 144 LEU H H 144 8.758 8.758 8.391 0.367 25153 6401 1 7 . 1 1 145 145 ASP N N 145 118.915 118.915 118.951 -0.036 25153 6402 1 7 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.319 0.213 25153 6403 1 7 . 1 1 145 145 ASP C C 145 176.470 176.470 176.054 0.416 25153 6404 1 7 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.815 -0.184 25153 6405 1 7 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.142 -0.142 25153 6406 1 7 . 1 1 146 146 GLU N N 146 124.813 124.813 123.598 1.215 25153 6407 1 7 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.532 -0.156 25153 6408 1 7 . 1 1 146 146 GLU C C 146 177.290 177.290 176.597 0.693 25153 6409 1 7 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.595 0.525 25153 6410 1 7 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.257 0.893 25153 6411 1 7 . 1 1 147 147 THR N N 147 118.328 118.328 112.087 6.241 25153 6412 1 7 . 1 1 147 147 THR HA H 147 4.200 4.200 4.553 -0.353 25153 6413 1 7 . 1 1 147 147 THR C C 147 175.683 175.683 173.868 1.815 25153 6414 1 7 . 1 1 147 147 THR CA C 147 66.250 66.250 63.031 3.219 25153 6415 1 7 . 1 1 147 147 THR CB C 147 69.600 69.600 70.315 -0.715 25153 6416 1 7 . 1 1 147 147 THR H H 147 8.562 8.562 8.815 -0.253 25153 6417 1 7 . 1 1 148 148 ASN N N 148 115.550 115.550 117.383 -1.833 25153 6418 1 7 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.774 0.213 25153 6419 1 7 . 1 1 148 148 ASN C C 148 175.870 175.870 176.280 -0.410 25153 6420 1 7 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.135 -0.435 25153 6421 1 7 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.360 1.520 25153 6422 1 7 . 1 1 148 148 ASN H H 148 9.118 9.118 8.371 0.747 25153 6423 1 7 . 1 1 149 149 GLN N N 149 117.400 117.400 119.582 -2.182 25153 6424 1 7 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.273 0.570 25153 6425 1 7 . 1 1 149 149 GLN C C 149 177.780 177.780 177.623 0.157 25153 6426 1 7 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.467 -1.567 25153 6427 1 7 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.145 1.155 25153 6428 1 7 . 1 1 149 149 GLN H H 149 7.555 7.555 8.594 -1.039 25153 6429 1 7 . 1 1 150 150 TYR N N 150 120.674 120.674 115.780 4.894 25153 6430 1 7 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.388 0.140 25153 6431 1 7 . 1 1 150 150 TYR C C 150 177.830 177.830 176.100 1.730 25153 6432 1 7 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.522 -0.035 25153 6433 1 7 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.846 -0.246 25153 6434 1 7 . 1 1 150 150 TYR H H 150 6.983 6.983 7.712 -0.729 25153 6435 1 7 . 1 1 151 151 ASP N N 151 120.810 120.810 118.985 1.825 25153 6436 1 7 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.691 -0.176 25153 6437 1 7 . 1 1 151 151 ASP C C 151 176.400 176.400 177.141 -0.741 25153 6438 1 7 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.583 -0.183 25153 6439 1 7 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.592 -2.511 25153 6440 1 7 . 1 1 152 152 LEU N N 152 118.083 118.083 112.831 5.252 25153 6441 1 7 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.914 -0.238 25153 6442 1 7 . 1 1 152 152 LEU C C 152 178.470 178.470 177.523 0.947 25153 6443 1 7 . 1 1 152 152 LEU CA C 152 54.600 54.600 54.895 -0.296 25153 6444 1 7 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.450 -0.850 25153 6445 1 7 . 1 1 152 152 LEU H H 152 7.453 7.453 7.523 -0.070 25153 6446 1 7 . 1 1 153 153 SER N N 153 116.407 116.407 117.900 -1.493 25153 6447 1 7 . 1 1 153 153 SER HA H 153 3.960 3.960 4.013 -0.053 25153 6448 1 7 . 1 1 153 153 SER C C 153 174.590 174.590 175.880 -1.290 25153 6449 1 7 . 1 1 153 153 SER CA C 153 63.400 63.400 62.193 1.207 25153 6450 1 7 . 1 1 153 153 SER CB C 153 63.100 63.100 62.690 0.410 25153 6451 1 7 . 1 1 153 153 SER H H 153 7.360 7.360 8.324 -0.964 25153 6452 1 7 . 1 1 154 154 ASP N N 154 121.960 121.960 120.696 1.264 25153 6453 1 7 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.332 -0.022 25153 6454 1 7 . 1 1 154 154 ASP C C 154 178.640 178.640 177.989 0.651 25153 6455 1 7 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.654 1.345 25153 6456 1 7 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.747 -1.177 25153 6457 1 7 . 1 1 155 155 GLU N N 155 121.310 121.310 119.216 2.094 25153 6458 1 7 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.098 0.087 25153 6459 1 7 . 1 1 155 155 GLU C C 155 179.600 179.600 179.192 0.408 25153 6460 1 7 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.163 0.287 25153 6461 1 7 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.277 0.123 25153 6462 1 7 . 1 1 156 156 ARG N N 156 121.394 121.394 119.806 1.588 25153 6463 1 7 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.275 0.025 25153 6464 1 7 . 1 1 156 156 ARG C C 156 177.330 177.330 179.199 -1.869 25153 6465 1 7 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.010 2.450 25153 6466 1 7 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.010 0.750 25153 6467 1 7 . 1 1 157 157 ILE N N 157 118.390 118.390 121.296 -2.906 25153 6468 1 7 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.774 -0.340 25153 6469 1 7 . 1 1 157 157 ILE C C 157 178.814 178.814 177.644 1.170 25153 6470 1 7 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.642 1.052 25153 6471 1 7 . 1 1 157 157 ILE CB C 157 38.853 38.853 38.015 0.838 25153 6472 1 7 . 1 1 157 157 ILE H H 157 8.966 8.966 8.331 0.635 25153 6473 1 7 . 1 1 158 158 GLN N N 158 120.060 120.060 119.339 0.721 25153 6474 1 7 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.973 -0.017 25153 6475 1 7 . 1 1 158 158 GLN C C 158 178.843 178.843 178.534 0.309 25153 6476 1 7 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.393 1.207 25153 6477 1 7 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.303 0.087 25153 6478 1 7 . 1 1 158 158 GLN H H 158 8.394 8.394 8.384 0.010 25153 6479 1 7 . 1 1 159 159 SER N N 159 115.613 115.613 116.846 -1.233 25153 6480 1 7 . 1 1 159 159 SER HA H 159 4.455 4.455 4.491 -0.036 25153 6481 1 7 . 1 1 159 159 SER C C 159 177.330 177.330 176.359 0.971 25153 6482 1 7 . 1 1 159 159 SER CA C 159 62.400 62.400 62.407 -0.007 25153 6483 1 7 . 1 1 159 159 SER CB C 159 63.760 63.760 63.094 0.666 25153 6484 1 7 . 1 1 159 159 SER H H 159 8.460 8.460 8.582 -0.122 25153 6485 1 7 . 1 1 160 160 TRP N N 160 126.820 126.820 124.147 2.673 25153 6486 1 7 . 1 1 160 160 TRP HA H 160 4.465 4.465 3.994 0.471 25153 6487 1 7 . 1 1 160 160 TRP C C 160 178.050 178.050 177.489 0.561 25153 6488 1 7 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.139 1.561 25153 6489 1 7 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.280 0.080 25153 6490 1 7 . 1 1 160 160 TRP H H 160 9.318 9.318 7.965 1.353 25153 6491 1 7 . 1 1 161 161 CYS N N 161 116.750 116.750 117.832 -1.082 25153 6492 1 7 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.771 0.112 25153 6493 1 7 . 1 1 161 161 CYS C C 161 176.270 176.270 177.141 -0.871 25153 6494 1 7 . 1 1 161 161 CYS CA C 161 65.360 65.360 63.124 2.236 25153 6495 1 7 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.372 1.508 25153 6496 1 7 . 1 1 161 161 CYS H H 161 8.950 8.950 9.004 -0.054 25153 6497 1 7 . 1 1 162 162 GLU N N 162 118.096 118.096 120.505 -2.409 25153 6498 1 7 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.018 -0.088 25153 6499 1 7 . 1 1 162 162 GLU C C 162 178.680 178.680 177.527 1.153 25153 6500 1 7 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.311 0.419 25153 6501 1 7 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.352 0.078 25153 6502 1 7 . 1 1 163 163 GLN N N 163 120.790 120.790 117.786 3.004 25153 6503 1 7 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.103 0.074 25153 6504 1 7 . 1 1 163 163 GLN C C 163 179.690 179.690 178.223 1.467 25153 6505 1 7 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.797 1.743 25153 6506 1 7 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.072 -0.072 25153 6507 1 7 . 1 1 163 163 GLN H H 163 8.205 8.205 7.478 0.727 25153 6508 1 7 . 1 1 164 164 ILE N N 164 114.860 114.860 118.980 -4.120 25153 6509 1 7 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.863 0.180 25153 6510 1 7 . 1 1 164 164 ILE C C 164 178.680 178.680 177.339 1.341 25153 6511 1 7 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.031 2.179 25153 6512 1 7 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.597 0.103 25153 6513 1 7 . 1 1 164 164 ILE H H 164 9.005 9.005 7.904 1.101 25153 6514 1 7 . 1 1 165 165 LEU N N 165 123.900 123.900 116.064 7.836 25153 6515 1 7 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.209 -0.059 25153 6516 1 7 . 1 1 165 165 LEU C C 165 180.520 180.520 177.298 3.222 25153 6517 1 7 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.188 1.112 25153 6518 1 7 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.296 -0.246 25153 6519 1 7 . 1 1 165 165 LEU H H 165 7.825 7.825 7.924 -0.099 25153 6520 1 7 . 1 1 166 166 ASN N N 166 120.112 120.112 117.719 2.393 25153 6521 1 7 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.697 -0.114 25153 6522 1 7 . 1 1 166 166 ASN C C 166 178.440 178.440 176.881 1.559 25153 6523 1 7 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.650 0.770 25153 6524 1 7 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.837 -1.417 25153 6525 1 7 . 1 1 166 166 ASN H H 166 7.760 7.760 7.840 -0.080 25153 6526 1 7 . 1 1 167 167 GLU N N 167 121.370 121.370 122.084 -0.714 25153 6527 1 7 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.001 0.102 25153 6528 1 7 . 1 1 167 167 GLU C C 167 180.332 180.332 179.337 0.995 25153 6529 1 7 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.931 0.219 25153 6530 1 7 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.723 1.297 25153 6531 1 7 . 1 1 168 168 MET N N 168 118.532 118.532 117.184 1.348 25153 6532 1 7 . 1 1 168 168 MET HA H 168 4.015 4.015 4.233 -0.218 25153 6533 1 7 . 1 1 168 168 MET C C 168 176.600 176.600 178.195 -1.595 25153 6534 1 7 . 1 1 168 168 MET CA C 168 59.300 59.300 59.410 -0.110 25153 6535 1 7 . 1 1 168 168 MET CB C 168 33.400 33.400 32.725 0.675 25153 6536 1 7 . 1 1 168 168 MET H H 168 8.718 8.718 8.421 0.297 25153 6537 1 7 . 1 1 169 169 ALA N N 169 121.922 121.922 122.079 -0.157 25153 6538 1 7 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.203 -0.029 25153 6539 1 7 . 1 1 169 169 ALA C C 169 179.410 179.410 179.717 -0.307 25153 6540 1 7 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.688 -0.288 25153 6541 1 7 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.581 -0.171 25153 6542 1 7 . 1 1 169 169 ALA H H 169 7.448 7.448 7.764 -0.316 25153 6543 1 7 . 1 1 170 170 GLU N N 170 117.300 117.300 116.839 0.461 25153 6544 1 7 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.081 0.014 25153 6545 1 7 . 1 1 170 170 GLU C C 170 177.470 177.470 179.139 -1.669 25153 6546 1 7 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.842 -0.892 25153 6547 1 7 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.350 0.425 25153 6548 1 7 . 1 1 171 171 HIS N N 171 117.944 117.944 118.827 -0.883 25153 6549 1 7 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.320 0.180 25153 6550 1 7 . 1 1 171 171 HIS C C 171 175.120 175.120 176.607 -1.487 25153 6551 1 7 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.062 -1.862 25153 6552 1 7 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.193 0.407 25153 6553 1 7 . 1 1 171 171 HIS H H 171 7.788 7.788 7.800 -0.012 25153 6554 1 7 . 1 1 172 172 TYR N N 172 120.040 120.040 117.369 2.671 25153 6555 1 7 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.552 0.041 25153 6556 1 7 . 1 1 172 172 TYR C C 172 174.612 174.612 175.635 -1.023 25153 6557 1 7 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.175 -0.195 25153 6558 1 7 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.717 0.264 25153 6559 1 7 . 1 1 172 172 TYR H H 172 7.820 7.820 7.720 0.100 25153 6560 1 8 . 1 1 2 2 ASN N N 2 123.320 123.320 119.816 3.504 25153 6561 1 8 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.140 0.068 25153 6562 1 8 . 1 1 2 2 ASN C C 2 174.590 174.590 173.565 1.025 25153 6563 1 8 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.387 0.613 25153 6564 1 8 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.816 -0.845 25153 6565 1 8 . 1 1 2 2 ASN H H 2 9.428 9.428 8.320 1.108 25153 6566 1 8 . 1 1 3 3 MET N N 3 120.920 120.920 118.149 2.771 25153 6567 1 8 . 1 1 3 3 MET HA H 3 5.530 5.530 5.260 0.270 25153 6568 1 8 . 1 1 3 3 MET C C 3 174.400 174.400 174.920 -0.520 25153 6569 1 8 . 1 1 3 3 MET CA C 3 54.643 54.643 54.211 0.432 25153 6570 1 8 . 1 1 3 3 MET CB C 3 34.637 34.637 37.404 -2.767 25153 6571 1 8 . 1 1 3 3 MET H H 3 8.751 8.751 9.127 -0.376 25153 6572 1 8 . 1 1 4 4 GLY N N 4 115.542 115.542 109.164 6.378 25153 6573 1 8 . 1 1 4 4 GLY C C 4 170.413 170.413 172.149 -1.736 25153 6574 1 8 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.839 -0.737 25153 6575 1 8 . 1 1 4 4 GLY H H 4 8.927 8.927 8.875 0.052 25153 6576 1 8 . 1 1 5 5 LEU N N 5 131.030 131.030 128.218 2.812 25153 6577 1 8 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.236 1.166 25153 6578 1 8 . 1 1 5 5 LEU C C 5 175.952 175.952 174.593 1.359 25153 6579 1 8 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.456 0.994 25153 6580 1 8 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.600 2.992 25153 6581 1 8 . 1 1 5 5 LEU H H 5 8.928 8.928 8.675 0.253 25153 6582 1 8 . 1 1 6 6 PHE N N 6 125.790 125.790 126.434 -0.644 25153 6583 1 8 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.716 0.024 25153 6584 1 8 . 1 1 6 6 PHE C C 6 174.300 174.300 175.883 -1.583 25153 6585 1 8 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.461 -1.141 25153 6586 1 8 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.505 -0.275 25153 6587 1 8 . 1 1 6 6 PHE H H 6 9.237 9.237 9.503 -0.266 25153 6588 1 8 . 1 1 7 7 TYR N N 7 117.289 117.289 116.765 0.524 25153 6589 1 8 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.962 0.003 25153 6590 1 8 . 1 1 7 7 TYR C C 7 171.262 171.262 173.410 -2.148 25153 6591 1 8 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.442 -1.042 25153 6592 1 8 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.967 0.273 25153 6593 1 8 . 1 1 7 7 TYR H H 7 8.125 8.125 8.279 -0.154 25153 6594 1 8 . 1 1 8 8 GLY N N 8 107.420 107.420 105.637 1.783 25153 6595 1 8 . 1 1 8 8 GLY C C 8 172.000 172.000 172.290 -0.290 25153 6596 1 8 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.425 -0.481 25153 6597 1 8 . 1 1 8 8 GLY H H 8 7.031 7.031 8.459 -1.428 25153 6598 1 8 . 1 1 9 9 SER N N 9 118.150 118.150 116.055 2.095 25153 6599 1 8 . 1 1 9 9 SER HA H 9 5.200 5.200 5.132 0.068 25153 6600 1 8 . 1 1 9 9 SER C C 9 175.000 175.000 174.342 0.658 25153 6601 1 8 . 1 1 9 9 SER CA C 9 57.570 57.570 57.100 0.470 25153 6602 1 8 . 1 1 9 9 SER CB C 9 66.700 66.700 65.287 1.413 25153 6603 1 8 . 1 1 9 9 SER H H 9 9.604 9.604 8.567 1.037 25153 6604 1 8 . 1 1 10 10 SER N N 10 131.193 131.193 119.295 11.898 25153 6605 1 8 . 1 1 10 10 SER HA H 10 4.775 4.775 4.633 0.142 25153 6606 1 8 . 1 1 10 10 SER C C 10 175.730 175.730 176.206 -0.476 25153 6607 1 8 . 1 1 10 10 SER CA C 10 61.750 61.750 59.903 1.847 25153 6608 1 8 . 1 1 10 10 SER CB C 10 64.400 64.400 63.824 0.577 25153 6609 1 8 . 1 1 10 10 SER H H 10 11.636 11.636 9.077 2.559 25153 6610 1 8 . 1 1 11 11 THR N N 11 115.848 115.848 113.557 2.291 25153 6611 1 8 . 1 1 11 11 THR HA H 11 4.770 4.770 4.224 0.546 25153 6612 1 8 . 1 1 11 11 THR C C 11 173.700 173.700 174.299 -0.599 25153 6613 1 8 . 1 1 11 11 THR CA C 11 60.700 60.700 62.726 -2.026 25153 6614 1 8 . 1 1 11 11 THR CB C 11 67.430 67.430 68.332 -0.902 25153 6615 1 8 . 1 1 11 11 THR H H 11 9.550 9.550 8.310 1.240 25153 6616 1 8 . 1 1 12 12 CYS N N 12 109.780 109.780 117.380 -7.600 25153 6617 1 8 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.056 0.014 25153 6618 1 8 . 1 1 12 12 CYS C C 12 176.220 176.220 175.564 0.656 25153 6619 1 8 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.573 3.027 25153 6620 1 8 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.482 0.918 25153 6621 1 8 . 1 1 12 12 CYS H H 12 7.437 7.437 7.748 -0.311 25153 6622 1 8 . 1 1 13 13 TYR N N 13 127.830 127.830 119.877 7.953 25153 6623 1 8 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.218 -0.115 25153 6624 1 8 . 1 1 13 13 TYR C C 13 180.880 180.880 177.929 2.951 25153 6625 1 8 . 1 1 13 13 TYR CA C 13 65.100 65.100 60.411 4.689 25153 6626 1 8 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.278 -0.443 25153 6627 1 8 . 1 1 13 13 TYR H H 13 10.886 10.886 7.603 3.283 25153 6628 1 8 . 1 1 14 14 THR N N 14 124.428 124.428 113.919 10.509 25153 6629 1 8 . 1 1 14 14 THR HA H 14 4.160 4.160 4.189 -0.029 25153 6630 1 8 . 1 1 14 14 THR C C 14 177.760 177.760 176.328 1.432 25153 6631 1 8 . 1 1 14 14 THR CA C 14 67.823 67.823 67.038 0.785 25153 6632 1 8 . 1 1 14 14 THR CB C 14 68.040 68.040 68.565 -0.525 25153 6633 1 8 . 1 1 14 14 THR H H 14 11.405 11.405 8.161 3.244 25153 6634 1 8 . 1 1 15 15 GLU N N 15 123.050 123.050 122.862 0.188 25153 6635 1 8 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.108 -0.218 25153 6636 1 8 . 1 1 15 15 GLU C C 15 176.392 176.392 178.178 -1.786 25153 6637 1 8 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.376 -0.176 25153 6638 1 8 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.273 1.177 25153 6639 1 8 . 1 1 16 16 MET N N 16 120.173 120.173 118.591 1.582 25153 6640 1 8 . 1 1 16 16 MET HA H 16 4.050 4.050 4.298 -0.248 25153 6641 1 8 . 1 1 16 16 MET C C 16 179.940 179.940 178.683 1.257 25153 6642 1 8 . 1 1 16 16 MET CA C 16 59.240 59.240 59.223 0.017 25153 6643 1 8 . 1 1 16 16 MET CB C 16 32.970 32.970 32.901 0.069 25153 6644 1 8 . 1 1 16 16 MET H H 16 8.469 8.469 8.436 0.033 25153 6645 1 8 . 1 1 17 17 ALA N N 17 121.930 121.930 121.738 0.192 25153 6646 1 8 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.857 -0.021 25153 6647 1 8 . 1 1 17 17 ALA C C 17 177.900 177.900 178.690 -0.790 25153 6648 1 8 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.160 0.040 25153 6649 1 8 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.093 -0.093 25153 6650 1 8 . 1 1 17 17 ALA H H 17 7.880 7.880 8.456 -0.576 25153 6651 1 8 . 1 1 18 18 ALA N N 18 121.477 121.477 121.443 0.034 25153 6652 1 8 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.769 -0.032 25153 6653 1 8 . 1 1 18 18 ALA C C 18 179.380 179.380 179.405 -0.025 25153 6654 1 8 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.149 -0.149 25153 6655 1 8 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.861 0.969 25153 6656 1 8 . 1 1 18 18 ALA H H 18 7.374 7.374 7.983 -0.609 25153 6657 1 8 . 1 1 19 19 GLU N N 19 116.650 116.650 118.197 -1.547 25153 6658 1 8 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.831 -0.215 25153 6659 1 8 . 1 1 19 19 GLU C C 19 178.479 178.479 179.294 -0.815 25153 6660 1 8 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.562 0.168 25153 6661 1 8 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.383 -0.083 25153 6662 1 8 . 1 1 20 20 LYS N N 20 119.470 119.470 119.767 -0.297 25153 6663 1 8 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.014 0.036 25153 6664 1 8 . 1 1 20 20 LYS C C 20 179.116 179.116 179.065 0.051 25153 6665 1 8 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.460 0.370 25153 6666 1 8 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.441 0.409 25153 6667 1 8 . 1 1 21 21 ILE N N 21 121.030 121.030 120.718 0.312 25153 6668 1 8 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.686 -0.296 25153 6669 1 8 . 1 1 21 21 ILE C C 21 177.580 177.580 178.184 -0.604 25153 6670 1 8 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.772 0.048 25153 6671 1 8 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.899 0.449 25153 6672 1 8 . 1 1 21 21 ILE H H 21 8.100 8.100 8.598 -0.498 25153 6673 1 8 . 1 1 22 22 ARG N N 22 119.720 119.720 119.539 0.181 25153 6674 1 8 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.838 -0.283 25153 6675 1 8 . 1 1 22 22 ARG C C 22 177.320 177.320 178.128 -0.808 25153 6676 1 8 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.734 -0.014 25153 6677 1 8 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.718 -0.786 25153 6678 1 8 . 1 1 23 23 ASP N N 23 118.730 118.730 119.328 -0.598 25153 6679 1 8 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.412 -0.049 25153 6680 1 8 . 1 1 23 23 ASP C C 23 178.330 178.330 178.793 -0.463 25153 6681 1 8 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.343 -0.393 25153 6682 1 8 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.867 -0.627 25153 6683 1 8 . 1 1 24 24 ILE N N 24 121.090 121.090 119.521 1.569 25153 6684 1 8 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.773 0.023 25153 6685 1 8 . 1 1 24 24 ILE C C 24 178.250 178.250 177.913 0.337 25153 6686 1 8 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.835 -0.685 25153 6687 1 8 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.272 0.208 25153 6688 1 8 . 1 1 24 24 ILE H H 24 7.910 7.910 8.205 -0.295 25153 6689 1 8 . 1 1 25 25 ILE N N 25 121.406 121.406 117.329 4.077 25153 6690 1 8 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.864 -0.218 25153 6691 1 8 . 1 1 25 25 ILE C C 25 176.800 176.800 176.751 0.049 25153 6692 1 8 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.036 2.663 25153 6693 1 8 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.945 -0.755 25153 6694 1 8 . 1 1 25 25 ILE H H 25 8.476 8.476 8.117 0.359 25153 6695 1 8 . 1 1 26 26 GLY N N 26 108.900 108.900 105.072 3.828 25153 6696 1 8 . 1 1 26 26 GLY C C 26 173.710 173.710 172.247 1.463 25153 6697 1 8 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.691 -0.361 25153 6698 1 8 . 1 1 26 26 GLY H H 26 8.016 8.016 7.795 0.221 25153 6699 1 8 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.709 -0.371 25153 6700 1 8 . 1 1 27 27 PRO C C 27 177.200 177.200 177.131 0.069 25153 6701 1 8 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.516 1.170 25153 6702 1 8 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.030 0.170 25153 6703 1 8 . 1 1 28 28 GLU N N 28 116.295 116.295 118.256 -1.961 25153 6704 1 8 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.188 0.082 25153 6705 1 8 . 1 1 28 28 GLU C C 28 176.980 176.980 177.206 -0.226 25153 6706 1 8 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.449 -0.709 25153 6707 1 8 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.494 -0.824 25153 6708 1 8 . 1 1 29 29 LEU N N 29 120.250 120.250 111.754 8.496 25153 6709 1 8 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.659 -0.023 25153 6710 1 8 . 1 1 29 29 LEU C C 29 175.770 175.770 175.971 -0.201 25153 6711 1 8 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.472 0.328 25153 6712 1 8 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.676 1.424 25153 6713 1 8 . 1 1 29 29 LEU H H 29 7.940 7.940 7.538 0.402 25153 6714 1 8 . 1 1 30 30 VAL N N 30 118.693 118.693 121.254 -2.561 25153 6715 1 8 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.912 -0.264 25153 6716 1 8 . 1 1 30 30 VAL C C 30 174.347 174.347 176.031 -1.684 25153 6717 1 8 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.427 -0.559 25153 6718 1 8 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.398 2.182 25153 6719 1 8 . 1 1 30 30 VAL H H 30 7.434 7.434 8.018 -0.584 25153 6720 1 8 . 1 1 31 31 THR N N 31 123.800 123.800 122.096 1.704 25153 6721 1 8 . 1 1 31 31 THR HA H 31 4.362 4.362 4.529 -0.167 25153 6722 1 8 . 1 1 31 31 THR C C 31 172.964 172.964 173.405 -0.441 25153 6723 1 8 . 1 1 31 31 THR CA C 31 61.720 61.720 60.863 0.857 25153 6724 1 8 . 1 1 31 31 THR CB C 31 70.485 70.485 70.870 -0.385 25153 6725 1 8 . 1 1 31 31 THR H H 31 7.844 7.844 8.313 -0.469 25153 6726 1 8 . 1 1 32 32 LEU N N 32 127.800 127.800 127.038 0.762 25153 6727 1 8 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.642 0.042 25153 6728 1 8 . 1 1 32 32 LEU C C 32 176.600 176.600 176.519 0.081 25153 6729 1 8 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.227 -0.072 25153 6730 1 8 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.678 1.172 25153 6731 1 8 . 1 1 32 32 LEU H H 32 8.660 8.660 8.589 0.071 25153 6732 1 8 . 1 1 33 33 HIS N N 33 119.670 119.670 119.755 -0.085 25153 6733 1 8 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.811 -0.411 25153 6734 1 8 . 1 1 33 33 HIS C C 33 171.667 171.667 173.258 -1.591 25153 6735 1 8 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.995 0.205 25153 6736 1 8 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.559 0.641 25153 6737 1 8 . 1 1 33 33 HIS H H 33 9.060 9.060 8.785 0.275 25153 6738 1 8 . 1 1 34 34 ASN N N 34 124.068 124.068 123.220 0.848 25153 6739 1 8 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.020 -0.586 25153 6740 1 8 . 1 1 34 34 ASN C C 34 178.000 178.000 175.933 2.067 25153 6741 1 8 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.123 -0.694 25153 6742 1 8 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.081 -0.521 25153 6743 1 8 . 1 1 34 34 ASN H H 34 8.780 8.780 8.200 0.580 25153 6744 1 8 . 1 1 35 35 LEU N N 35 129.040 129.040 126.451 2.589 25153 6745 1 8 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.179 0.136 25153 6746 1 8 . 1 1 35 35 LEU C C 35 177.700 177.700 177.887 -0.187 25153 6747 1 8 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.355 0.125 25153 6748 1 8 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.842 1.458 25153 6749 1 8 . 1 1 35 35 LEU H H 35 8.821 8.821 8.383 0.438 25153 6750 1 8 . 1 1 36 36 LYS N N 36 121.043 121.043 116.884 4.159 25153 6751 1 8 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.986 -0.106 25153 6752 1 8 . 1 1 36 36 LYS C C 36 176.230 176.230 177.101 -0.871 25153 6753 1 8 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.521 0.899 25153 6754 1 8 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.501 0.769 25153 6755 1 8 . 1 1 37 37 ASP N N 37 114.965 114.965 118.089 -3.124 25153 6756 1 8 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.799 -0.022 25153 6757 1 8 . 1 1 37 37 ASP C C 37 175.440 175.440 175.992 -0.552 25153 6758 1 8 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.479 0.232 25153 6759 1 8 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.528 1.172 25153 6760 1 8 . 1 1 38 38 ASP N N 38 121.650 121.650 121.686 -0.036 25153 6761 1 8 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.867 0.003 25153 6762 1 8 . 1 1 38 38 ASP C C 38 174.852 174.852 176.005 -1.153 25153 6763 1 8 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.696 -1.616 25153 6764 1 8 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.273 -0.163 25153 6765 1 8 . 1 1 39 39 SER N N 39 115.207 115.207 118.123 -2.916 25153 6766 1 8 . 1 1 39 39 SER HA H 39 4.585 4.585 4.691 -0.106 25153 6767 1 8 . 1 1 39 39 SER C C 39 175.040 175.040 174.325 0.715 25153 6768 1 8 . 1 1 39 39 SER CA C 39 54.960 54.960 56.391 -1.431 25153 6769 1 8 . 1 1 39 39 SER CB C 39 64.720 64.720 63.579 1.141 25153 6770 1 8 . 1 1 39 39 SER H H 39 8.351 8.351 8.599 -0.248 25153 6771 1 8 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.296 -0.291 25153 6772 1 8 . 1 1 40 40 PRO C C 40 176.730 176.730 177.811 -1.081 25153 6773 1 8 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.967 -0.067 25153 6774 1 8 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.747 -0.347 25153 6775 1 8 . 1 1 41 41 LYS N N 41 121.150 121.150 119.992 1.158 25153 6776 1 8 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.994 -0.082 25153 6777 1 8 . 1 1 41 41 LYS C C 41 179.600 179.600 178.469 1.131 25153 6778 1 8 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.428 -1.228 25153 6779 1 8 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.709 0.291 25153 6780 1 8 . 1 1 42 42 LEU N N 42 118.103 118.103 116.522 1.581 25153 6781 1 8 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.230 -0.193 25153 6782 1 8 . 1 1 42 42 LEU C C 42 178.760 178.760 178.810 -0.050 25153 6783 1 8 . 1 1 42 42 LEU CA C 42 57.180 57.180 56.926 0.254 25153 6784 1 8 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.695 1.278 25153 6785 1 8 . 1 1 42 42 LEU H H 42 7.600 7.600 7.496 0.104 25153 6786 1 8 . 1 1 43 43 MET N N 43 118.917 118.917 118.447 0.470 25153 6787 1 8 . 1 1 43 43 MET HA H 43 3.750 3.750 4.274 -0.524 25153 6788 1 8 . 1 1 43 43 MET C C 43 177.680 177.680 176.804 0.876 25153 6789 1 8 . 1 1 43 43 MET CA C 43 59.730 59.730 58.027 1.703 25153 6790 1 8 . 1 1 43 43 MET CB C 43 32.700 32.700 32.035 0.665 25153 6791 1 8 . 1 1 43 43 MET H H 43 8.202 8.202 8.031 0.171 25153 6792 1 8 . 1 1 44 44 GLU N N 44 110.924 110.924 116.863 -5.939 25153 6793 1 8 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.247 -0.507 25153 6794 1 8 . 1 1 44 44 GLU C C 44 178.130 178.130 178.894 -0.764 25153 6795 1 8 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.422 0.978 25153 6796 1 8 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.933 -0.383 25153 6797 1 8 . 1 1 45 45 GLN N N 45 115.756 115.756 118.396 -2.640 25153 6798 1 8 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.015 0.168 25153 6799 1 8 . 1 1 45 45 GLN C C 45 175.414 175.414 177.145 -1.731 25153 6800 1 8 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.588 -1.408 25153 6801 1 8 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.035 -0.435 25153 6802 1 8 . 1 1 45 45 GLN H H 45 7.516 7.516 7.447 0.069 25153 6803 1 8 . 1 1 46 46 TYR N N 46 117.860 117.860 118.657 -0.797 25153 6804 1 8 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.430 0.233 25153 6805 1 8 . 1 1 46 46 TYR C C 46 175.500 175.500 176.819 -1.319 25153 6806 1 8 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.084 -0.598 25153 6807 1 8 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.188 3.282 25153 6808 1 8 . 1 1 46 46 TYR H H 46 6.996 6.996 7.199 -0.203 25153 6809 1 8 . 1 1 47 47 ASP N N 47 121.683 121.683 122.991 -1.308 25153 6810 1 8 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.801 -0.101 25153 6811 1 8 . 1 1 47 47 ASP C C 47 175.610 175.610 174.826 0.784 25153 6812 1 8 . 1 1 47 47 ASP CA C 47 56.700 56.700 55.287 1.413 25153 6813 1 8 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.918 1.082 25153 6814 1 8 . 1 1 48 48 VAL N N 48 118.628 118.628 117.299 1.329 25153 6815 1 8 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.824 0.210 25153 6816 1 8 . 1 1 48 48 VAL C C 48 174.190 174.190 174.138 0.052 25153 6817 1 8 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.112 -0.922 25153 6818 1 8 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.913 0.187 25153 6819 1 8 . 1 1 48 48 VAL H H 48 7.628 7.628 7.321 0.307 25153 6820 1 8 . 1 1 49 49 LEU N N 49 128.190 128.190 123.297 4.893 25153 6821 1 8 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.394 0.209 25153 6822 1 8 . 1 1 49 49 LEU C C 49 174.880 174.880 175.435 -0.555 25153 6823 1 8 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.834 -1.594 25153 6824 1 8 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.519 -1.179 25153 6825 1 8 . 1 1 49 49 LEU H H 49 9.407 9.407 8.909 0.498 25153 6826 1 8 . 1 1 50 50 ILE N N 50 124.550 124.550 120.710 3.840 25153 6827 1 8 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.188 0.512 25153 6828 1 8 . 1 1 50 50 ILE C C 50 175.300 175.300 174.586 0.714 25153 6829 1 8 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.859 -0.995 25153 6830 1 8 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.378 -1.128 25153 6831 1 8 . 1 1 50 50 ILE H H 50 9.238 9.238 9.236 0.002 25153 6832 1 8 . 1 1 51 51 LEU N N 51 127.460 127.460 128.312 -0.852 25153 6833 1 8 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.856 0.329 25153 6834 1 8 . 1 1 51 51 LEU C C 51 174.544 174.544 175.943 -1.399 25153 6835 1 8 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.618 -0.798 25153 6836 1 8 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.999 -2.362 25153 6837 1 8 . 1 1 51 51 LEU H H 51 9.228 9.228 9.151 0.077 25153 6838 1 8 . 1 1 52 52 GLY N N 52 107.760 107.760 111.565 -3.805 25153 6839 1 8 . 1 1 52 52 GLY C C 52 174.710 174.710 172.422 2.288 25153 6840 1 8 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.965 -0.095 25153 6841 1 8 . 1 1 52 52 GLY H H 52 8.860 8.860 9.112 -0.252 25153 6842 1 8 . 1 1 53 53 ILE N N 53 123.890 123.890 120.255 3.635 25153 6843 1 8 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.852 0.418 25153 6844 1 8 . 1 1 53 53 ILE C C 53 172.630 172.630 173.209 -0.579 25153 6845 1 8 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.690 -0.010 25153 6846 1 8 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.486 3.674 25153 6847 1 8 . 1 1 53 53 ILE H H 53 8.458 8.458 8.077 0.381 25153 6848 1 8 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.898 0.490 25153 6849 1 8 . 1 1 54 54 PRO C C 54 175.000 175.000 176.358 -1.358 25153 6850 1 8 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.838 -0.238 25153 6851 1 8 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.024 -0.724 25153 6852 1 8 . 1 1 55 55 THR N N 55 112.754 112.754 117.097 -4.343 25153 6853 1 8 . 1 1 55 55 THR HA H 55 4.452 4.452 4.871 -0.419 25153 6854 1 8 . 1 1 55 55 THR C C 55 172.480 172.480 174.060 -1.580 25153 6855 1 8 . 1 1 55 55 THR CA C 55 62.350 62.350 63.046 -0.696 25153 6856 1 8 . 1 1 55 55 THR CB C 55 70.230 70.230 70.171 0.059 25153 6857 1 8 . 1 1 55 55 THR H H 55 6.523 6.523 7.950 -1.427 25153 6858 1 8 . 1 1 56 56 TRP N N 56 130.044 130.044 127.316 2.728 25153 6859 1 8 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.561 -1.846 25153 6860 1 8 . 1 1 56 56 TRP C C 56 172.890 172.890 175.402 -2.512 25153 6861 1 8 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.285 0.365 25153 6862 1 8 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.798 1.202 25153 6863 1 8 . 1 1 56 56 TRP H H 56 8.450 8.450 8.762 -0.312 25153 6864 1 8 . 1 1 57 57 ASP N N 57 115.275 115.275 121.136 -5.861 25153 6865 1 8 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.845 0.507 25153 6866 1 8 . 1 1 57 57 ASP C C 57 173.660 173.660 174.718 -1.058 25153 6867 1 8 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.142 1.088 25153 6868 1 8 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.742 0.428 25153 6869 1 8 . 1 1 58 58 PHE N N 58 112.840 112.840 117.122 -4.282 25153 6870 1 8 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.441 -0.117 25153 6871 1 8 . 1 1 58 58 PHE C C 58 175.730 175.730 176.250 -0.520 25153 6872 1 8 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.512 1.311 25153 6873 1 8 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.983 -2.229 25153 6874 1 8 . 1 1 58 58 PHE H H 58 7.640 7.640 7.427 0.213 25153 6875 1 8 . 1 1 59 59 GLY N N 59 104.940 104.940 106.178 -1.238 25153 6876 1 8 . 1 1 59 59 GLY C C 59 173.750 173.750 174.622 -0.872 25153 6877 1 8 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.152 1.138 25153 6878 1 8 . 1 1 59 59 GLY H H 59 8.024 8.024 8.708 -0.684 25153 6879 1 8 . 1 1 60 60 GLU N N 60 120.045 120.045 119.501 0.544 25153 6880 1 8 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.470 -0.057 25153 6881 1 8 . 1 1 60 60 GLU C C 60 176.050 176.050 175.958 0.092 25153 6882 1 8 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.699 -1.079 25153 6883 1 8 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.071 -0.461 25153 6884 1 8 . 1 1 61 61 ILE N N 61 120.790 120.790 120.691 0.099 25153 6885 1 8 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.216 -0.749 25153 6886 1 8 . 1 1 61 61 ILE C C 61 175.130 175.130 176.141 -1.011 25153 6887 1 8 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.843 0.704 25153 6888 1 8 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.286 -0.437 25153 6889 1 8 . 1 1 61 61 ILE H H 61 8.200 8.200 8.426 -0.226 25153 6890 1 8 . 1 1 62 62 GLN N N 62 124.520 124.520 124.540 -0.020 25153 6891 1 8 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.200 -0.244 25153 6892 1 8 . 1 1 62 62 GLN C C 62 177.160 177.160 176.983 0.177 25153 6893 1 8 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.790 1.820 25153 6894 1 8 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.238 -2.588 25153 6895 1 8 . 1 1 62 62 GLN H H 62 5.667 5.667 8.885 -3.218 25153 6896 1 8 . 1 1 63 63 GLU N N 63 124.570 124.570 125.793 -1.223 25153 6897 1 8 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.211 -0.225 25153 6898 1 8 . 1 1 63 63 GLU C C 63 177.300 177.300 177.263 0.037 25153 6899 1 8 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.944 1.776 25153 6900 1 8 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.235 0.885 25153 6901 1 8 . 1 1 64 64 ASP N N 64 119.060 119.060 119.571 -0.511 25153 6902 1 8 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.424 0.196 25153 6903 1 8 . 1 1 64 64 ASP C C 64 179.180 179.180 177.304 1.876 25153 6904 1 8 . 1 1 64 64 ASP CA C 64 57.950 57.950 57.059 0.891 25153 6905 1 8 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.175 0.775 25153 6906 1 8 . 1 1 65 65 TRP N N 65 121.070 121.070 120.945 0.125 25153 6907 1 8 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.531 -0.191 25153 6908 1 8 . 1 1 65 65 TRP C C 65 178.970 178.970 178.109 0.861 25153 6909 1 8 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.675 0.145 25153 6910 1 8 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.573 -0.173 25153 6911 1 8 . 1 1 65 65 TRP H H 65 7.350 7.350 8.077 -0.727 25153 6912 1 8 . 1 1 66 66 GLU N N 66 120.900 120.900 119.067 1.833 25153 6913 1 8 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.894 -0.054 25153 6914 1 8 . 1 1 66 66 GLU C C 66 178.750 178.750 179.126 -0.376 25153 6915 1 8 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.502 0.498 25153 6916 1 8 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.287 -0.427 25153 6917 1 8 . 1 1 67 67 ALA N N 67 119.130 119.130 119.984 -0.854 25153 6918 1 8 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.243 0.010 25153 6919 1 8 . 1 1 67 67 ALA C C 67 179.410 179.410 179.081 0.329 25153 6920 1 8 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.744 -0.164 25153 6921 1 8 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.870 -0.060 25153 6922 1 8 . 1 1 67 67 ALA H H 67 7.640 7.640 8.167 -0.527 25153 6923 1 8 . 1 1 68 68 VAL N N 68 106.845 106.845 111.195 -4.350 25153 6924 1 8 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.504 0.306 25153 6925 1 8 . 1 1 68 68 VAL C C 68 176.750 176.750 177.234 -0.484 25153 6926 1 8 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.476 -2.866 25153 6927 1 8 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.674 -0.054 25153 6928 1 8 . 1 1 68 68 VAL H H 68 7.219 7.219 7.572 -0.353 25153 6929 1 8 . 1 1 69 69 TRP N N 69 127.630 127.630 124.251 3.379 25153 6930 1 8 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.294 -0.056 25153 6931 1 8 . 1 1 69 69 TRP C C 69 178.670 178.670 177.121 1.549 25153 6932 1 8 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.700 -1.480 25153 6933 1 8 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.870 1.760 25153 6934 1 8 . 1 1 69 69 TRP H H 69 7.832 7.832 8.610 -0.778 25153 6935 1 8 . 1 1 70 70 ASP N N 70 114.544 114.544 118.235 -3.691 25153 6936 1 8 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.464 0.058 25153 6937 1 8 . 1 1 70 70 ASP C C 70 178.670 178.670 179.013 -0.343 25153 6938 1 8 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.239 -1.238 25153 6939 1 8 . 1 1 70 70 ASP CB C 70 39.850 39.850 41.000 -1.150 25153 6940 1 8 . 1 1 71 71 GLN N N 71 120.040 120.040 119.545 0.495 25153 6941 1 8 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.110 0.074 25153 6942 1 8 . 1 1 71 71 GLN C C 71 178.910 178.910 178.829 0.081 25153 6943 1 8 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.408 -0.798 25153 6944 1 8 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.817 0.283 25153 6945 1 8 . 1 1 71 71 GLN H H 71 7.995 7.995 7.718 0.277 25153 6946 1 8 . 1 1 72 72 LEU N N 72 117.400 117.400 118.108 -0.708 25153 6947 1 8 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.981 -0.168 25153 6948 1 8 . 1 1 72 72 LEU C C 72 178.650 178.650 178.095 0.555 25153 6949 1 8 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.048 0.152 25153 6950 1 8 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.420 -0.010 25153 6951 1 8 . 1 1 72 72 LEU H H 72 7.450 7.450 7.768 -0.318 25153 6952 1 8 . 1 1 73 73 ASP N N 73 115.750 115.750 117.661 -1.911 25153 6953 1 8 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.418 -0.250 25153 6954 1 8 . 1 1 73 73 ASP C C 73 177.560 177.560 177.484 0.076 25153 6955 1 8 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.425 0.975 25153 6956 1 8 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.488 -1.388 25153 6957 1 8 . 1 1 74 74 ASP N N 74 117.223 117.223 119.859 -2.636 25153 6958 1 8 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.574 0.129 25153 6959 1 8 . 1 1 74 74 ASP C C 74 176.388 176.388 177.165 -0.777 25153 6960 1 8 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.205 -0.705 25153 6961 1 8 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.561 0.139 25153 6962 1 8 . 1 1 75 75 LEU N N 75 118.316 118.316 119.614 -1.298 25153 6963 1 8 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.380 -0.095 25153 6964 1 8 . 1 1 75 75 LEU C C 75 176.820 176.820 175.911 0.909 25153 6965 1 8 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.568 -0.168 25153 6966 1 8 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.401 0.879 25153 6967 1 8 . 1 1 75 75 LEU H H 75 6.960 6.960 7.410 -0.450 25153 6968 1 8 . 1 1 76 76 ASN N N 76 123.045 123.045 118.094 4.951 25153 6969 1 8 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.078 -0.188 25153 6970 1 8 . 1 1 76 76 ASN C C 76 174.950 174.950 174.883 0.067 25153 6971 1 8 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.472 -0.422 25153 6972 1 8 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.899 -1.399 25153 6973 1 8 . 1 1 76 76 ASN H H 76 9.890 9.890 8.722 1.168 25153 6974 1 8 . 1 1 77 77 LEU N N 77 123.494 123.494 123.114 0.380 25153 6975 1 8 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.520 -0.150 25153 6976 1 8 . 1 1 77 77 LEU C C 77 175.040 175.040 176.101 -1.061 25153 6977 1 8 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.969 -1.719 25153 6978 1 8 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.601 0.299 25153 6979 1 8 . 1 1 77 77 LEU H H 77 8.730 8.730 8.134 0.596 25153 6980 1 8 . 1 1 78 78 GLU N N 78 120.870 120.870 121.238 -0.368 25153 6981 1 8 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.534 -0.634 25153 6982 1 8 . 1 1 78 78 GLU C C 78 178.660 178.660 177.921 0.739 25153 6983 1 8 . 1 1 78 78 GLU CA C 78 58.760 58.760 56.922 1.838 25153 6984 1 8 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.545 0.855 25153 6985 1 8 . 1 1 79 79 GLY N N 79 113.240 113.240 113.897 -0.657 25153 6986 1 8 . 1 1 79 79 GLY C C 79 174.460 174.460 173.576 0.884 25153 6987 1 8 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.503 -0.073 25153 6988 1 8 . 1 1 79 79 GLY H H 79 8.474 8.474 8.720 -0.246 25153 6989 1 8 . 1 1 80 80 LYS N N 80 120.295 120.295 117.958 2.337 25153 6990 1 8 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.750 -0.392 25153 6991 1 8 . 1 1 80 80 LYS C C 80 175.360 175.360 175.276 0.084 25153 6992 1 8 . 1 1 80 80 LYS CA C 80 56.970 56.970 54.252 2.718 25153 6993 1 8 . 1 1 80 80 LYS CB C 80 33.200 33.200 35.322 -2.122 25153 6994 1 8 . 1 1 81 81 ILE N N 81 122.400 122.400 121.259 1.141 25153 6995 1 8 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.720 0.073 25153 6996 1 8 . 1 1 81 81 ILE C C 81 174.760 174.760 175.448 -0.688 25153 6997 1 8 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.411 -1.581 25153 6998 1 8 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.027 -0.327 25153 6999 1 8 . 1 1 81 81 ILE H H 81 7.400 7.400 7.882 -0.482 25153 7000 1 8 . 1 1 82 82 VAL N N 82 127.840 127.840 125.431 2.409 25153 7001 1 8 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.997 0.265 25153 7002 1 8 . 1 1 82 82 VAL C C 82 172.724 172.724 174.314 -1.590 25153 7003 1 8 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.650 -0.240 25153 7004 1 8 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.715 -0.315 25153 7005 1 8 . 1 1 82 82 VAL H H 82 8.790 8.790 8.840 -0.050 25153 7006 1 8 . 1 1 83 83 ALA N N 83 131.347 131.347 129.339 2.008 25153 7007 1 8 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.438 -0.056 25153 7008 1 8 . 1 1 83 83 ALA C C 83 175.750 175.750 176.291 -0.541 25153 7009 1 8 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.051 -0.181 25153 7010 1 8 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.257 2.193 25153 7011 1 8 . 1 1 83 83 ALA H H 83 9.300 9.300 9.003 0.297 25153 7012 1 8 . 1 1 84 84 LEU N N 84 124.200 124.200 126.320 -2.120 25153 7013 1 8 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.698 -0.178 25153 7014 1 8 . 1 1 84 84 LEU C C 84 175.760 175.760 176.797 -1.037 25153 7015 1 8 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.803 -0.303 25153 7016 1 8 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.563 1.337 25153 7017 1 8 . 1 1 84 84 LEU H H 84 10.287 10.287 9.073 1.214 25153 7018 1 8 . 1 1 85 85 TYR N N 85 115.912 115.912 118.947 -3.035 25153 7019 1 8 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.326 -0.366 25153 7020 1 8 . 1 1 85 85 TYR C C 85 172.372 172.372 173.785 -1.413 25153 7021 1 8 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.167 0.933 25153 7022 1 8 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.576 1.454 25153 7023 1 8 . 1 1 85 85 TYR H H 85 9.257 9.257 8.877 0.380 25153 7024 1 8 . 1 1 86 86 GLY N N 86 107.800 107.800 105.835 1.965 25153 7025 1 8 . 1 1 86 86 GLY C C 86 170.330 170.330 171.458 -1.128 25153 7026 1 8 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.823 -0.453 25153 7027 1 8 . 1 1 86 86 GLY H H 86 9.027 9.027 8.656 0.371 25153 7028 1 8 . 1 1 87 87 LEU N N 87 123.458 123.458 118.441 5.017 25153 7029 1 8 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.186 0.279 25153 7030 1 8 . 1 1 87 87 LEU C C 87 178.100 178.100 175.818 2.282 25153 7031 1 8 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.999 0.591 25153 7032 1 8 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.566 -0.226 25153 7033 1 8 . 1 1 87 87 LEU H H 87 6.580 6.580 7.713 -1.133 25153 7034 1 8 . 1 1 88 88 GLY N N 88 108.966 108.966 107.578 1.388 25153 7035 1 8 . 1 1 88 88 GLY C C 88 172.820 172.820 171.753 1.067 25153 7036 1 8 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.088 1.572 25153 7037 1 8 . 1 1 88 88 GLY H H 88 8.070 8.070 8.129 -0.059 25153 7038 1 8 . 1 1 89 89 ASP N N 89 121.150 121.150 116.787 4.363 25153 7039 1 8 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.133 0.113 25153 7040 1 8 . 1 1 89 89 ASP C C 89 176.220 176.220 176.233 -0.013 25153 7041 1 8 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.049 -0.579 25153 7042 1 8 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.081 -1.601 25153 7043 1 8 . 1 1 90 90 GLN N N 90 123.970 123.970 122.911 1.059 25153 7044 1 8 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.319 -0.831 25153 7045 1 8 . 1 1 90 90 GLN C C 90 173.646 173.646 176.510 -2.864 25153 7046 1 8 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.500 0.810 25153 7047 1 8 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.824 -0.614 25153 7048 1 8 . 1 1 90 90 GLN H H 90 8.623 8.623 8.833 -0.210 25153 7049 1 8 . 1 1 91 91 LEU N N 91 118.017 118.017 120.511 -2.494 25153 7050 1 8 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.074 0.301 25153 7051 1 8 . 1 1 91 91 LEU C C 91 180.160 180.160 178.575 1.585 25153 7052 1 8 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.570 -0.510 25153 7053 1 8 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.977 -0.427 25153 7054 1 8 . 1 1 91 91 LEU H H 91 7.046 7.046 8.906 -1.860 25153 7055 1 8 . 1 1 92 92 GLY N N 92 110.028 110.028 103.720 6.308 25153 7056 1 8 . 1 1 92 92 GLY C C 92 174.912 174.912 174.519 0.393 25153 7057 1 8 . 1 1 92 92 GLY CA C 92 46.180 46.180 44.996 1.183 25153 7058 1 8 . 1 1 92 92 GLY H H 92 9.238 9.238 8.688 0.550 25153 7059 1 8 . 1 1 93 93 TYR N N 93 115.910 115.910 119.171 -3.261 25153 7060 1 8 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.377 -0.368 25153 7061 1 8 . 1 1 93 93 TYR C C 93 176.850 176.850 176.985 -0.135 25153 7062 1 8 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.336 0.394 25153 7063 1 8 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.881 -0.751 25153 7064 1 8 . 1 1 93 93 TYR H H 93 6.962 6.962 7.660 -0.698 25153 7065 1 8 . 1 1 94 94 GLY N N 94 111.630 111.630 110.459 1.171 25153 7066 1 8 . 1 1 94 94 GLY C C 94 177.777 177.777 175.861 1.916 25153 7067 1 8 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.404 2.627 25153 7068 1 8 . 1 1 94 94 GLY H H 94 7.835 7.835 8.138 -0.303 25153 7069 1 8 . 1 1 95 95 GLU N N 95 122.450 122.450 120.465 1.985 25153 7070 1 8 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.906 0.012 25153 7071 1 8 . 1 1 95 95 GLU C C 95 175.300 175.300 176.787 -1.487 25153 7072 1 8 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.483 -0.383 25153 7073 1 8 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.246 -0.735 25153 7074 1 8 . 1 1 96 96 TRP N N 96 118.790 118.790 117.047 1.743 25153 7075 1 8 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.923 0.521 25153 7076 1 8 . 1 1 96 96 TRP C C 96 179.280 179.280 176.015 3.265 25153 7077 1 8 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.767 1.248 25153 7078 1 8 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.890 0.131 25153 7079 1 8 . 1 1 96 96 TRP H H 96 8.070 8.070 8.161 -0.091 25153 7080 1 8 . 1 1 97 97 PHE N N 97 128.067 128.067 123.649 4.418 25153 7081 1 8 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.332 0.973 25153 7082 1 8 . 1 1 97 97 PHE C C 97 173.227 173.227 176.005 -2.778 25153 7083 1 8 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.720 -3.000 25153 7084 1 8 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.435 0.505 25153 7085 1 8 . 1 1 97 97 PHE H H 97 7.165 7.165 8.363 -1.198 25153 7086 1 8 . 1 1 98 98 LEU N N 98 114.306 114.306 124.470 -10.164 25153 7087 1 8 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.675 -0.185 25153 7088 1 8 . 1 1 98 98 LEU C C 98 179.365 179.365 177.400 1.965 25153 7089 1 8 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.606 -0.146 25153 7090 1 8 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.782 -0.552 25153 7091 1 8 . 1 1 98 98 LEU H H 98 7.453 7.453 8.680 -1.227 25153 7092 1 8 . 1 1 99 99 ASP N N 99 122.354 122.354 120.673 1.681 25153 7093 1 8 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.311 -0.378 25153 7094 1 8 . 1 1 99 99 ASP C C 99 178.800 178.800 177.170 1.630 25153 7095 1 8 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.868 1.312 25153 7096 1 8 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.456 -1.026 25153 7097 1 8 . 1 1 100 100 ALA N N 100 118.568 118.568 122.030 -3.462 25153 7098 1 8 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.058 -0.218 25153 7099 1 8 . 1 1 100 100 ALA C C 100 178.500 178.500 179.335 -0.835 25153 7100 1 8 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.136 -0.220 25153 7101 1 8 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.291 1.369 25153 7102 1 8 . 1 1 100 100 ALA H H 100 8.682 8.682 7.797 0.885 25153 7103 1 8 . 1 1 101 101 LEU N N 101 118.815 118.815 120.537 -1.722 25153 7104 1 8 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.961 -0.281 25153 7105 1 8 . 1 1 101 101 LEU C C 101 178.930 178.930 178.918 0.012 25153 7106 1 8 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.777 -0.077 25153 7107 1 8 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.544 0.856 25153 7108 1 8 . 1 1 101 101 LEU H H 101 6.637 6.637 7.251 -0.614 25153 7109 1 8 . 1 1 102 102 GLY N N 102 103.700 103.700 106.410 -2.710 25153 7110 1 8 . 1 1 102 102 GLY C C 102 175.530 175.530 176.127 -0.597 25153 7111 1 8 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.307 0.693 25153 7112 1 8 . 1 1 102 102 GLY H H 102 7.330 7.330 8.062 -0.732 25153 7113 1 8 . 1 1 103 103 MET N N 103 120.330 120.330 121.669 -1.339 25153 7114 1 8 . 1 1 103 103 MET HA H 103 4.254 4.254 4.241 0.013 25153 7115 1 8 . 1 1 103 103 MET C C 103 179.688 179.688 178.634 1.054 25153 7116 1 8 . 1 1 103 103 MET CA C 103 59.615 59.615 59.615 -0.000 25153 7117 1 8 . 1 1 103 103 MET CB C 103 33.290 33.290 32.606 0.684 25153 7118 1 8 . 1 1 103 103 MET H H 103 8.407 8.407 7.982 0.425 25153 7119 1 8 . 1 1 104 104 LEU N N 104 123.450 123.450 119.949 3.501 25153 7120 1 8 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.705 0.491 25153 7121 1 8 . 1 1 104 104 LEU C C 104 177.620 177.620 178.829 -1.209 25153 7122 1 8 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.958 0.012 25153 7123 1 8 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.295 0.004 25153 7124 1 8 . 1 1 104 104 LEU H H 104 8.330 8.330 8.667 -0.337 25153 7125 1 8 . 1 1 105 105 HIS N N 105 119.040 119.040 119.248 -0.208 25153 7126 1 8 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.118 -0.241 25153 7127 1 8 . 1 1 105 105 HIS C C 105 177.100 177.100 177.058 0.042 25153 7128 1 8 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.630 0.341 25153 7129 1 8 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.730 -1.137 25153 7130 1 8 . 1 1 105 105 HIS H H 105 8.050 8.050 8.505 -0.455 25153 7131 1 8 . 1 1 106 106 ASP N N 106 119.950 119.950 119.207 0.743 25153 7132 1 8 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.353 -0.023 25153 7133 1 8 . 1 1 106 106 ASP C C 106 179.300 179.300 178.407 0.893 25153 7134 1 8 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.303 0.507 25153 7135 1 8 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.154 -0.754 25153 7136 1 8 . 1 1 107 107 LYS N N 107 122.060 122.060 120.020 2.040 25153 7137 1 8 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.058 0.075 25153 7138 1 8 . 1 1 107 107 LYS C C 107 178.100 178.100 179.449 -1.349 25153 7139 1 8 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.697 -0.497 25153 7140 1 8 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.150 0.210 25153 7141 1 8 . 1 1 108 108 LEU N N 108 115.610 115.610 118.035 -2.425 25153 7142 1 8 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.123 -0.055 25153 7143 1 8 . 1 1 108 108 LEU C C 108 178.866 178.866 178.291 0.575 25153 7144 1 8 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.959 -1.005 25153 7145 1 8 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.556 0.604 25153 7146 1 8 . 1 1 108 108 LEU H H 108 7.828 7.828 8.495 -0.667 25153 7147 1 8 . 1 1 109 109 SER N N 109 116.362 116.362 115.246 1.116 25153 7148 1 8 . 1 1 109 109 SER HA H 109 4.299 4.299 4.251 0.048 25153 7149 1 8 . 1 1 109 109 SER C C 109 175.660 175.660 176.868 -1.208 25153 7150 1 8 . 1 1 109 109 SER CA C 109 62.350 62.350 61.313 1.037 25153 7151 1 8 . 1 1 109 109 SER CB C 109 62.815 62.815 62.954 -0.139 25153 7152 1 8 . 1 1 109 109 SER H H 109 8.278 8.278 8.614 -0.336 25153 7153 1 8 . 1 1 110 110 THR N N 110 110.230 110.230 115.712 -5.482 25153 7154 1 8 . 1 1 110 110 THR HA H 110 4.615 4.615 4.206 0.409 25153 7155 1 8 . 1 1 110 110 THR C C 110 175.990 175.990 175.427 0.563 25153 7156 1 8 . 1 1 110 110 THR CA C 110 62.090 62.090 64.410 -2.320 25153 7157 1 8 . 1 1 110 110 THR CB C 110 68.800 68.800 68.550 0.250 25153 7158 1 8 . 1 1 110 110 THR H H 110 7.211 7.211 7.834 -0.623 25153 7159 1 8 . 1 1 111 111 LYS N N 111 119.900 119.900 119.418 0.482 25153 7160 1 8 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.456 0.056 25153 7161 1 8 . 1 1 111 111 LYS C C 111 176.916 176.916 176.621 0.295 25153 7162 1 8 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.777 -0.123 25153 7163 1 8 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.759 -0.916 25153 7164 1 8 . 1 1 112 112 GLY N N 112 107.910 107.910 108.004 -0.094 25153 7165 1 8 . 1 1 112 112 GLY C C 112 176.250 176.250 174.140 2.110 25153 7166 1 8 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.602 1.438 25153 7167 1 8 . 1 1 112 112 GLY H H 112 8.366 8.366 7.559 0.807 25153 7168 1 8 . 1 1 113 113 VAL N N 113 113.530 113.530 114.507 -0.977 25153 7169 1 8 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.332 0.142 25153 7170 1 8 . 1 1 113 113 VAL C C 113 174.630 174.630 174.735 -0.105 25153 7171 1 8 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.781 -1.331 25153 7172 1 8 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.714 -0.164 25153 7173 1 8 . 1 1 113 113 VAL H H 113 6.903 6.903 6.958 -0.055 25153 7174 1 8 . 1 1 114 114 LYS N N 114 123.020 123.020 119.761 3.259 25153 7175 1 8 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.508 -0.003 25153 7176 1 8 . 1 1 114 114 LYS C C 114 175.000 175.000 174.663 0.337 25153 7177 1 8 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.655 -0.455 25153 7178 1 8 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.444 -1.104 25153 7179 1 8 . 1 1 115 115 PHE N N 115 123.290 123.290 120.284 3.006 25153 7180 1 8 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.758 -0.045 25153 7181 1 8 . 1 1 115 115 PHE C C 115 177.605 177.605 176.115 1.490 25153 7182 1 8 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.834 1.776 25153 7183 1 8 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.971 -0.971 25153 7184 1 8 . 1 1 115 115 PHE H H 115 8.494 8.494 8.449 0.045 25153 7185 1 8 . 1 1 116 116 VAL N N 116 115.790 115.790 113.045 2.745 25153 7186 1 8 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.538 -0.046 25153 7187 1 8 . 1 1 116 116 VAL C C 116 175.414 175.414 176.055 -0.641 25153 7188 1 8 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.456 -0.470 25153 7189 1 8 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.627 -0.527 25153 7190 1 8 . 1 1 116 116 VAL H H 116 8.889 8.889 8.591 0.298 25153 7191 1 8 . 1 1 117 117 GLY N N 117 108.300 108.300 107.208 1.092 25153 7192 1 8 . 1 1 117 117 GLY C C 117 176.180 176.180 174.876 1.304 25153 7193 1 8 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.415 2.385 25153 7194 1 8 . 1 1 117 117 GLY H H 117 9.810 9.810 8.687 1.123 25153 7195 1 8 . 1 1 118 118 TYR N N 118 120.050 120.050 119.871 0.179 25153 7196 1 8 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.828 0.126 25153 7197 1 8 . 1 1 118 118 TYR C C 118 177.450 177.450 176.177 1.273 25153 7198 1 8 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.463 -1.223 25153 7199 1 8 . 1 1 118 118 TYR CB C 118 36.110 36.110 38.807 -2.697 25153 7200 1 8 . 1 1 118 118 TYR H H 118 8.592 8.592 7.461 1.131 25153 7201 1 8 . 1 1 119 119 TRP N N 119 125.500 125.500 123.168 2.332 25153 7202 1 8 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.145 0.883 25153 7203 1 8 . 1 1 119 119 TRP C C 119 173.090 173.090 174.399 -1.309 25153 7204 1 8 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.372 -0.472 25153 7205 1 8 . 1 1 119 119 TRP CB C 119 36.250 36.250 32.839 3.412 25153 7206 1 8 . 1 1 119 119 TRP H H 119 7.926 7.926 8.247 -0.321 25153 7207 1 8 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.734 0.076 25153 7208 1 8 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.932 0.748 25153 7209 1 8 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.224 0.026 25153 7210 1 8 . 1 1 121 121 THR N N 121 109.114 109.114 112.501 -3.387 25153 7211 1 8 . 1 1 121 121 THR HA H 121 4.142 4.142 3.461 0.681 25153 7212 1 8 . 1 1 121 121 THR C C 121 176.300 176.300 175.117 1.183 25153 7213 1 8 . 1 1 121 121 THR CA C 121 61.230 61.230 62.514 -1.284 25153 7214 1 8 . 1 1 121 121 THR CB C 121 69.890 69.890 68.450 1.440 25153 7215 1 8 . 1 1 121 121 THR H H 121 7.356 7.356 8.350 -0.994 25153 7216 1 8 . 1 1 122 122 GLU N N 122 123.980 123.980 121.785 2.195 25153 7217 1 8 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.012 0.226 25153 7218 1 8 . 1 1 122 122 GLU C C 122 177.830 177.830 177.709 0.121 25153 7219 1 8 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.632 0.598 25153 7220 1 8 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.821 -0.051 25153 7221 1 8 . 1 1 123 123 GLY N N 123 114.570 114.570 112.553 2.017 25153 7222 1 8 . 1 1 123 123 GLY C C 123 173.700 173.700 174.251 -0.551 25153 7223 1 8 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.420 -0.020 25153 7224 1 8 . 1 1 123 123 GLY H H 123 9.181 9.181 8.844 0.337 25153 7225 1 8 . 1 1 124 124 TYR N N 124 118.923 118.923 120.391 -1.468 25153 7226 1 8 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.607 0.703 25153 7227 1 8 . 1 1 124 124 TYR C C 124 175.680 175.680 175.466 0.214 25153 7228 1 8 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.912 -2.442 25153 7229 1 8 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.121 0.879 25153 7230 1 8 . 1 1 124 124 TYR H H 124 7.877 7.877 7.678 0.199 25153 7231 1 8 . 1 1 125 125 GLU N N 125 124.890 124.890 121.010 3.880 25153 7232 1 8 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.593 0.107 25153 7233 1 8 . 1 1 125 125 GLU C C 125 172.880 172.880 175.241 -2.361 25153 7234 1 8 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.889 -0.459 25153 7235 1 8 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.798 -0.378 25153 7236 1 8 . 1 1 126 126 PHE N N 126 119.166 119.166 120.621 -1.455 25153 7237 1 8 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.440 0.369 25153 7238 1 8 . 1 1 126 126 PHE C C 126 173.750 173.750 174.592 -0.842 25153 7239 1 8 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.234 -1.444 25153 7240 1 8 . 1 1 126 126 PHE CB C 126 40.050 40.050 38.894 1.156 25153 7241 1 8 . 1 1 126 126 PHE H H 126 7.716 7.716 7.965 -0.249 25153 7242 1 8 . 1 1 127 127 THR N N 127 106.800 106.800 114.884 -8.084 25153 7243 1 8 . 1 1 127 127 THR HA H 127 4.400 4.400 3.316 1.084 25153 7244 1 8 . 1 1 127 127 THR C C 127 175.300 175.300 174.032 1.268 25153 7245 1 8 . 1 1 127 127 THR CA C 127 61.100 61.100 63.137 -2.037 25153 7246 1 8 . 1 1 127 127 THR CB C 127 70.600 70.600 68.015 2.585 25153 7247 1 8 . 1 1 127 127 THR H H 127 7.220 7.220 6.469 0.751 25153 7248 1 8 . 1 1 128 128 SER N N 128 118.360 118.360 115.460 2.900 25153 7249 1 8 . 1 1 128 128 SER HA H 128 4.680 4.680 4.530 0.150 25153 7250 1 8 . 1 1 128 128 SER C C 128 175.720 175.720 173.943 1.777 25153 7251 1 8 . 1 1 128 128 SER CA C 128 56.250 56.250 56.872 -0.622 25153 7252 1 8 . 1 1 128 128 SER CB C 128 65.635 65.635 64.383 1.252 25153 7253 1 8 . 1 1 128 128 SER H H 128 7.411 7.411 8.150 -0.739 25153 7254 1 8 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.563 0.212 25153 7255 1 8 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.115 -1.615 25153 7256 1 8 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.300 0.100 25153 7257 1 8 . 1 1 130 130 LYS N N 130 122.014 122.014 119.239 2.775 25153 7258 1 8 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.434 -0.201 25153 7259 1 8 . 1 1 130 130 LYS CA C 130 61.700 61.700 59.472 2.228 25153 7260 1 8 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.743 -0.173 25153 7261 1 8 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.497 0.021 25153 7262 1 8 . 1 1 131 131 PRO C C 131 174.000 174.000 175.022 -1.022 25153 7263 1 8 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.851 1.849 25153 7264 1 8 . 1 1 131 131 PRO CB C 131 31.200 31.200 29.979 1.221 25153 7265 1 8 . 1 1 132 132 VAL N N 132 113.260 113.260 116.420 -3.160 25153 7266 1 8 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.884 0.316 25153 7267 1 8 . 1 1 132 132 VAL C C 132 175.210 175.210 174.871 0.339 25153 7268 1 8 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.219 -0.599 25153 7269 1 8 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.038 -1.058 25153 7270 1 8 . 1 1 132 132 VAL H H 132 6.697 6.697 7.556 -0.859 25153 7271 1 8 . 1 1 133 133 ILE N N 133 119.940 119.940 118.227 1.713 25153 7272 1 8 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.506 -0.126 25153 7273 1 8 . 1 1 133 133 ILE C C 133 175.440 175.440 175.239 0.201 25153 7274 1 8 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.001 1.450 25153 7275 1 8 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.035 2.065 25153 7276 1 8 . 1 1 133 133 ILE H H 133 8.756 8.756 8.647 0.109 25153 7277 1 8 . 1 1 134 134 ALA N N 134 122.632 122.632 123.926 -1.294 25153 7278 1 8 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.924 0.036 25153 7279 1 8 . 1 1 134 134 ALA C C 134 178.312 178.312 177.238 1.074 25153 7280 1 8 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.608 -1.528 25153 7281 1 8 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.245 -0.409 25153 7282 1 8 . 1 1 134 134 ALA H H 134 8.523 8.523 8.504 0.019 25153 7283 1 8 . 1 1 135 135 ASP N N 135 117.366 117.366 122.712 -5.346 25153 7284 1 8 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.668 -0.416 25153 7285 1 8 . 1 1 135 135 ASP C C 135 176.387 176.387 176.655 -0.268 25153 7286 1 8 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.364 1.846 25153 7287 1 8 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.245 -1.545 25153 7288 1 8 . 1 1 136 136 GLY N N 136 104.310 104.310 108.057 -3.747 25153 7289 1 8 . 1 1 136 136 GLY C C 136 174.922 174.922 174.922 0.000 25153 7290 1 8 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.381 -0.281 25153 7291 1 8 . 1 1 136 136 GLY H H 136 7.610 7.610 8.323 -0.713 25153 7292 1 8 . 1 1 137 137 GLN N N 137 118.784 118.784 117.705 1.079 25153 7293 1 8 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.428 -0.373 25153 7294 1 8 . 1 1 137 137 GLN C C 137 176.390 176.390 175.450 0.940 25153 7295 1 8 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.809 1.831 25153 7296 1 8 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.228 0.002 25153 7297 1 8 . 1 1 137 137 GLN H H 137 7.870 7.870 7.883 -0.013 25153 7298 1 8 . 1 1 138 138 LEU N N 138 118.040 118.040 115.846 2.194 25153 7299 1 8 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.987 0.000 25153 7300 1 8 . 1 1 138 138 LEU C C 138 175.913 175.913 175.046 0.867 25153 7301 1 8 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.209 0.391 25153 7302 1 8 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.962 1.438 25153 7303 1 8 . 1 1 138 138 LEU H H 138 7.356 7.356 7.189 0.167 25153 7304 1 8 . 1 1 139 139 PHE N N 139 119.060 119.060 119.458 -0.398 25153 7305 1 8 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.936 0.374 25153 7306 1 8 . 1 1 139 139 PHE C C 139 178.780 178.780 177.485 1.295 25153 7307 1 8 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.908 -0.058 25153 7308 1 8 . 1 1 139 139 PHE CB C 139 43.460 43.460 40.022 3.438 25153 7309 1 8 . 1 1 139 139 PHE H H 139 10.094 10.094 8.903 1.191 25153 7310 1 8 . 1 1 140 140 VAL N N 140 109.690 109.690 114.656 -4.966 25153 7311 1 8 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.371 0.110 25153 7312 1 8 . 1 1 140 140 VAL C C 140 172.790 172.790 175.439 -2.649 25153 7313 1 8 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.356 -1.356 25153 7314 1 8 . 1 1 140 140 VAL CB C 140 30.550 30.550 30.878 -0.328 25153 7315 1 8 . 1 1 140 140 VAL H H 140 7.470 7.470 8.124 -0.654 25153 7316 1 8 . 1 1 141 141 GLY N N 141 107.060 107.060 105.372 1.688 25153 7317 1 8 . 1 1 141 141 GLY C C 141 171.513 171.513 172.506 -0.993 25153 7318 1 8 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.584 0.846 25153 7319 1 8 . 1 1 141 141 GLY H H 141 7.137 7.137 7.321 -0.184 25153 7320 1 8 . 1 1 142 142 LEU N N 142 117.863 117.863 120.298 -2.435 25153 7321 1 8 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.238 -1.263 25153 7322 1 8 . 1 1 142 142 LEU C C 142 173.640 173.640 175.154 -1.514 25153 7323 1 8 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.645 1.275 25153 7324 1 8 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.401 -4.851 25153 7325 1 8 . 1 1 142 142 LEU H H 142 7.517 7.517 7.705 -0.188 25153 7326 1 8 . 1 1 143 143 ALA N N 143 126.990 126.990 129.425 -2.435 25153 7327 1 8 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.326 -0.049 25153 7328 1 8 . 1 1 143 143 ALA C C 143 175.730 175.730 175.805 -0.075 25153 7329 1 8 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.324 -0.884 25153 7330 1 8 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.062 4.248 25153 7331 1 8 . 1 1 143 143 ALA H H 143 5.186 5.186 8.229 -3.043 25153 7332 1 8 . 1 1 144 144 LEU N N 144 125.477 125.477 124.128 1.349 25153 7333 1 8 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.643 0.137 25153 7334 1 8 . 1 1 144 144 LEU C C 144 174.473 174.473 174.969 -0.496 25153 7335 1 8 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.749 -0.509 25153 7336 1 8 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.124 0.176 25153 7337 1 8 . 1 1 144 144 LEU H H 144 8.758 8.758 8.193 0.565 25153 7338 1 8 . 1 1 145 145 ASP N N 145 118.915 118.915 118.940 -0.025 25153 7339 1 8 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.137 0.395 25153 7340 1 8 . 1 1 145 145 ASP C C 145 176.470 176.470 176.156 0.314 25153 7341 1 8 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.129 -0.499 25153 7342 1 8 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.955 -0.954 25153 7343 1 8 . 1 1 146 146 GLU N N 146 124.813 124.813 124.352 0.461 25153 7344 1 8 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.503 -0.127 25153 7345 1 8 . 1 1 146 146 GLU C C 146 177.290 177.290 176.493 0.797 25153 7346 1 8 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.015 0.105 25153 7347 1 8 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.143 1.007 25153 7348 1 8 . 1 1 147 147 THR N N 147 118.328 118.328 114.087 4.241 25153 7349 1 8 . 1 1 147 147 THR HA H 147 4.200 4.200 4.641 -0.441 25153 7350 1 8 . 1 1 147 147 THR C C 147 175.683 175.683 174.406 1.277 25153 7351 1 8 . 1 1 147 147 THR CA C 147 66.250 66.250 63.014 3.236 25153 7352 1 8 . 1 1 147 147 THR CB C 147 69.600 69.600 69.562 0.038 25153 7353 1 8 . 1 1 147 147 THR H H 147 8.562 8.562 8.895 -0.333 25153 7354 1 8 . 1 1 148 148 ASN N N 148 115.550 115.550 118.019 -2.469 25153 7355 1 8 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.850 0.137 25153 7356 1 8 . 1 1 148 148 ASN C C 148 175.870 175.870 176.111 -0.241 25153 7357 1 8 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.328 -0.628 25153 7358 1 8 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.222 1.658 25153 7359 1 8 . 1 1 148 148 ASN H H 148 9.118 9.118 8.787 0.331 25153 7360 1 8 . 1 1 149 149 GLN N N 149 117.400 117.400 119.546 -2.146 25153 7361 1 8 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.290 0.553 25153 7362 1 8 . 1 1 149 149 GLN C C 149 177.780 177.780 176.899 0.881 25153 7363 1 8 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.700 -1.800 25153 7364 1 8 . 1 1 149 149 GLN CB C 149 29.300 29.300 29.065 0.235 25153 7365 1 8 . 1 1 149 149 GLN H H 149 7.555 7.555 8.418 -0.863 25153 7366 1 8 . 1 1 150 150 TYR N N 150 120.674 120.674 117.249 3.425 25153 7367 1 8 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.175 0.353 25153 7368 1 8 . 1 1 150 150 TYR C C 150 177.830 177.830 176.316 1.514 25153 7369 1 8 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.245 0.242 25153 7370 1 8 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.799 -0.199 25153 7371 1 8 . 1 1 150 150 TYR H H 150 6.983 6.983 7.815 -0.832 25153 7372 1 8 . 1 1 151 151 ASP N N 151 120.810 120.810 119.626 1.184 25153 7373 1 8 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.657 -0.142 25153 7374 1 8 . 1 1 151 151 ASP C C 151 176.400 176.400 177.534 -1.134 25153 7375 1 8 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.979 -0.579 25153 7376 1 8 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.424 -2.344 25153 7377 1 8 . 1 1 152 152 LEU N N 152 118.083 118.083 114.916 3.167 25153 7378 1 8 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.728 -0.052 25153 7379 1 8 . 1 1 152 152 LEU C C 152 178.470 178.470 177.805 0.665 25153 7380 1 8 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.623 -1.022 25153 7381 1 8 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.282 -0.682 25153 7382 1 8 . 1 1 152 152 LEU H H 152 7.453 7.453 7.718 -0.265 25153 7383 1 8 . 1 1 153 153 SER N N 153 116.407 116.407 118.056 -1.649 25153 7384 1 8 . 1 1 153 153 SER HA H 153 3.960 3.960 3.987 -0.027 25153 7385 1 8 . 1 1 153 153 SER C C 153 174.590 174.590 175.689 -1.099 25153 7386 1 8 . 1 1 153 153 SER CA C 153 63.400 63.400 62.583 0.817 25153 7387 1 8 . 1 1 153 153 SER CB C 153 63.100 63.100 62.846 0.254 25153 7388 1 8 . 1 1 153 153 SER H H 153 7.360 7.360 8.229 -0.869 25153 7389 1 8 . 1 1 154 154 ASP N N 154 121.960 121.960 120.299 1.661 25153 7390 1 8 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.426 -0.116 25153 7391 1 8 . 1 1 154 154 ASP C C 154 178.640 178.640 177.959 0.681 25153 7392 1 8 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.430 1.570 25153 7393 1 8 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.838 -1.268 25153 7394 1 8 . 1 1 155 155 GLU N N 155 121.310 121.310 119.297 2.013 25153 7395 1 8 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.069 0.116 25153 7396 1 8 . 1 1 155 155 GLU C C 155 179.600 179.600 179.288 0.312 25153 7397 1 8 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.309 0.141 25153 7398 1 8 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.321 0.079 25153 7399 1 8 . 1 1 156 156 ARG N N 156 121.394 121.394 119.540 1.854 25153 7400 1 8 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.321 -0.021 25153 7401 1 8 . 1 1 156 156 ARG C C 156 177.330 177.330 179.246 -1.916 25153 7402 1 8 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.110 2.350 25153 7403 1 8 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.999 0.761 25153 7404 1 8 . 1 1 157 157 ILE N N 157 118.390 118.390 121.304 -2.914 25153 7405 1 8 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.822 -0.388 25153 7406 1 8 . 1 1 157 157 ILE C C 157 178.814 178.814 177.531 1.283 25153 7407 1 8 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.243 0.451 25153 7408 1 8 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.926 0.927 25153 7409 1 8 . 1 1 157 157 ILE H H 157 8.966 8.966 8.259 0.707 25153 7410 1 8 . 1 1 158 158 GLN N N 158 120.060 120.060 119.348 0.712 25153 7411 1 8 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.973 -0.017 25153 7412 1 8 . 1 1 158 158 GLN C C 158 178.843 178.843 178.551 0.292 25153 7413 1 8 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.437 1.163 25153 7414 1 8 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.309 0.081 25153 7415 1 8 . 1 1 158 158 GLN H H 158 8.394 8.394 8.314 0.080 25153 7416 1 8 . 1 1 159 159 SER N N 159 115.613 115.613 116.918 -1.305 25153 7417 1 8 . 1 1 159 159 SER HA H 159 4.455 4.455 4.402 0.053 25153 7418 1 8 . 1 1 159 159 SER C C 159 177.330 177.330 176.429 0.901 25153 7419 1 8 . 1 1 159 159 SER CA C 159 62.400 62.400 62.373 0.027 25153 7420 1 8 . 1 1 159 159 SER CB C 159 63.760 63.760 63.193 0.567 25153 7421 1 8 . 1 1 159 159 SER H H 159 8.460 8.460 8.685 -0.225 25153 7422 1 8 . 1 1 160 160 TRP N N 160 126.820 126.820 124.759 2.061 25153 7423 1 8 . 1 1 160 160 TRP HA H 160 4.465 4.465 3.914 0.551 25153 7424 1 8 . 1 1 160 160 TRP C C 160 178.050 178.050 177.259 0.791 25153 7425 1 8 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.569 1.131 25153 7426 1 8 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.229 0.131 25153 7427 1 8 . 1 1 160 160 TRP H H 160 9.318 9.318 8.028 1.290 25153 7428 1 8 . 1 1 161 161 CYS N N 161 116.750 116.750 117.891 -1.141 25153 7429 1 8 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.715 0.168 25153 7430 1 8 . 1 1 161 161 CYS C C 161 176.270 176.270 177.017 -0.747 25153 7431 1 8 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.202 1.158 25153 7432 1 8 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.940 0.940 25153 7433 1 8 . 1 1 161 161 CYS H H 161 8.950 8.950 9.043 -0.093 25153 7434 1 8 . 1 1 162 162 GLU N N 162 118.096 118.096 118.973 -0.877 25153 7435 1 8 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.054 -0.124 25153 7436 1 8 . 1 1 162 162 GLU C C 162 178.680 178.680 177.703 0.977 25153 7437 1 8 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.027 0.703 25153 7438 1 8 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.531 -0.101 25153 7439 1 8 . 1 1 163 163 GLN N N 163 120.790 120.790 118.034 2.756 25153 7440 1 8 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.107 0.070 25153 7441 1 8 . 1 1 163 163 GLN C C 163 179.690 179.690 177.990 1.700 25153 7442 1 8 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.173 1.367 25153 7443 1 8 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.917 0.083 25153 7444 1 8 . 1 1 163 163 GLN H H 163 8.205 8.205 7.491 0.714 25153 7445 1 8 . 1 1 164 164 ILE N N 164 114.860 114.860 119.041 -4.181 25153 7446 1 8 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.848 0.195 25153 7447 1 8 . 1 1 164 164 ILE C C 164 178.680 178.680 177.368 1.312 25153 7448 1 8 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.040 2.170 25153 7449 1 8 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.596 0.104 25153 7450 1 8 . 1 1 164 164 ILE H H 164 9.005 9.005 7.917 1.088 25153 7451 1 8 . 1 1 165 165 LEU N N 165 123.900 123.900 116.117 7.783 25153 7452 1 8 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.177 -0.027 25153 7453 1 8 . 1 1 165 165 LEU C C 165 180.520 180.520 177.420 3.100 25153 7454 1 8 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.281 1.020 25153 7455 1 8 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.241 -0.191 25153 7456 1 8 . 1 1 165 165 LEU H H 165 7.825 7.825 8.070 -0.245 25153 7457 1 8 . 1 1 166 166 ASN N N 166 120.112 120.112 117.845 2.267 25153 7458 1 8 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.761 -0.178 25153 7459 1 8 . 1 1 166 166 ASN C C 166 178.440 178.440 177.160 1.280 25153 7460 1 8 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.810 0.610 25153 7461 1 8 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.766 -1.346 25153 7462 1 8 . 1 1 166 166 ASN H H 166 7.760 7.760 7.930 -0.170 25153 7463 1 8 . 1 1 167 167 GLU N N 167 121.370 121.370 122.136 -0.766 25153 7464 1 8 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.975 0.128 25153 7465 1 8 . 1 1 167 167 GLU C C 167 180.332 180.332 179.296 1.036 25153 7466 1 8 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.932 0.218 25153 7467 1 8 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.685 1.335 25153 7468 1 8 . 1 1 168 168 MET N N 168 118.532 118.532 117.475 1.057 25153 7469 1 8 . 1 1 168 168 MET HA H 168 4.015 4.015 4.209 -0.194 25153 7470 1 8 . 1 1 168 168 MET C C 168 176.600 176.600 178.206 -1.606 25153 7471 1 8 . 1 1 168 168 MET CA C 168 59.300 59.300 59.676 -0.376 25153 7472 1 8 . 1 1 168 168 MET CB C 168 33.400 33.400 32.630 0.770 25153 7473 1 8 . 1 1 168 168 MET H H 168 8.718 8.718 8.468 0.250 25153 7474 1 8 . 1 1 169 169 ALA N N 169 121.922 121.922 121.256 0.666 25153 7475 1 8 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.122 0.052 25153 7476 1 8 . 1 1 169 169 ALA C C 169 179.410 179.410 178.973 0.437 25153 7477 1 8 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.653 -0.253 25153 7478 1 8 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.374 0.036 25153 7479 1 8 . 1 1 169 169 ALA H H 169 7.448 7.448 7.880 -0.432 25153 7480 1 8 . 1 1 170 170 GLU N N 170 117.300 117.300 115.941 1.359 25153 7481 1 8 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.139 -0.044 25153 7482 1 8 . 1 1 170 170 GLU C C 170 177.470 177.470 179.497 -2.027 25153 7483 1 8 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.615 -0.665 25153 7484 1 8 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.718 0.057 25153 7485 1 8 . 1 1 171 171 HIS N N 171 117.944 117.944 120.140 -2.196 25153 7486 1 8 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.398 0.102 25153 7487 1 8 . 1 1 171 171 HIS C C 171 175.120 175.120 176.790 -1.670 25153 7488 1 8 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.357 -2.157 25153 7489 1 8 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.024 0.576 25153 7490 1 8 . 1 1 171 171 HIS H H 171 7.788 7.788 8.048 -0.260 25153 7491 1 8 . 1 1 172 172 TYR N N 172 120.040 120.040 117.930 2.110 25153 7492 1 8 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.411 0.182 25153 7493 1 8 . 1 1 172 172 TYR C C 172 174.612 174.612 175.651 -1.039 25153 7494 1 8 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.797 -0.817 25153 7495 1 8 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.705 0.275 25153 7496 1 8 . 1 1 172 172 TYR H H 172 7.820 7.820 8.078 -0.258 25153 7497 1 9 . 1 1 2 2 ASN N N 2 123.320 123.320 119.700 3.620 25153 7498 1 9 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.060 0.148 25153 7499 1 9 . 1 1 2 2 ASN C C 2 174.590 174.590 174.447 0.143 25153 7500 1 9 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.807 0.193 25153 7501 1 9 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.175 -0.205 25153 7502 1 9 . 1 1 2 2 ASN H H 2 9.428 9.428 8.696 0.732 25153 7503 1 9 . 1 1 3 3 MET N N 3 120.920 120.920 118.813 2.107 25153 7504 1 9 . 1 1 3 3 MET HA H 3 5.530 5.530 5.241 0.289 25153 7505 1 9 . 1 1 3 3 MET C C 3 174.400 174.400 174.899 -0.499 25153 7506 1 9 . 1 1 3 3 MET CA C 3 54.643 54.643 54.263 0.380 25153 7507 1 9 . 1 1 3 3 MET CB C 3 34.637 34.637 37.607 -2.970 25153 7508 1 9 . 1 1 3 3 MET H H 3 8.751 8.751 9.107 -0.356 25153 7509 1 9 . 1 1 4 4 GLY N N 4 115.542 115.542 109.322 6.220 25153 7510 1 9 . 1 1 4 4 GLY C C 4 170.413 170.413 172.181 -1.768 25153 7511 1 9 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.804 -0.702 25153 7512 1 9 . 1 1 4 4 GLY H H 4 8.927 8.927 8.840 0.087 25153 7513 1 9 . 1 1 5 5 LEU N N 5 131.030 131.030 128.119 2.911 25153 7514 1 9 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.341 1.061 25153 7515 1 9 . 1 1 5 5 LEU C C 5 175.952 175.952 174.525 1.427 25153 7516 1 9 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.009 0.441 25153 7517 1 9 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.039 2.553 25153 7518 1 9 . 1 1 5 5 LEU H H 5 8.928 8.928 8.630 0.298 25153 7519 1 9 . 1 1 6 6 PHE N N 6 125.790 125.790 126.128 -0.338 25153 7520 1 9 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.753 -0.013 25153 7521 1 9 . 1 1 6 6 PHE C C 6 174.300 174.300 175.853 -1.553 25153 7522 1 9 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.300 -0.980 25153 7523 1 9 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.809 -0.579 25153 7524 1 9 . 1 1 6 6 PHE H H 6 9.237 9.237 9.428 -0.191 25153 7525 1 9 . 1 1 7 7 TYR N N 7 117.289 117.289 116.527 0.762 25153 7526 1 9 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.908 0.057 25153 7527 1 9 . 1 1 7 7 TYR C C 7 171.262 171.262 173.363 -2.101 25153 7528 1 9 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.354 -0.954 25153 7529 1 9 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.889 0.351 25153 7530 1 9 . 1 1 7 7 TYR H H 7 8.125 8.125 8.283 -0.158 25153 7531 1 9 . 1 1 8 8 GLY N N 8 107.420 107.420 105.712 1.708 25153 7532 1 9 . 1 1 8 8 GLY C C 8 172.000 172.000 172.219 -0.219 25153 7533 1 9 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.243 -0.299 25153 7534 1 9 . 1 1 8 8 GLY H H 8 7.031 7.031 8.548 -1.517 25153 7535 1 9 . 1 1 9 9 SER N N 9 118.150 118.150 116.309 1.841 25153 7536 1 9 . 1 1 9 9 SER HA H 9 5.200 5.200 5.054 0.146 25153 7537 1 9 . 1 1 9 9 SER C C 9 175.000 175.000 174.179 0.821 25153 7538 1 9 . 1 1 9 9 SER CA C 9 57.570 57.570 57.250 0.320 25153 7539 1 9 . 1 1 9 9 SER CB C 9 66.700 66.700 65.079 1.621 25153 7540 1 9 . 1 1 9 9 SER H H 9 9.604 9.604 8.587 1.017 25153 7541 1 9 . 1 1 10 10 SER N N 10 131.193 131.193 119.992 11.201 25153 7542 1 9 . 1 1 10 10 SER HA H 10 4.775 4.775 4.579 0.196 25153 7543 1 9 . 1 1 10 10 SER C C 10 175.730 175.730 175.686 0.044 25153 7544 1 9 . 1 1 10 10 SER CA C 10 61.750 61.750 60.175 1.575 25153 7545 1 9 . 1 1 10 10 SER CB C 10 64.400 64.400 63.654 0.747 25153 7546 1 9 . 1 1 10 10 SER H H 10 11.636 11.636 8.909 2.727 25153 7547 1 9 . 1 1 11 11 THR N N 11 115.848 115.848 112.561 3.287 25153 7548 1 9 . 1 1 11 11 THR HA H 11 4.770 4.770 4.307 0.463 25153 7549 1 9 . 1 1 11 11 THR C C 11 173.700 173.700 174.483 -0.783 25153 7550 1 9 . 1 1 11 11 THR CA C 11 60.700 60.700 61.864 -1.164 25153 7551 1 9 . 1 1 11 11 THR CB C 11 67.430 67.430 68.741 -1.311 25153 7552 1 9 . 1 1 11 11 THR H H 11 9.550 9.550 8.063 1.487 25153 7553 1 9 . 1 1 12 12 CYS N N 12 109.780 109.780 118.262 -8.482 25153 7554 1 9 . 1 1 12 12 CYS HA H 12 4.070 4.070 3.974 0.096 25153 7555 1 9 . 1 1 12 12 CYS C C 12 176.220 176.220 175.833 0.387 25153 7556 1 9 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.099 3.502 25153 7557 1 9 . 1 1 12 12 CYS CB C 12 26.400 26.400 26.034 0.366 25153 7558 1 9 . 1 1 12 12 CYS H H 12 7.437 7.437 7.726 -0.289 25153 7559 1 9 . 1 1 13 13 TYR N N 13 127.830 127.830 119.548 8.282 25153 7560 1 9 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.253 -0.150 25153 7561 1 9 . 1 1 13 13 TYR C C 13 180.880 180.880 178.066 2.814 25153 7562 1 9 . 1 1 13 13 TYR CA C 13 65.100 65.100 59.864 5.236 25153 7563 1 9 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.318 -0.483 25153 7564 1 9 . 1 1 13 13 TYR H H 13 10.886 10.886 7.561 3.325 25153 7565 1 9 . 1 1 14 14 THR N N 14 124.428 124.428 113.571 10.857 25153 7566 1 9 . 1 1 14 14 THR HA H 14 4.160 4.160 4.161 -0.001 25153 7567 1 9 . 1 1 14 14 THR C C 14 177.760 177.760 176.472 1.288 25153 7568 1 9 . 1 1 14 14 THR CA C 14 67.823 67.823 66.580 1.243 25153 7569 1 9 . 1 1 14 14 THR CB C 14 68.040 68.040 68.495 -0.454 25153 7570 1 9 . 1 1 14 14 THR H H 14 11.405 11.405 8.053 3.352 25153 7571 1 9 . 1 1 15 15 GLU N N 15 123.050 123.050 123.074 -0.024 25153 7572 1 9 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.236 -0.346 25153 7573 1 9 . 1 1 15 15 GLU C C 15 176.392 176.392 178.469 -2.077 25153 7574 1 9 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.569 -0.369 25153 7575 1 9 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.229 1.221 25153 7576 1 9 . 1 1 16 16 MET N N 16 120.173 120.173 118.611 1.562 25153 7577 1 9 . 1 1 16 16 MET HA H 16 4.050 4.050 4.127 -0.077 25153 7578 1 9 . 1 1 16 16 MET C C 16 179.940 179.940 178.659 1.281 25153 7579 1 9 . 1 1 16 16 MET CA C 16 59.240 59.240 59.276 -0.036 25153 7580 1 9 . 1 1 16 16 MET CB C 16 32.970 32.970 32.871 0.099 25153 7581 1 9 . 1 1 16 16 MET H H 16 8.469 8.469 8.325 0.144 25153 7582 1 9 . 1 1 17 17 ALA N N 17 121.930 121.930 121.730 0.200 25153 7583 1 9 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.849 -0.013 25153 7584 1 9 . 1 1 17 17 ALA C C 17 177.900 177.900 178.765 -0.865 25153 7585 1 9 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.161 0.039 25153 7586 1 9 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.119 -0.119 25153 7587 1 9 . 1 1 17 17 ALA H H 17 7.880 7.880 8.364 -0.484 25153 7588 1 9 . 1 1 18 18 ALA N N 18 121.477 121.477 121.389 0.088 25153 7589 1 9 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.821 -0.084 25153 7590 1 9 . 1 1 18 18 ALA C C 18 179.380 179.380 179.558 -0.178 25153 7591 1 9 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.165 -0.165 25153 7592 1 9 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.782 1.048 25153 7593 1 9 . 1 1 18 18 ALA H H 18 7.374 7.374 8.051 -0.677 25153 7594 1 9 . 1 1 19 19 GLU N N 19 116.650 116.650 118.167 -1.517 25153 7595 1 9 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.835 -0.219 25153 7596 1 9 . 1 1 19 19 GLU C C 19 178.479 178.479 179.299 -0.820 25153 7597 1 9 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.545 0.185 25153 7598 1 9 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.379 -0.079 25153 7599 1 9 . 1 1 20 20 LYS N N 20 119.470 119.470 119.816 -0.346 25153 7600 1 9 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.008 0.042 25153 7601 1 9 . 1 1 20 20 LYS C C 20 179.116 179.116 179.052 0.064 25153 7602 1 9 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.459 0.371 25153 7603 1 9 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.416 0.433 25153 7604 1 9 . 1 1 21 21 ILE N N 21 121.030 121.030 120.756 0.274 25153 7605 1 9 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.678 -0.288 25153 7606 1 9 . 1 1 21 21 ILE C C 21 177.580 177.580 178.202 -0.622 25153 7607 1 9 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.752 0.068 25153 7608 1 9 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.908 0.440 25153 7609 1 9 . 1 1 21 21 ILE H H 21 8.100 8.100 8.568 -0.468 25153 7610 1 9 . 1 1 22 22 ARG N N 22 119.720 119.720 119.482 0.238 25153 7611 1 9 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.838 -0.283 25153 7612 1 9 . 1 1 22 22 ARG C C 22 177.320 177.320 178.094 -0.774 25153 7613 1 9 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.715 0.005 25153 7614 1 9 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.729 -0.797 25153 7615 1 9 . 1 1 23 23 ASP N N 23 118.730 118.730 119.877 -1.147 25153 7616 1 9 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.418 -0.055 25153 7617 1 9 . 1 1 23 23 ASP C C 23 178.330 178.330 178.773 -0.443 25153 7618 1 9 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.257 -0.307 25153 7619 1 9 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.854 -0.614 25153 7620 1 9 . 1 1 24 24 ILE N N 24 121.090 121.090 119.482 1.608 25153 7621 1 9 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.773 0.023 25153 7622 1 9 . 1 1 24 24 ILE C C 24 178.250 178.250 177.927 0.323 25153 7623 1 9 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.832 -0.681 25153 7624 1 9 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.270 0.210 25153 7625 1 9 . 1 1 24 24 ILE H H 24 7.910 7.910 8.195 -0.285 25153 7626 1 9 . 1 1 25 25 ILE N N 25 121.406 121.406 117.265 4.141 25153 7627 1 9 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.861 -0.215 25153 7628 1 9 . 1 1 25 25 ILE C C 25 176.800 176.800 176.768 0.032 25153 7629 1 9 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.025 2.675 25153 7630 1 9 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.933 -0.743 25153 7631 1 9 . 1 1 25 25 ILE H H 25 8.476 8.476 8.047 0.429 25153 7632 1 9 . 1 1 26 26 GLY N N 26 108.900 108.900 105.179 3.721 25153 7633 1 9 . 1 1 26 26 GLY C C 26 173.710 173.710 172.254 1.456 25153 7634 1 9 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.665 -0.335 25153 7635 1 9 . 1 1 26 26 GLY H H 26 8.016 8.016 7.804 0.212 25153 7636 1 9 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.692 -0.354 25153 7637 1 9 . 1 1 27 27 PRO C C 27 177.200 177.200 177.137 0.063 25153 7638 1 9 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.487 1.199 25153 7639 1 9 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.019 0.181 25153 7640 1 9 . 1 1 28 28 GLU N N 28 116.295 116.295 117.965 -1.670 25153 7641 1 9 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.209 0.061 25153 7642 1 9 . 1 1 28 28 GLU C C 28 176.980 176.980 177.294 -0.314 25153 7643 1 9 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.147 -0.407 25153 7644 1 9 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.603 -0.933 25153 7645 1 9 . 1 1 29 29 LEU N N 29 120.250 120.250 112.090 8.160 25153 7646 1 9 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.697 -0.061 25153 7647 1 9 . 1 1 29 29 LEU C C 29 175.770 175.770 175.579 0.191 25153 7648 1 9 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.008 0.792 25153 7649 1 9 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.017 1.083 25153 7650 1 9 . 1 1 29 29 LEU H H 29 7.940 7.940 7.587 0.353 25153 7651 1 9 . 1 1 30 30 VAL N N 30 118.693 118.693 120.757 -2.064 25153 7652 1 9 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.785 -0.137 25153 7653 1 9 . 1 1 30 30 VAL C C 30 174.347 174.347 175.788 -1.441 25153 7654 1 9 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.495 -0.627 25153 7655 1 9 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.109 1.471 25153 7656 1 9 . 1 1 30 30 VAL H H 30 7.434 7.434 7.975 -0.541 25153 7657 1 9 . 1 1 31 31 THR N N 31 123.800 123.800 121.486 2.314 25153 7658 1 9 . 1 1 31 31 THR HA H 31 4.362 4.362 4.541 -0.179 25153 7659 1 9 . 1 1 31 31 THR C C 31 172.964 172.964 173.308 -0.344 25153 7660 1 9 . 1 1 31 31 THR CA C 31 61.720 61.720 60.906 0.814 25153 7661 1 9 . 1 1 31 31 THR CB C 31 70.485 70.485 70.787 -0.302 25153 7662 1 9 . 1 1 31 31 THR H H 31 7.844 7.844 8.238 -0.394 25153 7663 1 9 . 1 1 32 32 LEU N N 32 127.800 127.800 126.861 0.939 25153 7664 1 9 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.552 0.132 25153 7665 1 9 . 1 1 32 32 LEU C C 32 176.600 176.600 176.483 0.117 25153 7666 1 9 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.083 0.072 25153 7667 1 9 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.713 1.137 25153 7668 1 9 . 1 1 32 32 LEU H H 32 8.660 8.660 8.601 0.059 25153 7669 1 9 . 1 1 33 33 HIS N N 33 119.670 119.670 119.804 -0.134 25153 7670 1 9 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.782 -0.382 25153 7671 1 9 . 1 1 33 33 HIS C C 33 171.667 171.667 173.218 -1.551 25153 7672 1 9 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.977 0.223 25153 7673 1 9 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.590 0.610 25153 7674 1 9 . 1 1 33 33 HIS H H 33 9.060 9.060 8.697 0.363 25153 7675 1 9 . 1 1 34 34 ASN N N 34 124.068 124.068 123.142 0.926 25153 7676 1 9 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.014 -0.580 25153 7677 1 9 . 1 1 34 34 ASN C C 34 178.000 178.000 175.948 2.052 25153 7678 1 9 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.973 -0.544 25153 7679 1 9 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.057 -0.497 25153 7680 1 9 . 1 1 34 34 ASN H H 34 8.780 8.780 8.186 0.594 25153 7681 1 9 . 1 1 35 35 LEU N N 35 129.040 129.040 126.508 2.532 25153 7682 1 9 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.164 0.151 25153 7683 1 9 . 1 1 35 35 LEU C C 35 177.700 177.700 177.836 -0.136 25153 7684 1 9 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.388 0.092 25153 7685 1 9 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.841 1.459 25153 7686 1 9 . 1 1 35 35 LEU H H 35 8.821 8.821 8.479 0.342 25153 7687 1 9 . 1 1 36 36 LYS N N 36 121.043 121.043 116.575 4.468 25153 7688 1 9 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.067 -0.187 25153 7689 1 9 . 1 1 36 36 LYS C C 36 176.230 176.230 176.983 -0.753 25153 7690 1 9 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.398 1.022 25153 7691 1 9 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.505 0.765 25153 7692 1 9 . 1 1 37 37 ASP N N 37 114.965 114.965 117.997 -3.032 25153 7693 1 9 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.783 -0.006 25153 7694 1 9 . 1 1 37 37 ASP C C 37 175.440 175.440 175.977 -0.537 25153 7695 1 9 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.481 0.230 25153 7696 1 9 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.494 1.206 25153 7697 1 9 . 1 1 38 38 ASP N N 38 121.650 121.650 121.673 -0.023 25153 7698 1 9 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.854 0.016 25153 7699 1 9 . 1 1 38 38 ASP C C 38 174.852 174.852 175.973 -1.121 25153 7700 1 9 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.680 -1.600 25153 7701 1 9 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.256 -0.146 25153 7702 1 9 . 1 1 39 39 SER N N 39 115.207 115.207 118.150 -2.943 25153 7703 1 9 . 1 1 39 39 SER HA H 39 4.585 4.585 4.687 -0.102 25153 7704 1 9 . 1 1 39 39 SER C C 39 175.040 175.040 174.308 0.732 25153 7705 1 9 . 1 1 39 39 SER CA C 39 54.960 54.960 56.299 -1.339 25153 7706 1 9 . 1 1 39 39 SER CB C 39 64.720 64.720 63.625 1.095 25153 7707 1 9 . 1 1 39 39 SER H H 39 8.351 8.351 8.588 -0.237 25153 7708 1 9 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.216 -0.211 25153 7709 1 9 . 1 1 40 40 PRO C C 40 176.730 176.730 177.833 -1.103 25153 7710 1 9 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.040 -0.140 25153 7711 1 9 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.701 -0.301 25153 7712 1 9 . 1 1 41 41 LYS N N 41 121.150 121.150 119.938 1.212 25153 7713 1 9 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.963 -0.051 25153 7714 1 9 . 1 1 41 41 LYS C C 41 179.600 179.600 178.540 1.060 25153 7715 1 9 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.439 -1.239 25153 7716 1 9 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.685 0.315 25153 7717 1 9 . 1 1 42 42 LEU N N 42 118.103 118.103 116.275 1.828 25153 7718 1 9 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.158 -0.121 25153 7719 1 9 . 1 1 42 42 LEU C C 42 178.760 178.760 178.733 0.027 25153 7720 1 9 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.338 -0.158 25153 7721 1 9 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.491 1.482 25153 7722 1 9 . 1 1 42 42 LEU H H 42 7.600 7.600 7.475 0.125 25153 7723 1 9 . 1 1 43 43 MET N N 43 118.917 118.917 116.732 2.185 25153 7724 1 9 . 1 1 43 43 MET HA H 43 3.750 3.750 4.408 -0.658 25153 7725 1 9 . 1 1 43 43 MET C C 43 177.680 177.680 176.699 0.981 25153 7726 1 9 . 1 1 43 43 MET CA C 43 59.730 59.730 57.925 1.805 25153 7727 1 9 . 1 1 43 43 MET CB C 43 32.700 32.700 31.838 0.862 25153 7728 1 9 . 1 1 43 43 MET H H 43 8.202 8.202 8.067 0.135 25153 7729 1 9 . 1 1 44 44 GLU N N 44 110.924 110.924 117.491 -6.567 25153 7730 1 9 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.255 -0.515 25153 7731 1 9 . 1 1 44 44 GLU C C 44 178.130 178.130 178.956 -0.826 25153 7732 1 9 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.046 1.354 25153 7733 1 9 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.979 -0.429 25153 7734 1 9 . 1 1 45 45 GLN N N 45 115.756 115.756 118.817 -3.061 25153 7735 1 9 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.022 0.161 25153 7736 1 9 . 1 1 45 45 GLN C C 45 175.414 175.414 177.174 -1.760 25153 7737 1 9 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.627 -1.447 25153 7738 1 9 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.083 -0.483 25153 7739 1 9 . 1 1 45 45 GLN H H 45 7.516 7.516 7.468 0.048 25153 7740 1 9 . 1 1 46 46 TYR N N 46 117.860 117.860 118.698 -0.838 25153 7741 1 9 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.341 0.322 25153 7742 1 9 . 1 1 46 46 TYR C C 46 175.500 175.500 177.157 -1.657 25153 7743 1 9 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.370 -0.884 25153 7744 1 9 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.134 3.336 25153 7745 1 9 . 1 1 46 46 TYR H H 46 6.996 6.996 7.123 -0.127 25153 7746 1 9 . 1 1 47 47 ASP N N 47 121.683 121.683 121.796 -0.113 25153 7747 1 9 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.608 0.092 25153 7748 1 9 . 1 1 47 47 ASP C C 47 175.610 175.610 175.323 0.287 25153 7749 1 9 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.374 -0.674 25153 7750 1 9 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.864 1.135 25153 7751 1 9 . 1 1 48 48 VAL N N 48 118.628 118.628 116.003 2.625 25153 7752 1 9 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.755 0.279 25153 7753 1 9 . 1 1 48 48 VAL C C 48 174.190 174.190 173.787 0.403 25153 7754 1 9 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.013 -0.823 25153 7755 1 9 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.764 0.336 25153 7756 1 9 . 1 1 48 48 VAL H H 48 7.628 7.628 7.260 0.368 25153 7757 1 9 . 1 1 49 49 LEU N N 49 128.190 128.190 123.843 4.347 25153 7758 1 9 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.394 0.209 25153 7759 1 9 . 1 1 49 49 LEU C C 49 174.880 174.880 175.464 -0.584 25153 7760 1 9 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.436 -1.196 25153 7761 1 9 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.258 -0.918 25153 7762 1 9 . 1 1 49 49 LEU H H 49 9.407 9.407 8.946 0.461 25153 7763 1 9 . 1 1 50 50 ILE N N 50 124.550 124.550 120.721 3.829 25153 7764 1 9 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.046 0.654 25153 7765 1 9 . 1 1 50 50 ILE C C 50 175.300 175.300 174.569 0.731 25153 7766 1 9 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.864 -1.000 25153 7767 1 9 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.001 -0.751 25153 7768 1 9 . 1 1 50 50 ILE H H 50 9.238 9.238 9.173 0.065 25153 7769 1 9 . 1 1 51 51 LEU N N 51 127.460 127.460 128.279 -0.819 25153 7770 1 9 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.772 0.413 25153 7771 1 9 . 1 1 51 51 LEU C C 51 174.544 174.544 175.876 -1.332 25153 7772 1 9 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.576 -0.756 25153 7773 1 9 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.082 -2.445 25153 7774 1 9 . 1 1 51 51 LEU H H 51 9.228 9.228 9.110 0.118 25153 7775 1 9 . 1 1 52 52 GLY N N 52 107.760 107.760 111.343 -3.583 25153 7776 1 9 . 1 1 52 52 GLY C C 52 174.710 174.710 172.494 2.216 25153 7777 1 9 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.853 0.017 25153 7778 1 9 . 1 1 52 52 GLY H H 52 8.860 8.860 8.937 -0.077 25153 7779 1 9 . 1 1 53 53 ILE N N 53 123.890 123.890 120.502 3.388 25153 7780 1 9 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.728 0.542 25153 7781 1 9 . 1 1 53 53 ILE C C 53 172.630 172.630 173.219 -0.589 25153 7782 1 9 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.628 0.052 25153 7783 1 9 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.047 4.113 25153 7784 1 9 . 1 1 53 53 ILE H H 53 8.458 8.458 8.117 0.341 25153 7785 1 9 . 1 1 54 54 PRO HA H 54 5.388 5.388 5.016 0.372 25153 7786 1 9 . 1 1 54 54 PRO C C 54 175.000 175.000 176.543 -1.543 25153 7787 1 9 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.815 -0.215 25153 7788 1 9 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.029 -0.729 25153 7789 1 9 . 1 1 55 55 THR N N 55 112.754 112.754 118.755 -6.001 25153 7790 1 9 . 1 1 55 55 THR HA H 55 4.452 4.452 4.831 -0.379 25153 7791 1 9 . 1 1 55 55 THR C C 55 172.480 172.480 174.126 -1.646 25153 7792 1 9 . 1 1 55 55 THR CA C 55 62.350 62.350 63.590 -1.240 25153 7793 1 9 . 1 1 55 55 THR CB C 55 70.230 70.230 70.200 0.030 25153 7794 1 9 . 1 1 55 55 THR H H 55 6.523 6.523 8.044 -1.521 25153 7795 1 9 . 1 1 56 56 TRP N N 56 130.044 130.044 126.166 3.878 25153 7796 1 9 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.531 -1.816 25153 7797 1 9 . 1 1 56 56 TRP C C 56 172.890 172.890 174.954 -2.064 25153 7798 1 9 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.785 -0.135 25153 7799 1 9 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.815 0.185 25153 7800 1 9 . 1 1 56 56 TRP H H 56 8.450 8.450 8.690 -0.240 25153 7801 1 9 . 1 1 57 57 ASP N N 57 115.275 115.275 120.362 -5.087 25153 7802 1 9 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.974 0.378 25153 7803 1 9 . 1 1 57 57 ASP C C 57 173.660 173.660 174.645 -0.985 25153 7804 1 9 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.469 0.761 25153 7805 1 9 . 1 1 57 57 ASP CB C 57 40.170 40.170 40.033 0.137 25153 7806 1 9 . 1 1 58 58 PHE N N 58 112.840 112.840 115.814 -2.974 25153 7807 1 9 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.484 -0.160 25153 7808 1 9 . 1 1 58 58 PHE C C 58 175.730 175.730 176.043 -0.313 25153 7809 1 9 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.038 0.785 25153 7810 1 9 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.034 -2.280 25153 7811 1 9 . 1 1 58 58 PHE H H 58 7.640 7.640 7.346 0.294 25153 7812 1 9 . 1 1 59 59 GLY N N 59 104.940 104.940 107.277 -2.337 25153 7813 1 9 . 1 1 59 59 GLY C C 59 173.750 173.750 174.391 -0.641 25153 7814 1 9 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.354 0.936 25153 7815 1 9 . 1 1 59 59 GLY H H 59 8.024 8.024 8.727 -0.703 25153 7816 1 9 . 1 1 60 60 GLU N N 60 120.045 120.045 119.072 0.973 25153 7817 1 9 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.551 -0.138 25153 7818 1 9 . 1 1 60 60 GLU C C 60 176.050 176.050 175.982 0.068 25153 7819 1 9 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.864 -0.243 25153 7820 1 9 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.319 -0.709 25153 7821 1 9 . 1 1 61 61 ILE N N 61 120.790 120.790 120.049 0.741 25153 7822 1 9 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.126 -0.659 25153 7823 1 9 . 1 1 61 61 ILE C C 61 175.130 175.130 176.170 -1.040 25153 7824 1 9 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.300 0.247 25153 7825 1 9 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.973 -0.123 25153 7826 1 9 . 1 1 61 61 ILE H H 61 8.200 8.200 8.434 -0.234 25153 7827 1 9 . 1 1 62 62 GLN N N 62 124.520 124.520 124.160 0.360 25153 7828 1 9 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.138 -0.182 25153 7829 1 9 . 1 1 62 62 GLN C C 62 177.160 177.160 177.014 0.146 25153 7830 1 9 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.395 2.215 25153 7831 1 9 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.223 -2.573 25153 7832 1 9 . 1 1 62 62 GLN H H 62 5.667 5.667 8.742 -3.075 25153 7833 1 9 . 1 1 63 63 GLU N N 63 124.570 124.570 126.597 -2.027 25153 7834 1 9 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.161 -0.175 25153 7835 1 9 . 1 1 63 63 GLU C C 63 177.300 177.300 177.159 0.141 25153 7836 1 9 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.215 1.505 25153 7837 1 9 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.206 0.914 25153 7838 1 9 . 1 1 64 64 ASP N N 64 119.060 119.060 119.521 -0.461 25153 7839 1 9 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.431 0.189 25153 7840 1 9 . 1 1 64 64 ASP C C 64 179.180 179.180 177.222 1.958 25153 7841 1 9 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.619 1.331 25153 7842 1 9 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.291 0.659 25153 7843 1 9 . 1 1 65 65 TRP N N 65 121.070 121.070 120.635 0.435 25153 7844 1 9 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.468 -0.128 25153 7845 1 9 . 1 1 65 65 TRP C C 65 178.970 178.970 178.278 0.692 25153 7846 1 9 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.343 0.478 25153 7847 1 9 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.592 -0.192 25153 7848 1 9 . 1 1 65 65 TRP H H 65 7.350 7.350 8.082 -0.732 25153 7849 1 9 . 1 1 66 66 GLU N N 66 120.900 120.900 119.265 1.635 25153 7850 1 9 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.934 -0.094 25153 7851 1 9 . 1 1 66 66 GLU C C 66 178.750 178.750 179.125 -0.375 25153 7852 1 9 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.546 0.454 25153 7853 1 9 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.304 -0.444 25153 7854 1 9 . 1 1 67 67 ALA N N 67 119.130 119.130 120.314 -1.184 25153 7855 1 9 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.250 0.003 25153 7856 1 9 . 1 1 67 67 ALA C C 67 179.410 179.410 179.196 0.214 25153 7857 1 9 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.896 -0.316 25153 7858 1 9 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.835 -0.025 25153 7859 1 9 . 1 1 67 67 ALA H H 67 7.640 7.640 8.237 -0.597 25153 7860 1 9 . 1 1 68 68 VAL N N 68 106.845 106.845 112.330 -5.485 25153 7861 1 9 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.495 0.315 25153 7862 1 9 . 1 1 68 68 VAL C C 68 176.750 176.750 176.961 -0.211 25153 7863 1 9 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.284 -2.674 25153 7864 1 9 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.193 0.427 25153 7865 1 9 . 1 1 68 68 VAL H H 68 7.219 7.219 7.636 -0.417 25153 7866 1 9 . 1 1 69 69 TRP N N 69 127.630 127.630 124.118 3.512 25153 7867 1 9 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.260 -0.022 25153 7868 1 9 . 1 1 69 69 TRP C C 69 178.670 178.670 177.018 1.652 25153 7869 1 9 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.836 -1.616 25153 7870 1 9 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.600 2.030 25153 7871 1 9 . 1 1 69 69 TRP H H 69 7.832 7.832 8.578 -0.746 25153 7872 1 9 . 1 1 70 70 ASP N N 70 114.544 114.544 117.991 -3.447 25153 7873 1 9 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.467 0.055 25153 7874 1 9 . 1 1 70 70 ASP C C 70 178.670 178.670 179.065 -0.395 25153 7875 1 9 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.090 -1.090 25153 7876 1 9 . 1 1 70 70 ASP CB C 70 39.850 39.850 41.055 -1.205 25153 7877 1 9 . 1 1 71 71 GLN N N 71 120.040 120.040 119.538 0.502 25153 7878 1 9 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.107 0.077 25153 7879 1 9 . 1 1 71 71 GLN C C 71 178.910 178.910 178.805 0.105 25153 7880 1 9 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.386 -0.776 25153 7881 1 9 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.841 0.259 25153 7882 1 9 . 1 1 71 71 GLN H H 71 7.995 7.995 7.716 0.279 25153 7883 1 9 . 1 1 72 72 LEU N N 72 117.400 117.400 118.189 -0.789 25153 7884 1 9 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.959 -0.146 25153 7885 1 9 . 1 1 72 72 LEU C C 72 178.650 178.650 178.104 0.546 25153 7886 1 9 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.012 0.188 25153 7887 1 9 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.353 0.057 25153 7888 1 9 . 1 1 72 72 LEU H H 72 7.450 7.450 7.803 -0.353 25153 7889 1 9 . 1 1 73 73 ASP N N 73 115.750 115.750 117.577 -1.827 25153 7890 1 9 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.439 -0.271 25153 7891 1 9 . 1 1 73 73 ASP C C 73 177.560 177.560 177.503 0.057 25153 7892 1 9 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.342 1.058 25153 7893 1 9 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.483 -1.383 25153 7894 1 9 . 1 1 74 74 ASP N N 74 117.223 117.223 119.894 -2.671 25153 7895 1 9 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.593 0.110 25153 7896 1 9 . 1 1 74 74 ASP C C 74 176.388 176.388 177.079 -0.691 25153 7897 1 9 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.073 -0.573 25153 7898 1 9 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.608 0.092 25153 7899 1 9 . 1 1 75 75 LEU N N 75 118.316 118.316 119.543 -1.227 25153 7900 1 9 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.342 -0.057 25153 7901 1 9 . 1 1 75 75 LEU C C 75 176.820 176.820 175.881 0.939 25153 7902 1 9 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.507 -0.107 25153 7903 1 9 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.431 0.849 25153 7904 1 9 . 1 1 75 75 LEU H H 75 6.960 6.960 7.352 -0.392 25153 7905 1 9 . 1 1 76 76 ASN N N 76 123.045 123.045 118.043 5.002 25153 7906 1 9 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.777 0.113 25153 7907 1 9 . 1 1 76 76 ASN C C 76 174.950 174.950 174.767 0.183 25153 7908 1 9 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.657 -0.607 25153 7909 1 9 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.474 -0.974 25153 7910 1 9 . 1 1 76 76 ASN H H 76 9.890 9.890 8.787 1.103 25153 7911 1 9 . 1 1 77 77 LEU N N 77 123.494 123.494 123.260 0.234 25153 7912 1 9 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.527 -0.157 25153 7913 1 9 . 1 1 77 77 LEU C C 77 175.040 175.040 176.352 -1.312 25153 7914 1 9 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.876 -1.626 25153 7915 1 9 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.368 0.532 25153 7916 1 9 . 1 1 77 77 LEU H H 77 8.730 8.730 8.050 0.680 25153 7917 1 9 . 1 1 78 78 GLU N N 78 120.870 120.870 121.612 -0.742 25153 7918 1 9 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.383 -0.483 25153 7919 1 9 . 1 1 78 78 GLU C C 78 178.660 178.660 177.815 0.845 25153 7920 1 9 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.647 1.113 25153 7921 1 9 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.207 0.193 25153 7922 1 9 . 1 1 79 79 GLY N N 79 113.240 113.240 114.149 -0.909 25153 7923 1 9 . 1 1 79 79 GLY C C 79 174.460 174.460 174.446 0.014 25153 7924 1 9 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.325 0.105 25153 7925 1 9 . 1 1 79 79 GLY H H 79 8.474 8.474 8.870 -0.396 25153 7926 1 9 . 1 1 80 80 LYS N N 80 120.295 120.295 119.420 0.875 25153 7927 1 9 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.603 -0.245 25153 7928 1 9 . 1 1 80 80 LYS C C 80 175.360 175.360 176.148 -0.788 25153 7929 1 9 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.227 0.743 25153 7930 1 9 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.671 -0.471 25153 7931 1 9 . 1 1 81 81 ILE N N 81 122.400 122.400 122.671 -0.271 25153 7932 1 9 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.662 0.131 25153 7933 1 9 . 1 1 81 81 ILE C C 81 174.760 174.760 175.451 -0.691 25153 7934 1 9 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.475 -1.645 25153 7935 1 9 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.837 -0.137 25153 7936 1 9 . 1 1 81 81 ILE H H 81 7.400 7.400 7.830 -0.430 25153 7937 1 9 . 1 1 82 82 VAL N N 82 127.840 127.840 125.829 2.011 25153 7938 1 9 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.002 0.260 25153 7939 1 9 . 1 1 82 82 VAL C C 82 172.724 172.724 174.268 -1.544 25153 7940 1 9 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.200 0.210 25153 7941 1 9 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.139 0.261 25153 7942 1 9 . 1 1 82 82 VAL H H 82 8.790 8.790 8.777 0.013 25153 7943 1 9 . 1 1 83 83 ALA N N 83 131.347 131.347 130.200 1.147 25153 7944 1 9 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.255 0.127 25153 7945 1 9 . 1 1 83 83 ALA C C 83 175.750 175.750 176.330 -0.580 25153 7946 1 9 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.055 -0.185 25153 7947 1 9 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.159 2.291 25153 7948 1 9 . 1 1 83 83 ALA H H 83 9.300 9.300 8.863 0.437 25153 7949 1 9 . 1 1 84 84 LEU N N 84 124.200 124.200 126.437 -2.237 25153 7950 1 9 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.671 -0.151 25153 7951 1 9 . 1 1 84 84 LEU C C 84 175.760 175.760 176.787 -1.027 25153 7952 1 9 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.758 -0.258 25153 7953 1 9 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.347 1.553 25153 7954 1 9 . 1 1 84 84 LEU H H 84 10.287 10.287 8.909 1.378 25153 7955 1 9 . 1 1 85 85 TYR N N 85 115.912 115.912 118.998 -3.086 25153 7956 1 9 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.317 -0.357 25153 7957 1 9 . 1 1 85 85 TYR C C 85 172.372 172.372 173.725 -1.353 25153 7958 1 9 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.118 0.982 25153 7959 1 9 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.442 1.588 25153 7960 1 9 . 1 1 85 85 TYR H H 85 9.257 9.257 8.700 0.557 25153 7961 1 9 . 1 1 86 86 GLY N N 86 107.800 107.800 105.491 2.309 25153 7962 1 9 . 1 1 86 86 GLY C C 86 170.330 170.330 171.491 -1.161 25153 7963 1 9 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.595 -0.225 25153 7964 1 9 . 1 1 86 86 GLY H H 86 9.027 9.027 8.604 0.423 25153 7965 1 9 . 1 1 87 87 LEU N N 87 123.458 123.458 118.682 4.776 25153 7966 1 9 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.276 0.189 25153 7967 1 9 . 1 1 87 87 LEU C C 87 178.100 178.100 175.760 2.340 25153 7968 1 9 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.954 0.636 25153 7969 1 9 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.508 -0.168 25153 7970 1 9 . 1 1 87 87 LEU H H 87 6.580 6.580 7.717 -1.137 25153 7971 1 9 . 1 1 88 88 GLY N N 88 108.966 108.966 107.937 1.029 25153 7972 1 9 . 1 1 88 88 GLY C C 88 172.820 172.820 171.724 1.096 25153 7973 1 9 . 1 1 88 88 GLY CA C 88 46.660 46.660 44.795 1.865 25153 7974 1 9 . 1 1 88 88 GLY H H 88 8.070 8.070 8.336 -0.266 25153 7975 1 9 . 1 1 89 89 ASP N N 89 121.150 121.150 119.515 1.635 25153 7976 1 9 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.533 -0.287 25153 7977 1 9 . 1 1 89 89 ASP C C 89 176.220 176.220 177.075 -0.855 25153 7978 1 9 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.530 -0.060 25153 7979 1 9 . 1 1 89 89 ASP CB C 89 42.480 42.480 42.419 0.061 25153 7980 1 9 . 1 1 90 90 GLN N N 90 123.970 123.970 125.974 -2.004 25153 7981 1 9 . 1 1 90 90 GLN HA H 90 3.488 3.488 3.927 -0.439 25153 7982 1 9 . 1 1 90 90 GLN C C 90 173.646 173.646 176.679 -3.033 25153 7983 1 9 . 1 1 90 90 GLN CA C 90 58.310 58.310 58.148 0.162 25153 7984 1 9 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.945 -0.735 25153 7985 1 9 . 1 1 90 90 GLN H H 90 8.623 8.623 9.386 -0.763 25153 7986 1 9 . 1 1 91 91 LEU N N 91 118.017 118.017 118.900 -0.883 25153 7987 1 9 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.142 0.233 25153 7988 1 9 . 1 1 91 91 LEU C C 91 180.160 180.160 178.725 1.435 25153 7989 1 9 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.287 -0.227 25153 7990 1 9 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.852 -0.302 25153 7991 1 9 . 1 1 91 91 LEU H H 91 7.046 7.046 7.927 -0.881 25153 7992 1 9 . 1 1 92 92 GLY N N 92 110.028 110.028 105.139 4.889 25153 7993 1 9 . 1 1 92 92 GLY C C 92 174.912 174.912 174.989 -0.077 25153 7994 1 9 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.668 0.512 25153 7995 1 9 . 1 1 92 92 GLY H H 92 9.238 9.238 8.761 0.477 25153 7996 1 9 . 1 1 93 93 TYR N N 93 115.910 115.910 119.014 -3.104 25153 7997 1 9 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.367 -0.358 25153 7998 1 9 . 1 1 93 93 TYR C C 93 176.850 176.850 176.500 0.350 25153 7999 1 9 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.486 0.243 25153 8000 1 9 . 1 1 93 93 TYR CB C 93 38.130 38.130 39.053 -0.923 25153 8001 1 9 . 1 1 93 93 TYR H H 93 6.962 6.962 8.111 -1.149 25153 8002 1 9 . 1 1 94 94 GLY N N 94 111.630 111.630 109.720 1.910 25153 8003 1 9 . 1 1 94 94 GLY C C 94 177.777 177.777 174.991 2.786 25153 8004 1 9 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.263 2.767 25153 8005 1 9 . 1 1 94 94 GLY H H 94 7.835 7.835 7.950 -0.115 25153 8006 1 9 . 1 1 95 95 GLU N N 95 122.450 122.450 119.352 3.098 25153 8007 1 9 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.871 0.047 25153 8008 1 9 . 1 1 95 95 GLU C C 95 175.300 175.300 177.687 -2.387 25153 8009 1 9 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.749 -0.649 25153 8010 1 9 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.249 -0.738 25153 8011 1 9 . 1 1 96 96 TRP N N 96 118.790 118.790 117.995 0.795 25153 8012 1 9 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.891 0.553 25153 8013 1 9 . 1 1 96 96 TRP C C 96 179.280 179.280 178.277 1.003 25153 8014 1 9 . 1 1 96 96 TRP CA C 96 57.015 57.015 57.597 -0.582 25153 8015 1 9 . 1 1 96 96 TRP CB C 96 30.020 30.020 31.754 -1.734 25153 8016 1 9 . 1 1 96 96 TRP H H 96 8.070 8.070 8.003 0.067 25153 8017 1 9 . 1 1 97 97 PHE N N 97 128.067 128.067 119.722 8.345 25153 8018 1 9 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.166 1.139 25153 8019 1 9 . 1 1 97 97 PHE C C 97 173.227 173.227 176.387 -3.160 25153 8020 1 9 . 1 1 97 97 PHE CA C 97 56.720 56.720 60.526 -3.806 25153 8021 1 9 . 1 1 97 97 PHE CB C 97 39.940 39.940 37.788 2.152 25153 8022 1 9 . 1 1 97 97 PHE H H 97 7.165 7.165 9.327 -2.162 25153 8023 1 9 . 1 1 98 98 LEU N N 98 114.306 114.306 121.550 -7.244 25153 8024 1 9 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.957 -0.467 25153 8025 1 9 . 1 1 98 98 LEU C C 98 179.365 179.365 177.610 1.755 25153 8026 1 9 . 1 1 98 98 LEU CA C 98 55.460 55.460 54.920 0.540 25153 8027 1 9 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.236 -0.006 25153 8028 1 9 . 1 1 98 98 LEU H H 98 7.453 7.453 7.938 -0.485 25153 8029 1 9 . 1 1 99 99 ASP N N 99 122.354 122.354 122.229 0.125 25153 8030 1 9 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.319 -0.386 25153 8031 1 9 . 1 1 99 99 ASP C C 99 178.800 178.800 177.578 1.222 25153 8032 1 9 . 1 1 99 99 ASP CA C 99 59.180 59.180 58.136 1.044 25153 8033 1 9 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.582 -1.152 25153 8034 1 9 . 1 1 100 100 ALA N N 100 118.568 118.568 121.727 -3.159 25153 8035 1 9 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.022 -0.182 25153 8036 1 9 . 1 1 100 100 ALA C C 100 178.500 178.500 179.304 -0.804 25153 8037 1 9 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.001 -0.085 25153 8038 1 9 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.440 1.220 25153 8039 1 9 . 1 1 100 100 ALA H H 100 8.682 8.682 8.058 0.624 25153 8040 1 9 . 1 1 101 101 LEU N N 101 118.815 118.815 120.574 -1.759 25153 8041 1 9 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.996 -0.316 25153 8042 1 9 . 1 1 101 101 LEU C C 101 178.930 178.930 178.813 0.117 25153 8043 1 9 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.760 -0.060 25153 8044 1 9 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.529 0.871 25153 8045 1 9 . 1 1 101 101 LEU H H 101 6.637 6.637 7.610 -0.973 25153 8046 1 9 . 1 1 102 102 GLY N N 102 103.700 103.700 106.617 -2.917 25153 8047 1 9 . 1 1 102 102 GLY C C 102 175.530 175.530 176.210 -0.680 25153 8048 1 9 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.291 0.709 25153 8049 1 9 . 1 1 102 102 GLY H H 102 7.330 7.330 7.761 -0.431 25153 8050 1 9 . 1 1 103 103 MET N N 103 120.330 120.330 121.616 -1.286 25153 8051 1 9 . 1 1 103 103 MET HA H 103 4.254 4.254 4.227 0.027 25153 8052 1 9 . 1 1 103 103 MET C C 103 179.688 179.688 178.596 1.092 25153 8053 1 9 . 1 1 103 103 MET CA C 103 59.615 59.615 59.448 0.167 25153 8054 1 9 . 1 1 103 103 MET CB C 103 33.290 33.290 32.686 0.604 25153 8055 1 9 . 1 1 103 103 MET H H 103 8.407 8.407 8.194 0.213 25153 8056 1 9 . 1 1 104 104 LEU N N 104 123.450 123.450 119.973 3.477 25153 8057 1 9 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.990 0.206 25153 8058 1 9 . 1 1 104 104 LEU C C 104 177.620 177.620 178.506 -0.886 25153 8059 1 9 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.667 0.303 25153 8060 1 9 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.200 0.100 25153 8061 1 9 . 1 1 104 104 LEU H H 104 8.330 8.330 8.720 -0.390 25153 8062 1 9 . 1 1 105 105 HIS N N 105 119.040 119.040 119.459 -0.419 25153 8063 1 9 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.034 -0.157 25153 8064 1 9 . 1 1 105 105 HIS C C 105 177.100 177.100 177.022 0.078 25153 8065 1 9 . 1 1 105 105 HIS CA C 105 60.970 60.970 61.271 -0.301 25153 8066 1 9 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.840 -1.247 25153 8067 1 9 . 1 1 105 105 HIS H H 105 8.050 8.050 8.465 -0.415 25153 8068 1 9 . 1 1 106 106 ASP N N 106 119.950 119.950 118.826 1.124 25153 8069 1 9 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.414 -0.084 25153 8070 1 9 . 1 1 106 106 ASP C C 106 179.300 179.300 178.433 0.867 25153 8071 1 9 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.239 0.571 25153 8072 1 9 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.175 -0.774 25153 8073 1 9 . 1 1 107 107 LYS N N 107 122.060 122.060 120.186 1.874 25153 8074 1 9 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.107 0.026 25153 8075 1 9 . 1 1 107 107 LYS C C 107 178.100 178.100 179.423 -1.323 25153 8076 1 9 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.731 -0.531 25153 8077 1 9 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.220 0.140 25153 8078 1 9 . 1 1 108 108 LEU N N 108 115.610 115.610 118.241 -2.631 25153 8079 1 9 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.063 0.005 25153 8080 1 9 . 1 1 108 108 LEU C C 108 178.866 178.866 178.412 0.454 25153 8081 1 9 . 1 1 108 108 LEU CA C 108 55.954 55.954 57.084 -1.130 25153 8082 1 9 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.455 0.705 25153 8083 1 9 . 1 1 108 108 LEU H H 108 7.828 7.828 8.413 -0.585 25153 8084 1 9 . 1 1 109 109 SER N N 109 116.362 116.362 115.153 1.209 25153 8085 1 9 . 1 1 109 109 SER HA H 109 4.299 4.299 4.333 -0.034 25153 8086 1 9 . 1 1 109 109 SER C C 109 175.660 175.660 176.864 -1.204 25153 8087 1 9 . 1 1 109 109 SER CA C 109 62.350 62.350 61.306 1.044 25153 8088 1 9 . 1 1 109 109 SER CB C 109 62.815 62.815 63.055 -0.240 25153 8089 1 9 . 1 1 109 109 SER H H 109 8.278 8.278 8.518 -0.240 25153 8090 1 9 . 1 1 110 110 THR N N 110 110.230 110.230 115.451 -5.221 25153 8091 1 9 . 1 1 110 110 THR HA H 110 4.615 4.615 4.249 0.366 25153 8092 1 9 . 1 1 110 110 THR C C 110 175.990 175.990 175.541 0.449 25153 8093 1 9 . 1 1 110 110 THR CA C 110 62.090 62.090 64.288 -2.198 25153 8094 1 9 . 1 1 110 110 THR CB C 110 68.800 68.800 68.534 0.267 25153 8095 1 9 . 1 1 110 110 THR H H 110 7.211 7.211 8.005 -0.794 25153 8096 1 9 . 1 1 111 111 LYS N N 111 119.900 119.900 119.799 0.101 25153 8097 1 9 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.371 0.141 25153 8098 1 9 . 1 1 111 111 LYS C C 111 176.916 176.916 176.512 0.404 25153 8099 1 9 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.313 0.341 25153 8100 1 9 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.098 -1.255 25153 8101 1 9 . 1 1 112 112 GLY N N 112 107.910 107.910 108.116 -0.206 25153 8102 1 9 . 1 1 112 112 GLY C C 112 176.250 176.250 174.082 2.168 25153 8103 1 9 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.652 1.388 25153 8104 1 9 . 1 1 112 112 GLY H H 112 8.366 8.366 7.673 0.693 25153 8105 1 9 . 1 1 113 113 VAL N N 113 113.530 113.530 116.143 -2.613 25153 8106 1 9 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.484 -0.010 25153 8107 1 9 . 1 1 113 113 VAL C C 113 174.630 174.630 174.775 -0.145 25153 8108 1 9 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.777 -1.327 25153 8109 1 9 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.138 -0.588 25153 8110 1 9 . 1 1 113 113 VAL H H 113 6.903 6.903 6.988 -0.085 25153 8111 1 9 . 1 1 114 114 LYS N N 114 123.020 123.020 118.992 4.028 25153 8112 1 9 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.587 -0.082 25153 8113 1 9 . 1 1 114 114 LYS C C 114 175.000 175.000 174.875 0.125 25153 8114 1 9 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.499 -0.299 25153 8115 1 9 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.757 -1.417 25153 8116 1 9 . 1 1 115 115 PHE N N 115 123.290 123.290 120.058 3.232 25153 8117 1 9 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.719 -0.006 25153 8118 1 9 . 1 1 115 115 PHE C C 115 177.605 177.605 175.980 1.625 25153 8119 1 9 . 1 1 115 115 PHE CA C 115 58.610 58.610 57.105 1.505 25153 8120 1 9 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.995 -0.995 25153 8121 1 9 . 1 1 115 115 PHE H H 115 8.494 8.494 8.719 -0.225 25153 8122 1 9 . 1 1 116 116 VAL N N 116 115.790 115.790 113.840 1.950 25153 8123 1 9 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.693 -0.201 25153 8124 1 9 . 1 1 116 116 VAL C C 116 175.414 175.414 176.086 -0.672 25153 8125 1 9 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.312 -0.326 25153 8126 1 9 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.728 -0.629 25153 8127 1 9 . 1 1 116 116 VAL H H 116 8.889 8.889 8.302 0.587 25153 8128 1 9 . 1 1 117 117 GLY N N 117 108.300 108.300 107.312 0.988 25153 8129 1 9 . 1 1 117 117 GLY C C 117 176.180 176.180 174.703 1.477 25153 8130 1 9 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.456 2.344 25153 8131 1 9 . 1 1 117 117 GLY H H 117 9.810 9.810 8.633 1.177 25153 8132 1 9 . 1 1 118 118 TYR N N 118 120.050 120.050 119.907 0.143 25153 8133 1 9 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.649 0.305 25153 8134 1 9 . 1 1 118 118 TYR C C 118 177.450 177.450 175.802 1.648 25153 8135 1 9 . 1 1 118 118 TYR CA C 118 56.240 56.240 59.741 -3.501 25153 8136 1 9 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.488 -3.378 25153 8137 1 9 . 1 1 118 118 TYR H H 118 8.592 8.592 7.585 1.007 25153 8138 1 9 . 1 1 119 119 TRP N N 119 125.500 125.500 120.345 5.155 25153 8139 1 9 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.196 0.832 25153 8140 1 9 . 1 1 119 119 TRP C C 119 173.090 173.090 174.000 -0.910 25153 8141 1 9 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.555 -0.655 25153 8142 1 9 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.892 2.358 25153 8143 1 9 . 1 1 119 119 TRP H H 119 7.926 7.926 8.275 -0.349 25153 8144 1 9 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.759 0.051 25153 8145 1 9 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.819 0.861 25153 8146 1 9 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.600 -0.350 25153 8147 1 9 . 1 1 121 121 THR N N 121 109.114 109.114 111.056 -1.942 25153 8148 1 9 . 1 1 121 121 THR HA H 121 4.142 4.142 3.542 0.600 25153 8149 1 9 . 1 1 121 121 THR C C 121 176.300 176.300 175.079 1.221 25153 8150 1 9 . 1 1 121 121 THR CA C 121 61.230 61.230 61.812 -0.582 25153 8151 1 9 . 1 1 121 121 THR CB C 121 69.890 69.890 68.424 1.466 25153 8152 1 9 . 1 1 121 121 THR H H 121 7.356 7.356 8.293 -0.937 25153 8153 1 9 . 1 1 122 122 GLU N N 122 123.980 123.980 121.794 2.186 25153 8154 1 9 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.051 0.187 25153 8155 1 9 . 1 1 122 122 GLU C C 122 177.830 177.830 177.841 -0.011 25153 8156 1 9 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.400 0.830 25153 8157 1 9 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.931 -0.161 25153 8158 1 9 . 1 1 123 123 GLY N N 123 114.570 114.570 112.991 1.579 25153 8159 1 9 . 1 1 123 123 GLY C C 123 173.700 173.700 173.371 0.329 25153 8160 1 9 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.888 -0.488 25153 8161 1 9 . 1 1 123 123 GLY H H 123 9.181 9.181 8.838 0.343 25153 8162 1 9 . 1 1 124 124 TYR N N 124 118.923 118.923 118.997 -0.074 25153 8163 1 9 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.914 0.396 25153 8164 1 9 . 1 1 124 124 TYR C C 124 175.680 175.680 174.208 1.472 25153 8165 1 9 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.339 -0.869 25153 8166 1 9 . 1 1 124 124 TYR CB C 124 41.000 41.000 42.984 -1.984 25153 8167 1 9 . 1 1 124 124 TYR H H 124 7.877 7.877 7.551 0.326 25153 8168 1 9 . 1 1 125 125 GLU N N 125 124.890 124.890 122.338 2.552 25153 8169 1 9 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.707 -0.007 25153 8170 1 9 . 1 1 125 125 GLU C C 125 172.880 172.880 175.074 -2.194 25153 8171 1 9 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.428 0.002 25153 8172 1 9 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.895 -0.475 25153 8173 1 9 . 1 1 126 126 PHE N N 126 119.166 119.166 119.214 -0.048 25153 8174 1 9 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.551 0.258 25153 8175 1 9 . 1 1 126 126 PHE C C 126 173.750 173.750 174.385 -0.635 25153 8176 1 9 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.028 -1.238 25153 8177 1 9 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.085 0.965 25153 8178 1 9 . 1 1 126 126 PHE H H 126 7.716 7.716 7.928 -0.212 25153 8179 1 9 . 1 1 127 127 THR N N 127 106.800 106.800 114.847 -8.047 25153 8180 1 9 . 1 1 127 127 THR HA H 127 4.400 4.400 3.391 1.009 25153 8181 1 9 . 1 1 127 127 THR C C 127 175.300 175.300 174.112 1.188 25153 8182 1 9 . 1 1 127 127 THR CA C 127 61.100 61.100 62.644 -1.544 25153 8183 1 9 . 1 1 127 127 THR CB C 127 70.600 70.600 67.858 2.742 25153 8184 1 9 . 1 1 127 127 THR H H 127 7.220 7.220 6.438 0.782 25153 8185 1 9 . 1 1 128 128 SER N N 128 118.360 118.360 115.328 3.032 25153 8186 1 9 . 1 1 128 128 SER HA H 128 4.680 4.680 4.474 0.206 25153 8187 1 9 . 1 1 128 128 SER C C 128 175.720 175.720 174.397 1.323 25153 8188 1 9 . 1 1 128 128 SER CA C 128 56.250 56.250 56.746 -0.496 25153 8189 1 9 . 1 1 128 128 SER CB C 128 65.635 65.635 64.387 1.248 25153 8190 1 9 . 1 1 128 128 SER H H 128 7.411 7.411 8.135 -0.724 25153 8191 1 9 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.679 0.096 25153 8192 1 9 . 1 1 129 129 PRO CA C 129 62.500 62.500 63.857 -1.357 25153 8193 1 9 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.339 0.061 25153 8194 1 9 . 1 1 130 130 LYS N N 130 122.014 122.014 120.454 1.560 25153 8195 1 9 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.366 -0.133 25153 8196 1 9 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.462 3.238 25153 8197 1 9 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.099 -0.529 25153 8198 1 9 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.611 -0.093 25153 8199 1 9 . 1 1 131 131 PRO C C 131 174.000 174.000 175.279 -1.279 25153 8200 1 9 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.254 2.446 25153 8201 1 9 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.311 0.889 25153 8202 1 9 . 1 1 132 132 VAL N N 132 113.260 113.260 117.552 -4.292 25153 8203 1 9 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.945 0.255 25153 8204 1 9 . 1 1 132 132 VAL C C 132 175.210 175.210 175.010 0.200 25153 8205 1 9 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.399 -0.779 25153 8206 1 9 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.135 -1.155 25153 8207 1 9 . 1 1 132 132 VAL H H 132 6.697 6.697 7.642 -0.945 25153 8208 1 9 . 1 1 133 133 ILE N N 133 119.940 119.940 118.208 1.732 25153 8209 1 9 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.551 -0.171 25153 8210 1 9 . 1 1 133 133 ILE C C 133 175.440 175.440 175.390 0.050 25153 8211 1 9 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.944 1.506 25153 8212 1 9 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.380 1.720 25153 8213 1 9 . 1 1 133 133 ILE H H 133 8.756 8.756 8.812 -0.056 25153 8214 1 9 . 1 1 134 134 ALA N N 134 122.632 122.632 123.901 -1.269 25153 8215 1 9 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.898 0.062 25153 8216 1 9 . 1 1 134 134 ALA C C 134 178.312 178.312 177.231 1.081 25153 8217 1 9 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.609 -1.529 25153 8218 1 9 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.253 -0.417 25153 8219 1 9 . 1 1 134 134 ALA H H 134 8.523 8.523 8.514 0.009 25153 8220 1 9 . 1 1 135 135 ASP N N 135 117.366 117.366 122.728 -5.362 25153 8221 1 9 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.676 -0.424 25153 8222 1 9 . 1 1 135 135 ASP C C 135 176.387 176.387 176.638 -0.251 25153 8223 1 9 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.360 1.850 25153 8224 1 9 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.258 -1.558 25153 8225 1 9 . 1 1 136 136 GLY N N 136 104.310 104.310 108.079 -3.769 25153 8226 1 9 . 1 1 136 136 GLY C C 136 174.922 174.922 174.924 -0.002 25153 8227 1 9 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.424 -0.324 25153 8228 1 9 . 1 1 136 136 GLY H H 136 7.610 7.610 8.340 -0.730 25153 8229 1 9 . 1 1 137 137 GLN N N 137 118.784 118.784 117.652 1.132 25153 8230 1 9 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.444 -0.389 25153 8231 1 9 . 1 1 137 137 GLN C C 137 176.390 176.390 175.498 0.892 25153 8232 1 9 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.853 1.787 25153 8233 1 9 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.270 -0.041 25153 8234 1 9 . 1 1 137 137 GLN H H 137 7.870 7.870 7.863 0.007 25153 8235 1 9 . 1 1 138 138 LEU N N 138 118.040 118.040 116.041 1.999 25153 8236 1 9 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.077 -0.090 25153 8237 1 9 . 1 1 138 138 LEU C C 138 175.913 175.913 175.321 0.592 25153 8238 1 9 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.243 0.357 25153 8239 1 9 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.923 1.477 25153 8240 1 9 . 1 1 138 138 LEU H H 138 7.356 7.356 7.266 0.090 25153 8241 1 9 . 1 1 139 139 PHE N N 139 119.060 119.060 119.061 -0.001 25153 8242 1 9 . 1 1 139 139 PHE HA H 139 5.310 5.310 5.031 0.279 25153 8243 1 9 . 1 1 139 139 PHE C C 139 178.780 178.780 178.176 0.604 25153 8244 1 9 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.606 -0.756 25153 8245 1 9 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.686 3.774 25153 8246 1 9 . 1 1 139 139 PHE H H 139 10.094 10.094 9.043 1.051 25153 8247 1 9 . 1 1 140 140 VAL N N 140 109.690 109.690 116.232 -6.542 25153 8248 1 9 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.821 -0.340 25153 8249 1 9 . 1 1 140 140 VAL C C 140 172.790 172.790 175.621 -2.831 25153 8250 1 9 . 1 1 140 140 VAL CA C 140 62.000 62.000 64.257 -2.257 25153 8251 1 9 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.640 -1.090 25153 8252 1 9 . 1 1 140 140 VAL H H 140 7.470 7.470 8.170 -0.700 25153 8253 1 9 . 1 1 141 141 GLY N N 141 107.060 107.060 105.300 1.760 25153 8254 1 9 . 1 1 141 141 GLY C C 141 171.513 171.513 172.631 -1.118 25153 8255 1 9 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.077 1.353 25153 8256 1 9 . 1 1 141 141 GLY H H 141 7.137 7.137 7.361 -0.224 25153 8257 1 9 . 1 1 142 142 LEU N N 142 117.863 117.863 120.474 -2.611 25153 8258 1 9 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.017 -1.042 25153 8259 1 9 . 1 1 142 142 LEU C C 142 173.640 173.640 175.241 -1.601 25153 8260 1 9 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.928 0.992 25153 8261 1 9 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.105 -4.554 25153 8262 1 9 . 1 1 142 142 LEU H H 142 7.517 7.517 7.676 -0.159 25153 8263 1 9 . 1 1 143 143 ALA N N 143 126.990 126.990 128.542 -1.552 25153 8264 1 9 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.336 -0.059 25153 8265 1 9 . 1 1 143 143 ALA C C 143 175.730 175.730 176.212 -0.482 25153 8266 1 9 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.346 -0.906 25153 8267 1 9 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.377 3.933 25153 8268 1 9 . 1 1 143 143 ALA H H 143 5.186 5.186 8.185 -2.999 25153 8269 1 9 . 1 1 144 144 LEU N N 144 125.477 125.477 124.292 1.185 25153 8270 1 9 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.892 -0.112 25153 8271 1 9 . 1 1 144 144 LEU C C 144 174.473 174.473 175.356 -0.883 25153 8272 1 9 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.660 -0.419 25153 8273 1 9 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.618 -0.318 25153 8274 1 9 . 1 1 144 144 LEU H H 144 8.758 8.758 8.152 0.606 25153 8275 1 9 . 1 1 145 145 ASP N N 145 118.915 118.915 120.189 -1.274 25153 8276 1 9 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.387 0.145 25153 8277 1 9 . 1 1 145 145 ASP C C 145 176.470 176.470 175.691 0.779 25153 8278 1 9 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.669 -0.039 25153 8279 1 9 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.106 -1.107 25153 8280 1 9 . 1 1 146 146 GLU N N 146 124.813 124.813 124.277 0.536 25153 8281 1 9 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.630 -0.254 25153 8282 1 9 . 1 1 146 146 GLU C C 146 177.290 177.290 176.503 0.787 25153 8283 1 9 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.899 0.221 25153 8284 1 9 . 1 1 146 146 GLU CB C 146 30.150 30.150 30.087 0.063 25153 8285 1 9 . 1 1 147 147 THR N N 147 118.328 118.328 115.250 3.078 25153 8286 1 9 . 1 1 147 147 THR HA H 147 4.200 4.200 4.463 -0.263 25153 8287 1 9 . 1 1 147 147 THR C C 147 175.683 175.683 175.346 0.337 25153 8288 1 9 . 1 1 147 147 THR CA C 147 66.250 66.250 64.030 2.220 25153 8289 1 9 . 1 1 147 147 THR CB C 147 69.600 69.600 69.386 0.214 25153 8290 1 9 . 1 1 147 147 THR H H 147 8.562 8.562 8.521 0.041 25153 8291 1 9 . 1 1 148 148 ASN N N 148 115.550 115.550 117.817 -2.267 25153 8292 1 9 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.848 0.139 25153 8293 1 9 . 1 1 148 148 ASN C C 148 175.870 175.870 176.275 -0.405 25153 8294 1 9 . 1 1 148 148 ASN CA C 148 53.700 53.700 53.681 0.019 25153 8295 1 9 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.777 2.103 25153 8296 1 9 . 1 1 148 148 ASN H H 148 9.118 9.118 9.055 0.063 25153 8297 1 9 . 1 1 149 149 GLN N N 149 117.400 117.400 119.581 -2.181 25153 8298 1 9 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.267 0.576 25153 8299 1 9 . 1 1 149 149 GLN C C 149 177.780 177.780 176.662 1.118 25153 8300 1 9 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.858 -1.958 25153 8301 1 9 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.193 1.107 25153 8302 1 9 . 1 1 149 149 GLN H H 149 7.555 7.555 8.828 -1.273 25153 8303 1 9 . 1 1 150 150 TYR N N 150 120.674 120.674 117.718 2.956 25153 8304 1 9 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.558 -0.030 25153 8305 1 9 . 1 1 150 150 TYR C C 150 177.830 177.830 176.175 1.655 25153 8306 1 9 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.552 -0.065 25153 8307 1 9 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.889 -0.289 25153 8308 1 9 . 1 1 150 150 TYR H H 150 6.983 6.983 7.798 -0.815 25153 8309 1 9 . 1 1 151 151 ASP N N 151 120.810 120.810 119.278 1.532 25153 8310 1 9 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.710 -0.195 25153 8311 1 9 . 1 1 151 151 ASP C C 151 176.400 176.400 177.200 -0.800 25153 8312 1 9 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.556 -0.156 25153 8313 1 9 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.508 -2.428 25153 8314 1 9 . 1 1 152 152 LEU N N 152 118.083 118.083 118.098 -0.015 25153 8315 1 9 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.544 0.132 25153 8316 1 9 . 1 1 152 152 LEU C C 152 178.470 178.470 178.186 0.284 25153 8317 1 9 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.300 -0.700 25153 8318 1 9 . 1 1 152 152 LEU CB C 152 42.600 42.600 42.929 -0.329 25153 8319 1 9 . 1 1 152 152 LEU H H 152 7.453 7.453 7.783 -0.330 25153 8320 1 9 . 1 1 153 153 SER N N 153 116.407 116.407 116.793 -0.386 25153 8321 1 9 . 1 1 153 153 SER HA H 153 3.960 3.960 4.037 -0.077 25153 8322 1 9 . 1 1 153 153 SER C C 153 174.590 174.590 176.036 -1.446 25153 8323 1 9 . 1 1 153 153 SER CA C 153 63.400 63.400 61.789 1.611 25153 8324 1 9 . 1 1 153 153 SER CB C 153 63.100 63.100 62.865 0.234 25153 8325 1 9 . 1 1 153 153 SER H H 153 7.360 7.360 8.749 -1.389 25153 8326 1 9 . 1 1 154 154 ASP N N 154 121.960 121.960 120.957 1.003 25153 8327 1 9 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.350 -0.040 25153 8328 1 9 . 1 1 154 154 ASP C C 154 178.640 178.640 177.734 0.906 25153 8329 1 9 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.408 1.592 25153 8330 1 9 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.990 -1.420 25153 8331 1 9 . 1 1 155 155 GLU N N 155 121.310 121.310 118.456 2.854 25153 8332 1 9 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.111 0.074 25153 8333 1 9 . 1 1 155 155 GLU C C 155 179.600 179.600 179.089 0.511 25153 8334 1 9 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.998 0.452 25153 8335 1 9 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.403 -0.003 25153 8336 1 9 . 1 1 156 156 ARG N N 156 121.394 121.394 119.423 1.971 25153 8337 1 9 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.459 -0.159 25153 8338 1 9 . 1 1 156 156 ARG C C 156 177.330 177.330 179.062 -1.732 25153 8339 1 9 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.783 1.677 25153 8340 1 9 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.554 0.206 25153 8341 1 9 . 1 1 157 157 ILE N N 157 118.390 118.390 121.223 -2.833 25153 8342 1 9 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.752 -0.318 25153 8343 1 9 . 1 1 157 157 ILE C C 157 178.814 178.814 177.907 0.907 25153 8344 1 9 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.066 0.628 25153 8345 1 9 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.880 0.973 25153 8346 1 9 . 1 1 157 157 ILE H H 157 8.966 8.966 7.838 1.128 25153 8347 1 9 . 1 1 158 158 GLN N N 158 120.060 120.060 119.098 0.962 25153 8348 1 9 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.991 -0.035 25153 8349 1 9 . 1 1 158 158 GLN C C 158 178.843 178.843 178.420 0.423 25153 8350 1 9 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.179 1.421 25153 8351 1 9 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.274 0.116 25153 8352 1 9 . 1 1 158 158 GLN H H 158 8.394 8.394 7.890 0.504 25153 8353 1 9 . 1 1 159 159 SER N N 159 115.613 115.613 115.508 0.105 25153 8354 1 9 . 1 1 159 159 SER HA H 159 4.455 4.455 4.504 -0.049 25153 8355 1 9 . 1 1 159 159 SER C C 159 177.330 177.330 176.746 0.584 25153 8356 1 9 . 1 1 159 159 SER CA C 159 62.400 62.400 60.499 1.901 25153 8357 1 9 . 1 1 159 159 SER CB C 159 63.760 63.760 63.381 0.379 25153 8358 1 9 . 1 1 159 159 SER H H 159 8.460 8.460 7.816 0.644 25153 8359 1 9 . 1 1 160 160 TRP N N 160 126.820 126.820 125.447 1.373 25153 8360 1 9 . 1 1 160 160 TRP HA H 160 4.465 4.465 3.993 0.472 25153 8361 1 9 . 1 1 160 160 TRP C C 160 178.050 178.050 177.738 0.312 25153 8362 1 9 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.956 0.744 25153 8363 1 9 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.384 -0.023 25153 8364 1 9 . 1 1 160 160 TRP H H 160 9.318 9.318 8.341 0.977 25153 8365 1 9 . 1 1 161 161 CYS N N 161 116.750 116.750 117.862 -1.112 25153 8366 1 9 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.734 0.149 25153 8367 1 9 . 1 1 161 161 CYS C C 161 176.270 176.270 176.468 -0.198 25153 8368 1 9 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.623 0.737 25153 8369 1 9 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.795 1.085 25153 8370 1 9 . 1 1 161 161 CYS H H 161 8.950 8.950 8.994 -0.044 25153 8371 1 9 . 1 1 162 162 GLU N N 162 118.096 118.096 120.038 -1.942 25153 8372 1 9 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.023 -0.093 25153 8373 1 9 . 1 1 162 162 GLU C C 162 178.680 178.680 177.539 1.141 25153 8374 1 9 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.108 0.622 25153 8375 1 9 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.319 0.111 25153 8376 1 9 . 1 1 163 163 GLN N N 163 120.790 120.790 117.992 2.798 25153 8377 1 9 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.130 0.047 25153 8378 1 9 . 1 1 163 163 GLN C C 163 179.690 179.690 178.250 1.440 25153 8379 1 9 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.902 1.638 25153 8380 1 9 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.045 -0.045 25153 8381 1 9 . 1 1 163 163 GLN H H 163 8.205 8.205 7.530 0.675 25153 8382 1 9 . 1 1 164 164 ILE N N 164 114.860 114.860 118.764 -3.904 25153 8383 1 9 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.903 0.140 25153 8384 1 9 . 1 1 164 164 ILE C C 164 178.680 178.680 177.340 1.340 25153 8385 1 9 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.017 2.193 25153 8386 1 9 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.606 0.094 25153 8387 1 9 . 1 1 164 164 ILE H H 164 9.005 9.005 8.088 0.917 25153 8388 1 9 . 1 1 165 165 LEU N N 165 123.900 123.900 116.230 7.670 25153 8389 1 9 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.198 -0.048 25153 8390 1 9 . 1 1 165 165 LEU C C 165 180.520 180.520 177.565 2.955 25153 8391 1 9 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.234 1.066 25153 8392 1 9 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.202 -0.152 25153 8393 1 9 . 1 1 165 165 LEU H H 165 7.825 7.825 7.943 -0.118 25153 8394 1 9 . 1 1 166 166 ASN N N 166 120.112 120.112 118.311 1.801 25153 8395 1 9 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.688 -0.105 25153 8396 1 9 . 1 1 166 166 ASN C C 166 178.440 178.440 177.003 1.437 25153 8397 1 9 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.945 0.475 25153 8398 1 9 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.639 -1.219 25153 8399 1 9 . 1 1 166 166 ASN H H 166 7.760 7.760 7.944 -0.184 25153 8400 1 9 . 1 1 167 167 GLU N N 167 121.370 121.370 121.927 -0.557 25153 8401 1 9 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.055 0.048 25153 8402 1 9 . 1 1 167 167 GLU C C 167 180.332 180.332 179.418 0.914 25153 8403 1 9 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.814 0.336 25153 8404 1 9 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.732 1.288 25153 8405 1 9 . 1 1 168 168 MET N N 168 118.532 118.532 117.624 0.908 25153 8406 1 9 . 1 1 168 168 MET HA H 168 4.015 4.015 4.250 -0.235 25153 8407 1 9 . 1 1 168 168 MET C C 168 176.600 176.600 178.106 -1.506 25153 8408 1 9 . 1 1 168 168 MET CA C 168 59.300 59.300 59.483 -0.183 25153 8409 1 9 . 1 1 168 168 MET CB C 168 33.400 33.400 32.709 0.691 25153 8410 1 9 . 1 1 168 168 MET H H 168 8.718 8.718 8.510 0.208 25153 8411 1 9 . 1 1 169 169 ALA N N 169 121.922 121.922 121.404 0.518 25153 8412 1 9 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.150 0.024 25153 8413 1 9 . 1 1 169 169 ALA C C 169 179.410 179.410 179.240 0.170 25153 8414 1 9 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.688 -0.288 25153 8415 1 9 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.442 -0.032 25153 8416 1 9 . 1 1 169 169 ALA H H 169 7.448 7.448 7.814 -0.366 25153 8417 1 9 . 1 1 170 170 GLU N N 170 117.300 117.300 116.082 1.218 25153 8418 1 9 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.131 -0.036 25153 8419 1 9 . 1 1 170 170 GLU C C 170 177.470 177.470 179.639 -2.169 25153 8420 1 9 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.782 -0.832 25153 8421 1 9 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.526 0.249 25153 8422 1 9 . 1 1 171 171 HIS N N 171 117.944 117.944 120.438 -2.494 25153 8423 1 9 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.372 0.128 25153 8424 1 9 . 1 1 171 171 HIS C C 171 175.120 175.120 177.073 -1.953 25153 8425 1 9 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.445 -2.245 25153 8426 1 9 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.107 0.493 25153 8427 1 9 . 1 1 171 171 HIS H H 171 7.788 7.788 7.748 0.040 25153 8428 1 9 . 1 1 172 172 TYR N N 172 120.040 120.040 116.957 3.083 25153 8429 1 9 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.518 0.075 25153 8430 1 9 . 1 1 172 172 TYR C C 172 174.612 174.612 174.911 -0.299 25153 8431 1 9 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.413 -0.433 25153 8432 1 9 . 1 1 172 172 TYR CB C 172 38.980 38.980 39.080 -0.100 25153 8433 1 9 . 1 1 172 172 TYR H H 172 7.820 7.820 7.857 -0.037 25153 8434 1 10 . 1 1 2 2 ASN N N 2 123.320 123.320 119.780 3.540 25153 8435 1 10 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.112 0.096 25153 8436 1 10 . 1 1 2 2 ASN C C 2 174.590 174.590 174.505 0.085 25153 8437 1 10 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.815 0.185 25153 8438 1 10 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.299 -0.329 25153 8439 1 10 . 1 1 2 2 ASN H H 2 9.428 9.428 8.706 0.722 25153 8440 1 10 . 1 1 3 3 MET N N 3 120.920 120.920 118.619 2.301 25153 8441 1 10 . 1 1 3 3 MET HA H 3 5.530 5.530 5.243 0.287 25153 8442 1 10 . 1 1 3 3 MET C C 3 174.400 174.400 174.876 -0.476 25153 8443 1 10 . 1 1 3 3 MET CA C 3 54.643 54.643 54.302 0.341 25153 8444 1 10 . 1 1 3 3 MET CB C 3 34.637 34.637 37.625 -2.988 25153 8445 1 10 . 1 1 3 3 MET H H 3 8.751 8.751 9.135 -0.384 25153 8446 1 10 . 1 1 4 4 GLY N N 4 115.542 115.542 109.204 6.338 25153 8447 1 10 . 1 1 4 4 GLY C C 4 170.413 170.413 172.184 -1.771 25153 8448 1 10 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.747 -0.645 25153 8449 1 10 . 1 1 4 4 GLY H H 4 8.927 8.927 8.817 0.110 25153 8450 1 10 . 1 1 5 5 LEU N N 5 131.030 131.030 128.124 2.906 25153 8451 1 10 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.379 1.023 25153 8452 1 10 . 1 1 5 5 LEU C C 5 175.952 175.952 174.560 1.392 25153 8453 1 10 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.960 0.490 25153 8454 1 10 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.986 2.606 25153 8455 1 10 . 1 1 5 5 LEU H H 5 8.928 8.928 8.625 0.303 25153 8456 1 10 . 1 1 6 6 PHE N N 6 125.790 125.790 125.923 -0.133 25153 8457 1 10 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.818 -0.078 25153 8458 1 10 . 1 1 6 6 PHE C C 6 174.300 174.300 175.778 -1.478 25153 8459 1 10 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.105 -0.785 25153 8460 1 10 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.721 -0.491 25153 8461 1 10 . 1 1 6 6 PHE H H 6 9.237 9.237 9.427 -0.190 25153 8462 1 10 . 1 1 7 7 TYR N N 7 117.289 117.289 116.687 0.602 25153 8463 1 10 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.945 0.020 25153 8464 1 10 . 1 1 7 7 TYR C C 7 171.262 171.262 173.346 -2.084 25153 8465 1 10 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.282 -0.882 25153 8466 1 10 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.996 0.244 25153 8467 1 10 . 1 1 7 7 TYR H H 7 8.125 8.125 8.407 -0.282 25153 8468 1 10 . 1 1 8 8 GLY N N 8 107.420 107.420 106.250 1.170 25153 8469 1 10 . 1 1 8 8 GLY C C 8 172.000 172.000 172.153 -0.153 25153 8470 1 10 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.186 -0.242 25153 8471 1 10 . 1 1 8 8 GLY H H 8 7.031 7.031 8.468 -1.437 25153 8472 1 10 . 1 1 9 9 SER N N 9 118.150 118.150 116.478 1.672 25153 8473 1 10 . 1 1 9 9 SER HA H 9 5.200 5.200 5.079 0.121 25153 8474 1 10 . 1 1 9 9 SER C C 9 175.000 175.000 174.759 0.241 25153 8475 1 10 . 1 1 9 9 SER CA C 9 57.570 57.570 57.336 0.234 25153 8476 1 10 . 1 1 9 9 SER CB C 9 66.700 66.700 65.956 0.744 25153 8477 1 10 . 1 1 9 9 SER H H 9 9.604 9.604 8.256 1.348 25153 8478 1 10 . 1 1 10 10 SER N N 10 131.193 131.193 120.061 11.132 25153 8479 1 10 . 1 1 10 10 SER HA H 10 4.775 4.775 4.390 0.385 25153 8480 1 10 . 1 1 10 10 SER C C 10 175.730 175.730 175.561 0.169 25153 8481 1 10 . 1 1 10 10 SER CA C 10 61.750 61.750 60.676 1.074 25153 8482 1 10 . 1 1 10 10 SER CB C 10 64.400 64.400 63.538 0.862 25153 8483 1 10 . 1 1 10 10 SER H H 10 11.636 11.636 8.815 2.821 25153 8484 1 10 . 1 1 11 11 THR N N 11 115.848 115.848 109.980 5.868 25153 8485 1 10 . 1 1 11 11 THR HA H 11 4.770 4.770 4.242 0.528 25153 8486 1 10 . 1 1 11 11 THR C C 11 173.700 173.700 174.124 -0.424 25153 8487 1 10 . 1 1 11 11 THR CA C 11 60.700 60.700 61.387 -0.687 25153 8488 1 10 . 1 1 11 11 THR CB C 11 67.430 67.430 68.581 -1.151 25153 8489 1 10 . 1 1 11 11 THR H H 11 9.550 9.550 7.952 1.598 25153 8490 1 10 . 1 1 12 12 CYS N N 12 109.780 109.780 116.130 -6.350 25153 8491 1 10 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.096 -0.026 25153 8492 1 10 . 1 1 12 12 CYS C C 12 176.220 176.220 175.482 0.738 25153 8493 1 10 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.138 3.462 25153 8494 1 10 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.862 0.538 25153 8495 1 10 . 1 1 12 12 CYS H H 12 7.437 7.437 7.918 -0.481 25153 8496 1 10 . 1 1 13 13 TYR N N 13 127.830 127.830 119.454 8.376 25153 8497 1 10 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.249 -0.146 25153 8498 1 10 . 1 1 13 13 TYR C C 13 180.880 180.880 178.400 2.480 25153 8499 1 10 . 1 1 13 13 TYR CA C 13 65.100 65.100 60.321 4.779 25153 8500 1 10 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.483 -0.648 25153 8501 1 10 . 1 1 13 13 TYR H H 13 10.886 10.886 7.417 3.469 25153 8502 1 10 . 1 1 14 14 THR N N 14 124.428 124.428 114.393 10.035 25153 8503 1 10 . 1 1 14 14 THR HA H 14 4.160 4.160 4.066 0.094 25153 8504 1 10 . 1 1 14 14 THR C C 14 177.760 177.760 176.472 1.288 25153 8505 1 10 . 1 1 14 14 THR CA C 14 67.823 67.823 66.895 0.928 25153 8506 1 10 . 1 1 14 14 THR CB C 14 68.040 68.040 68.584 -0.544 25153 8507 1 10 . 1 1 14 14 THR H H 14 11.405 11.405 8.525 2.880 25153 8508 1 10 . 1 1 15 15 GLU N N 15 123.050 123.050 122.383 0.667 25153 8509 1 10 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.238 -0.348 25153 8510 1 10 . 1 1 15 15 GLU C C 15 176.392 176.392 178.641 -2.249 25153 8511 1 10 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.625 -0.425 25153 8512 1 10 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.408 1.042 25153 8513 1 10 . 1 1 16 16 MET N N 16 120.173 120.173 118.593 1.580 25153 8514 1 10 . 1 1 16 16 MET HA H 16 4.050 4.050 4.138 -0.088 25153 8515 1 10 . 1 1 16 16 MET C C 16 179.940 179.940 178.675 1.265 25153 8516 1 10 . 1 1 16 16 MET CA C 16 59.240 59.240 59.316 -0.076 25153 8517 1 10 . 1 1 16 16 MET CB C 16 32.970 32.970 32.900 0.070 25153 8518 1 10 . 1 1 16 16 MET H H 16 8.469 8.469 8.271 0.198 25153 8519 1 10 . 1 1 17 17 ALA N N 17 121.930 121.930 121.594 0.336 25153 8520 1 10 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.864 -0.028 25153 8521 1 10 . 1 1 17 17 ALA C C 17 177.900 177.900 178.811 -0.911 25153 8522 1 10 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.097 0.103 25153 8523 1 10 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.151 -0.151 25153 8524 1 10 . 1 1 17 17 ALA H H 17 7.880 7.880 8.287 -0.406 25153 8525 1 10 . 1 1 18 18 ALA N N 18 121.477 121.477 121.435 0.042 25153 8526 1 10 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.822 -0.085 25153 8527 1 10 . 1 1 18 18 ALA C C 18 179.380 179.380 179.529 -0.149 25153 8528 1 10 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.223 -0.223 25153 8529 1 10 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.810 1.020 25153 8530 1 10 . 1 1 18 18 ALA H H 18 7.374 7.374 8.254 -0.880 25153 8531 1 10 . 1 1 19 19 GLU N N 19 116.650 116.650 118.202 -1.552 25153 8532 1 10 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.845 -0.229 25153 8533 1 10 . 1 1 19 19 GLU C C 19 178.479 178.479 179.311 -0.832 25153 8534 1 10 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.585 0.145 25153 8535 1 10 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.377 -0.077 25153 8536 1 10 . 1 1 20 20 LYS N N 20 119.470 119.470 119.788 -0.318 25153 8537 1 10 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.022 0.028 25153 8538 1 10 . 1 1 20 20 LYS C C 20 179.116 179.116 179.064 0.052 25153 8539 1 10 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.449 0.381 25153 8540 1 10 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.433 0.417 25153 8541 1 10 . 1 1 21 21 ILE N N 21 121.030 121.030 120.810 0.220 25153 8542 1 10 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.681 -0.291 25153 8543 1 10 . 1 1 21 21 ILE C C 21 177.580 177.580 178.192 -0.612 25153 8544 1 10 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.799 0.021 25153 8545 1 10 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.915 0.433 25153 8546 1 10 . 1 1 21 21 ILE H H 21 8.100 8.100 8.596 -0.496 25153 8547 1 10 . 1 1 22 22 ARG N N 22 119.720 119.720 119.495 0.225 25153 8548 1 10 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.847 -0.292 25153 8549 1 10 . 1 1 22 22 ARG C C 22 177.320 177.320 178.112 -0.792 25153 8550 1 10 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.724 -0.003 25153 8551 1 10 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.744 -0.812 25153 8552 1 10 . 1 1 23 23 ASP N N 23 118.730 118.730 119.884 -1.154 25153 8553 1 10 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.422 -0.059 25153 8554 1 10 . 1 1 23 23 ASP C C 23 178.330 178.330 178.784 -0.454 25153 8555 1 10 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.255 -0.305 25153 8556 1 10 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.851 -0.611 25153 8557 1 10 . 1 1 24 24 ILE N N 24 121.090 121.090 119.494 1.596 25153 8558 1 10 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.777 0.019 25153 8559 1 10 . 1 1 24 24 ILE C C 24 178.250 178.250 177.937 0.313 25153 8560 1 10 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.833 -0.683 25153 8561 1 10 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.283 0.197 25153 8562 1 10 . 1 1 24 24 ILE H H 24 7.910 7.910 8.187 -0.277 25153 8563 1 10 . 1 1 25 25 ILE N N 25 121.406 121.406 117.261 4.145 25153 8564 1 10 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.870 -0.224 25153 8565 1 10 . 1 1 25 25 ILE C C 25 176.800 176.800 176.769 0.031 25153 8566 1 10 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.030 2.670 25153 8567 1 10 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.937 -0.747 25153 8568 1 10 . 1 1 25 25 ILE H H 25 8.476 8.476 8.063 0.413 25153 8569 1 10 . 1 1 26 26 GLY N N 26 108.900 108.900 105.169 3.731 25153 8570 1 10 . 1 1 26 26 GLY C C 26 173.710 173.710 172.258 1.452 25153 8571 1 10 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.683 -0.353 25153 8572 1 10 . 1 1 26 26 GLY H H 26 8.016 8.016 7.812 0.204 25153 8573 1 10 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.701 -0.363 25153 8574 1 10 . 1 1 27 27 PRO C C 27 177.200 177.200 177.142 0.058 25153 8575 1 10 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.506 1.180 25153 8576 1 10 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.028 0.172 25153 8577 1 10 . 1 1 28 28 GLU N N 28 116.295 116.295 118.235 -1.940 25153 8578 1 10 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.197 0.073 25153 8579 1 10 . 1 1 28 28 GLU C C 28 176.980 176.980 177.159 -0.179 25153 8580 1 10 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.456 -0.716 25153 8581 1 10 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.552 -0.882 25153 8582 1 10 . 1 1 29 29 LEU N N 29 120.250 120.250 112.504 7.746 25153 8583 1 10 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.658 -0.022 25153 8584 1 10 . 1 1 29 29 LEU C C 29 175.770 175.770 175.715 0.055 25153 8585 1 10 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.502 0.298 25153 8586 1 10 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.083 1.017 25153 8587 1 10 . 1 1 29 29 LEU H H 29 7.940 7.940 7.603 0.337 25153 8588 1 10 . 1 1 30 30 VAL N N 30 118.693 118.693 121.089 -2.396 25153 8589 1 10 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.798 -0.150 25153 8590 1 10 . 1 1 30 30 VAL C C 30 174.347 174.347 175.737 -1.390 25153 8591 1 10 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.561 -0.693 25153 8592 1 10 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.144 1.436 25153 8593 1 10 . 1 1 30 30 VAL H H 30 7.434 7.434 8.006 -0.572 25153 8594 1 10 . 1 1 31 31 THR N N 31 123.800 123.800 121.704 2.096 25153 8595 1 10 . 1 1 31 31 THR HA H 31 4.362 4.362 4.526 -0.164 25153 8596 1 10 . 1 1 31 31 THR C C 31 172.964 172.964 173.201 -0.237 25153 8597 1 10 . 1 1 31 31 THR CA C 31 61.720 61.720 60.926 0.794 25153 8598 1 10 . 1 1 31 31 THR CB C 31 70.485 70.485 70.727 -0.242 25153 8599 1 10 . 1 1 31 31 THR H H 31 7.844 7.844 8.142 -0.298 25153 8600 1 10 . 1 1 32 32 LEU N N 32 127.800 127.800 127.027 0.773 25153 8601 1 10 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.600 0.084 25153 8602 1 10 . 1 1 32 32 LEU C C 32 176.600 176.600 176.392 0.208 25153 8603 1 10 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.085 0.070 25153 8604 1 10 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.655 1.195 25153 8605 1 10 . 1 1 32 32 LEU H H 32 8.660 8.660 8.569 0.091 25153 8606 1 10 . 1 1 33 33 HIS N N 33 119.670 119.670 120.102 -0.432 25153 8607 1 10 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.828 -0.428 25153 8608 1 10 . 1 1 33 33 HIS C C 33 171.667 171.667 173.322 -1.655 25153 8609 1 10 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.804 0.396 25153 8610 1 10 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.349 0.851 25153 8611 1 10 . 1 1 33 33 HIS H H 33 9.060 9.060 8.765 0.295 25153 8612 1 10 . 1 1 34 34 ASN N N 34 124.068 124.068 123.127 0.941 25153 8613 1 10 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.038 -0.604 25153 8614 1 10 . 1 1 34 34 ASN C C 34 178.000 178.000 176.008 1.992 25153 8615 1 10 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.950 -0.521 25153 8616 1 10 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.032 -0.472 25153 8617 1 10 . 1 1 34 34 ASN H H 34 8.780 8.780 8.181 0.599 25153 8618 1 10 . 1 1 35 35 LEU N N 35 129.040 129.040 126.397 2.643 25153 8619 1 10 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.173 0.142 25153 8620 1 10 . 1 1 35 35 LEU C C 35 177.700 177.700 177.867 -0.167 25153 8621 1 10 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.390 0.090 25153 8622 1 10 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.805 1.495 25153 8623 1 10 . 1 1 35 35 LEU H H 35 8.821 8.821 8.525 0.296 25153 8624 1 10 . 1 1 36 36 LYS N N 36 121.043 121.043 116.629 4.414 25153 8625 1 10 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.967 -0.087 25153 8626 1 10 . 1 1 36 36 LYS C C 36 176.230 176.230 176.950 -0.720 25153 8627 1 10 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.405 1.015 25153 8628 1 10 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.522 0.748 25153 8629 1 10 . 1 1 37 37 ASP N N 37 114.965 114.965 118.117 -3.152 25153 8630 1 10 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.788 -0.011 25153 8631 1 10 . 1 1 37 37 ASP C C 37 175.440 175.440 175.966 -0.526 25153 8632 1 10 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.510 0.201 25153 8633 1 10 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.511 1.189 25153 8634 1 10 . 1 1 38 38 ASP N N 38 121.650 121.650 121.646 0.004 25153 8635 1 10 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.840 0.030 25153 8636 1 10 . 1 1 38 38 ASP C C 38 174.852 174.852 176.040 -1.188 25153 8637 1 10 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.680 -1.600 25153 8638 1 10 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.283 -0.173 25153 8639 1 10 . 1 1 39 39 SER N N 39 115.207 115.207 117.772 -2.565 25153 8640 1 10 . 1 1 39 39 SER HA H 39 4.585 4.585 4.650 -0.065 25153 8641 1 10 . 1 1 39 39 SER C C 39 175.040 175.040 174.323 0.717 25153 8642 1 10 . 1 1 39 39 SER CA C 39 54.960 54.960 56.582 -1.622 25153 8643 1 10 . 1 1 39 39 SER CB C 39 64.720 64.720 63.471 1.249 25153 8644 1 10 . 1 1 39 39 SER H H 39 8.351 8.351 8.577 -0.226 25153 8645 1 10 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.339 -0.334 25153 8646 1 10 . 1 1 40 40 PRO C C 40 176.730 176.730 177.747 -1.017 25153 8647 1 10 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.933 -0.033 25153 8648 1 10 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.820 -0.420 25153 8649 1 10 . 1 1 41 41 LYS N N 41 121.150 121.150 119.816 1.334 25153 8650 1 10 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.009 -0.097 25153 8651 1 10 . 1 1 41 41 LYS C C 41 179.600 179.600 178.505 1.095 25153 8652 1 10 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.381 -1.181 25153 8653 1 10 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.680 0.320 25153 8654 1 10 . 1 1 42 42 LEU N N 42 118.103 118.103 115.871 2.232 25153 8655 1 10 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.203 -0.166 25153 8656 1 10 . 1 1 42 42 LEU C C 42 178.760 178.760 178.856 -0.096 25153 8657 1 10 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.278 -0.098 25153 8658 1 10 . 1 1 42 42 LEU CB C 42 41.973 41.973 41.033 0.940 25153 8659 1 10 . 1 1 42 42 LEU H H 42 7.600 7.600 7.524 0.076 25153 8660 1 10 . 1 1 43 43 MET N N 43 118.917 118.917 118.253 0.664 25153 8661 1 10 . 1 1 43 43 MET HA H 43 3.750 3.750 4.349 -0.599 25153 8662 1 10 . 1 1 43 43 MET C C 43 177.680 177.680 176.780 0.900 25153 8663 1 10 . 1 1 43 43 MET CA C 43 59.730 59.730 57.935 1.795 25153 8664 1 10 . 1 1 43 43 MET CB C 43 32.700 32.700 32.138 0.562 25153 8665 1 10 . 1 1 43 43 MET H H 43 8.202 8.202 8.022 0.180 25153 8666 1 10 . 1 1 44 44 GLU N N 44 110.924 110.924 116.594 -5.670 25153 8667 1 10 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.242 -0.502 25153 8668 1 10 . 1 1 44 44 GLU C C 44 178.130 178.130 178.852 -0.722 25153 8669 1 10 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.402 0.998 25153 8670 1 10 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.975 -0.425 25153 8671 1 10 . 1 1 45 45 GLN N N 45 115.756 115.756 118.318 -2.562 25153 8672 1 10 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.019 0.164 25153 8673 1 10 . 1 1 45 45 GLN C C 45 175.414 175.414 177.156 -1.742 25153 8674 1 10 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.551 -1.371 25153 8675 1 10 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.072 -0.472 25153 8676 1 10 . 1 1 45 45 GLN H H 45 7.516 7.516 7.524 -0.008 25153 8677 1 10 . 1 1 46 46 TYR N N 46 117.860 117.860 118.678 -0.818 25153 8678 1 10 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.377 0.286 25153 8679 1 10 . 1 1 46 46 TYR C C 46 175.500 175.500 177.078 -1.578 25153 8680 1 10 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.408 -0.922 25153 8681 1 10 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.210 3.260 25153 8682 1 10 . 1 1 46 46 TYR H H 46 6.996 6.996 7.218 -0.222 25153 8683 1 10 . 1 1 47 47 ASP N N 47 121.683 121.683 121.490 0.193 25153 8684 1 10 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.656 0.044 25153 8685 1 10 . 1 1 47 47 ASP C C 47 175.610 175.610 175.177 0.433 25153 8686 1 10 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.051 -0.351 25153 8687 1 10 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.904 1.096 25153 8688 1 10 . 1 1 48 48 VAL N N 48 118.628 118.628 116.341 2.287 25153 8689 1 10 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.784 0.250 25153 8690 1 10 . 1 1 48 48 VAL C C 48 174.190 174.190 174.007 0.183 25153 8691 1 10 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.414 -1.224 25153 8692 1 10 . 1 1 48 48 VAL CB C 48 36.100 36.100 36.294 -0.194 25153 8693 1 10 . 1 1 48 48 VAL H H 48 7.628 7.628 7.393 0.235 25153 8694 1 10 . 1 1 49 49 LEU N N 49 128.190 128.190 123.070 5.120 25153 8695 1 10 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.449 0.154 25153 8696 1 10 . 1 1 49 49 LEU C C 49 174.880 174.880 175.485 -0.605 25153 8697 1 10 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.802 -1.562 25153 8698 1 10 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.387 -1.047 25153 8699 1 10 . 1 1 49 49 LEU H H 49 9.407 9.407 8.951 0.456 25153 8700 1 10 . 1 1 50 50 ILE N N 50 124.550 124.550 121.081 3.469 25153 8701 1 10 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.105 0.595 25153 8702 1 10 . 1 1 50 50 ILE C C 50 175.300 175.300 174.589 0.711 25153 8703 1 10 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.893 -1.029 25153 8704 1 10 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.158 -0.908 25153 8705 1 10 . 1 1 50 50 ILE H H 50 9.238 9.238 9.216 0.022 25153 8706 1 10 . 1 1 51 51 LEU N N 51 127.460 127.460 128.519 -1.059 25153 8707 1 10 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.864 0.321 25153 8708 1 10 . 1 1 51 51 LEU C C 51 174.544 174.544 175.948 -1.404 25153 8709 1 10 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.637 -0.817 25153 8710 1 10 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.836 -2.199 25153 8711 1 10 . 1 1 51 51 LEU H H 51 9.228 9.228 9.121 0.107 25153 8712 1 10 . 1 1 52 52 GLY N N 52 107.760 107.760 112.106 -4.346 25153 8713 1 10 . 1 1 52 52 GLY C C 52 174.710 174.710 172.615 2.095 25153 8714 1 10 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.646 0.224 25153 8715 1 10 . 1 1 52 52 GLY H H 52 8.860 8.860 9.305 -0.445 25153 8716 1 10 . 1 1 53 53 ILE N N 53 123.890 123.890 120.888 3.002 25153 8717 1 10 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.796 0.474 25153 8718 1 10 . 1 1 53 53 ILE C C 53 172.630 172.630 173.080 -0.450 25153 8719 1 10 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.475 0.205 25153 8720 1 10 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.752 4.408 25153 8721 1 10 . 1 1 53 53 ILE H H 53 8.458 8.458 8.194 0.264 25153 8722 1 10 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.986 0.402 25153 8723 1 10 . 1 1 54 54 PRO C C 54 175.000 175.000 176.412 -1.412 25153 8724 1 10 . 1 1 54 54 PRO CA C 54 61.600 61.600 62.116 -0.516 25153 8725 1 10 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.987 -0.687 25153 8726 1 10 . 1 1 55 55 THR N N 55 112.754 112.754 118.241 -5.487 25153 8727 1 10 . 1 1 55 55 THR HA H 55 4.452 4.452 4.832 -0.380 25153 8728 1 10 . 1 1 55 55 THR C C 55 172.480 172.480 173.894 -1.414 25153 8729 1 10 . 1 1 55 55 THR CA C 55 62.350 62.350 62.715 -0.365 25153 8730 1 10 . 1 1 55 55 THR CB C 55 70.230 70.230 70.124 0.106 25153 8731 1 10 . 1 1 55 55 THR H H 55 6.523 6.523 8.161 -1.638 25153 8732 1 10 . 1 1 56 56 TRP N N 56 130.044 130.044 125.408 4.636 25153 8733 1 10 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.620 -1.905 25153 8734 1 10 . 1 1 56 56 TRP C C 56 172.890 172.890 175.282 -2.392 25153 8735 1 10 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.410 0.241 25153 8736 1 10 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.060 0.940 25153 8737 1 10 . 1 1 56 56 TRP H H 56 8.450 8.450 9.055 -0.605 25153 8738 1 10 . 1 1 57 57 ASP N N 57 115.275 115.275 120.745 -5.470 25153 8739 1 10 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.852 0.500 25153 8740 1 10 . 1 1 57 57 ASP C C 57 173.660 173.660 174.857 -1.197 25153 8741 1 10 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.064 1.166 25153 8742 1 10 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.890 0.280 25153 8743 1 10 . 1 1 58 58 PHE N N 58 112.840 112.840 117.908 -5.068 25153 8744 1 10 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.546 -0.222 25153 8745 1 10 . 1 1 58 58 PHE C C 58 175.730 175.730 176.304 -0.574 25153 8746 1 10 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.586 1.237 25153 8747 1 10 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.072 -2.318 25153 8748 1 10 . 1 1 58 58 PHE H H 58 7.640 7.640 7.506 0.134 25153 8749 1 10 . 1 1 59 59 GLY N N 59 104.940 104.940 106.769 -1.829 25153 8750 1 10 . 1 1 59 59 GLY C C 59 173.750 173.750 174.080 -0.330 25153 8751 1 10 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.180 1.110 25153 8752 1 10 . 1 1 59 59 GLY H H 59 8.024 8.024 8.774 -0.750 25153 8753 1 10 . 1 1 60 60 GLU N N 60 120.045 120.045 119.228 0.817 25153 8754 1 10 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.446 -0.033 25153 8755 1 10 . 1 1 60 60 GLU C C 60 176.050 176.050 175.650 0.400 25153 8756 1 10 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.829 -0.209 25153 8757 1 10 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.656 -1.046 25153 8758 1 10 . 1 1 61 61 ILE N N 61 120.790 120.790 121.707 -0.917 25153 8759 1 10 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.206 -0.739 25153 8760 1 10 . 1 1 61 61 ILE C C 61 175.130 175.130 176.064 -0.934 25153 8761 1 10 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.956 0.591 25153 8762 1 10 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.937 -0.087 25153 8763 1 10 . 1 1 61 61 ILE H H 61 8.200 8.200 7.958 0.242 25153 8764 1 10 . 1 1 62 62 GLN N N 62 124.520 124.520 123.405 1.115 25153 8765 1 10 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.091 -0.135 25153 8766 1 10 . 1 1 62 62 GLN C C 62 177.160 177.160 177.155 0.005 25153 8767 1 10 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.906 0.704 25153 8768 1 10 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.012 -2.362 25153 8769 1 10 . 1 1 62 62 GLN H H 62 5.667 5.667 8.123 -2.456 25153 8770 1 10 . 1 1 63 63 GLU N N 63 124.570 124.570 126.119 -1.549 25153 8771 1 10 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.227 -0.241 25153 8772 1 10 . 1 1 63 63 GLU C C 63 177.300 177.300 177.353 -0.053 25153 8773 1 10 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.872 1.848 25153 8774 1 10 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.259 0.861 25153 8775 1 10 . 1 1 64 64 ASP N N 64 119.060 119.060 119.673 -0.613 25153 8776 1 10 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.514 0.106 25153 8777 1 10 . 1 1 64 64 ASP C C 64 179.180 179.180 177.216 1.964 25153 8778 1 10 . 1 1 64 64 ASP CA C 64 57.950 57.950 55.914 2.036 25153 8779 1 10 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.753 0.197 25153 8780 1 10 . 1 1 65 65 TRP N N 65 121.070 121.070 121.356 -0.286 25153 8781 1 10 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.499 -0.159 25153 8782 1 10 . 1 1 65 65 TRP C C 65 178.970 178.970 177.990 0.980 25153 8783 1 10 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.999 -0.179 25153 8784 1 10 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.356 0.044 25153 8785 1 10 . 1 1 65 65 TRP H H 65 7.350 7.350 8.030 -0.680 25153 8786 1 10 . 1 1 66 66 GLU N N 66 120.900 120.900 118.665 2.235 25153 8787 1 10 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.889 -0.049 25153 8788 1 10 . 1 1 66 66 GLU C C 66 178.750 178.750 179.097 -0.347 25153 8789 1 10 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.431 0.569 25153 8790 1 10 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.247 -0.386 25153 8791 1 10 . 1 1 67 67 ALA N N 67 119.130 119.130 120.099 -0.969 25153 8792 1 10 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.261 -0.008 25153 8793 1 10 . 1 1 67 67 ALA C C 67 179.410 179.410 179.102 0.308 25153 8794 1 10 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.751 -0.171 25153 8795 1 10 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.906 -0.096 25153 8796 1 10 . 1 1 67 67 ALA H H 67 7.640 7.640 7.804 -0.164 25153 8797 1 10 . 1 1 68 68 VAL N N 68 106.845 106.845 111.659 -4.814 25153 8798 1 10 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.553 0.257 25153 8799 1 10 . 1 1 68 68 VAL C C 68 176.750 176.750 176.939 -0.189 25153 8800 1 10 . 1 1 68 68 VAL CA C 68 59.610 59.610 61.912 -2.302 25153 8801 1 10 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.292 0.328 25153 8802 1 10 . 1 1 68 68 VAL H H 68 7.219 7.219 7.679 -0.460 25153 8803 1 10 . 1 1 69 69 TRP N N 69 127.630 127.630 124.369 3.261 25153 8804 1 10 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.258 -0.020 25153 8805 1 10 . 1 1 69 69 TRP C C 69 178.670 178.670 176.904 1.766 25153 8806 1 10 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.804 -1.585 25153 8807 1 10 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.678 1.952 25153 8808 1 10 . 1 1 69 69 TRP H H 69 7.832 7.832 8.567 -0.735 25153 8809 1 10 . 1 1 70 70 ASP N N 70 114.544 114.544 118.221 -3.677 25153 8810 1 10 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.444 0.078 25153 8811 1 10 . 1 1 70 70 ASP C C 70 178.670 178.670 179.023 -0.353 25153 8812 1 10 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.218 -1.218 25153 8813 1 10 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.992 -1.142 25153 8814 1 10 . 1 1 71 71 GLN N N 71 120.040 120.040 119.341 0.699 25153 8815 1 10 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.122 0.062 25153 8816 1 10 . 1 1 71 71 GLN C C 71 178.910 178.910 178.830 0.080 25153 8817 1 10 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.354 -0.744 25153 8818 1 10 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.835 0.265 25153 8819 1 10 . 1 1 71 71 GLN H H 71 7.995 7.995 7.720 0.275 25153 8820 1 10 . 1 1 72 72 LEU N N 72 117.400 117.400 118.110 -0.710 25153 8821 1 10 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.979 -0.166 25153 8822 1 10 . 1 1 72 72 LEU C C 72 178.650 178.650 178.057 0.593 25153 8823 1 10 . 1 1 72 72 LEU CA C 72 57.200 57.200 56.982 0.218 25153 8824 1 10 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.403 0.007 25153 8825 1 10 . 1 1 72 72 LEU H H 72 7.450 7.450 7.582 -0.132 25153 8826 1 10 . 1 1 73 73 ASP N N 73 115.750 115.750 117.605 -1.855 25153 8827 1 10 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.429 -0.261 25153 8828 1 10 . 1 1 73 73 ASP C C 73 177.560 177.560 177.539 0.021 25153 8829 1 10 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.346 1.054 25153 8830 1 10 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.514 -1.414 25153 8831 1 10 . 1 1 74 74 ASP N N 74 117.223 117.223 119.980 -2.757 25153 8832 1 10 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.581 0.122 25153 8833 1 10 . 1 1 74 74 ASP C C 74 176.388 176.388 177.111 -0.723 25153 8834 1 10 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.129 -0.629 25153 8835 1 10 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.557 0.143 25153 8836 1 10 . 1 1 75 75 LEU N N 75 118.316 118.316 119.605 -1.289 25153 8837 1 10 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.411 -0.126 25153 8838 1 10 . 1 1 75 75 LEU C C 75 176.820 176.820 175.913 0.907 25153 8839 1 10 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.448 -0.048 25153 8840 1 10 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.476 0.804 25153 8841 1 10 . 1 1 75 75 LEU H H 75 6.960 6.960 7.339 -0.379 25153 8842 1 10 . 1 1 76 76 ASN N N 76 123.045 123.045 117.999 5.046 25153 8843 1 10 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.800 0.090 25153 8844 1 10 . 1 1 76 76 ASN C C 76 174.950 174.950 174.772 0.178 25153 8845 1 10 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.564 -0.514 25153 8846 1 10 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.429 -0.929 25153 8847 1 10 . 1 1 76 76 ASN H H 76 9.890 9.890 8.783 1.107 25153 8848 1 10 . 1 1 77 77 LEU N N 77 123.494 123.494 123.244 0.250 25153 8849 1 10 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.512 -0.142 25153 8850 1 10 . 1 1 77 77 LEU C C 77 175.040 175.040 176.292 -1.252 25153 8851 1 10 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.825 -1.575 25153 8852 1 10 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.237 0.663 25153 8853 1 10 . 1 1 77 77 LEU H H 77 8.730 8.730 8.054 0.676 25153 8854 1 10 . 1 1 78 78 GLU N N 78 120.870 120.870 121.061 -0.191 25153 8855 1 10 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.399 -0.499 25153 8856 1 10 . 1 1 78 78 GLU C C 78 178.660 178.660 177.791 0.869 25153 8857 1 10 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.416 1.344 25153 8858 1 10 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.416 -0.016 25153 8859 1 10 . 1 1 79 79 GLY N N 79 113.240 113.240 113.538 -0.298 25153 8860 1 10 . 1 1 79 79 GLY C C 79 174.460 174.460 173.515 0.945 25153 8861 1 10 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.539 -0.109 25153 8862 1 10 . 1 1 79 79 GLY H H 79 8.474 8.474 8.768 -0.294 25153 8863 1 10 . 1 1 80 80 LYS N N 80 120.295 120.295 117.774 2.521 25153 8864 1 10 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.744 -0.386 25153 8865 1 10 . 1 1 80 80 LYS C C 80 175.360 175.360 175.247 0.113 25153 8866 1 10 . 1 1 80 80 LYS CA C 80 56.970 56.970 54.222 2.748 25153 8867 1 10 . 1 1 80 80 LYS CB C 80 33.200 33.200 35.270 -2.070 25153 8868 1 10 . 1 1 81 81 ILE N N 81 122.400 122.400 120.821 1.579 25153 8869 1 10 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.719 0.074 25153 8870 1 10 . 1 1 81 81 ILE C C 81 174.760 174.760 175.419 -0.659 25153 8871 1 10 . 1 1 81 81 ILE CA C 81 59.830 59.830 60.973 -1.143 25153 8872 1 10 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.302 -0.602 25153 8873 1 10 . 1 1 81 81 ILE H H 81 7.400 7.400 7.889 -0.489 25153 8874 1 10 . 1 1 82 82 VAL N N 82 127.840 127.840 124.344 3.496 25153 8875 1 10 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.993 0.269 25153 8876 1 10 . 1 1 82 82 VAL C C 82 172.724 172.724 174.324 -1.600 25153 8877 1 10 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.283 0.127 25153 8878 1 10 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.132 0.268 25153 8879 1 10 . 1 1 82 82 VAL H H 82 8.790 8.790 8.735 0.055 25153 8880 1 10 . 1 1 83 83 ALA N N 83 131.347 131.347 130.143 1.204 25153 8881 1 10 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.309 0.073 25153 8882 1 10 . 1 1 83 83 ALA C C 83 175.750 175.750 176.370 -0.620 25153 8883 1 10 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.140 -0.270 25153 8884 1 10 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.216 2.234 25153 8885 1 10 . 1 1 83 83 ALA H H 83 9.300 9.300 8.961 0.339 25153 8886 1 10 . 1 1 84 84 LEU N N 84 124.200 124.200 126.566 -2.366 25153 8887 1 10 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.686 -0.166 25153 8888 1 10 . 1 1 84 84 LEU C C 84 175.760 175.760 176.841 -1.081 25153 8889 1 10 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.820 -0.320 25153 8890 1 10 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.491 1.409 25153 8891 1 10 . 1 1 84 84 LEU H H 84 10.287 10.287 9.054 1.233 25153 8892 1 10 . 1 1 85 85 TYR N N 85 115.912 115.912 119.210 -3.298 25153 8893 1 10 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.339 -0.379 25153 8894 1 10 . 1 1 85 85 TYR C C 85 172.372 172.372 173.792 -1.420 25153 8895 1 10 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.085 1.015 25153 8896 1 10 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.505 1.525 25153 8897 1 10 . 1 1 85 85 TYR H H 85 9.257 9.257 8.856 0.401 25153 8898 1 10 . 1 1 86 86 GLY N N 86 107.800 107.800 105.725 2.075 25153 8899 1 10 . 1 1 86 86 GLY C C 86 170.330 170.330 171.458 -1.128 25153 8900 1 10 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.725 -0.355 25153 8901 1 10 . 1 1 86 86 GLY H H 86 9.027 9.027 8.663 0.364 25153 8902 1 10 . 1 1 87 87 LEU N N 87 123.458 123.458 118.599 4.859 25153 8903 1 10 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.249 0.216 25153 8904 1 10 . 1 1 87 87 LEU C C 87 178.100 178.100 175.868 2.232 25153 8905 1 10 . 1 1 87 87 LEU CA C 87 53.590 53.590 53.046 0.544 25153 8906 1 10 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.833 -0.493 25153 8907 1 10 . 1 1 87 87 LEU H H 87 6.580 6.580 7.730 -1.150 25153 8908 1 10 . 1 1 88 88 GLY N N 88 108.966 108.966 107.351 1.615 25153 8909 1 10 . 1 1 88 88 GLY C C 88 172.820 172.820 171.620 1.200 25153 8910 1 10 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.640 1.020 25153 8911 1 10 . 1 1 88 88 GLY H H 88 8.070 8.070 7.966 0.104 25153 8912 1 10 . 1 1 89 89 ASP N N 89 121.150 121.150 117.502 3.648 25153 8913 1 10 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.259 -0.013 25153 8914 1 10 . 1 1 89 89 ASP C C 89 176.220 176.220 176.105 0.115 25153 8915 1 10 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.929 -0.459 25153 8916 1 10 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.163 -1.683 25153 8917 1 10 . 1 1 90 90 GLN N N 90 123.970 123.970 122.501 1.469 25153 8918 1 10 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.022 -0.534 25153 8919 1 10 . 1 1 90 90 GLN C C 90 173.646 173.646 176.118 -2.472 25153 8920 1 10 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.300 1.010 25153 8921 1 10 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.540 -0.330 25153 8922 1 10 . 1 1 90 90 GLN H H 90 8.623 8.623 8.587 0.036 25153 8923 1 10 . 1 1 91 91 LEU N N 91 118.017 118.017 119.400 -1.383 25153 8924 1 10 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.152 0.223 25153 8925 1 10 . 1 1 91 91 LEU C C 91 180.160 180.160 178.492 1.668 25153 8926 1 10 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.377 -0.317 25153 8927 1 10 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.062 -0.512 25153 8928 1 10 . 1 1 91 91 LEU H H 91 7.046 7.046 8.799 -1.753 25153 8929 1 10 . 1 1 92 92 GLY N N 92 110.028 110.028 104.361 5.667 25153 8930 1 10 . 1 1 92 92 GLY C C 92 174.912 174.912 174.312 0.600 25153 8931 1 10 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.397 0.783 25153 8932 1 10 . 1 1 92 92 GLY H H 92 9.238 9.238 8.846 0.392 25153 8933 1 10 . 1 1 93 93 TYR N N 93 115.910 115.910 118.821 -2.911 25153 8934 1 10 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.414 -0.405 25153 8935 1 10 . 1 1 93 93 TYR C C 93 176.850 176.850 176.838 0.012 25153 8936 1 10 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.094 0.636 25153 8937 1 10 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.120 0.010 25153 8938 1 10 . 1 1 93 93 TYR H H 93 6.962 6.962 7.626 -0.664 25153 8939 1 10 . 1 1 94 94 GLY N N 94 111.630 111.630 111.096 0.534 25153 8940 1 10 . 1 1 94 94 GLY C C 94 177.777 177.777 175.825 1.952 25153 8941 1 10 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.553 2.477 25153 8942 1 10 . 1 1 94 94 GLY H H 94 7.835 7.835 8.034 -0.199 25153 8943 1 10 . 1 1 95 95 GLU N N 95 122.450 122.450 120.142 2.308 25153 8944 1 10 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.923 -0.005 25153 8945 1 10 . 1 1 95 95 GLU C C 95 175.300 175.300 176.762 -1.462 25153 8946 1 10 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.596 -0.496 25153 8947 1 10 . 1 1 95 95 GLU CB C 95 27.511 27.511 27.995 -0.484 25153 8948 1 10 . 1 1 96 96 TRP N N 96 118.790 118.790 117.091 1.699 25153 8949 1 10 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.906 0.538 25153 8950 1 10 . 1 1 96 96 TRP C C 96 179.280 179.280 175.886 3.394 25153 8951 1 10 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.971 1.044 25153 8952 1 10 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.381 -0.361 25153 8953 1 10 . 1 1 96 96 TRP H H 96 8.070 8.070 8.154 -0.084 25153 8954 1 10 . 1 1 97 97 PHE N N 97 128.067 128.067 123.440 4.627 25153 8955 1 10 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.345 0.960 25153 8956 1 10 . 1 1 97 97 PHE C C 97 173.227 173.227 175.988 -2.761 25153 8957 1 10 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.289 -2.569 25153 8958 1 10 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.476 0.464 25153 8959 1 10 . 1 1 97 97 PHE H H 97 7.165 7.165 8.390 -1.225 25153 8960 1 10 . 1 1 98 98 LEU N N 98 114.306 114.306 124.149 -9.843 25153 8961 1 10 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.652 -0.162 25153 8962 1 10 . 1 1 98 98 LEU C C 98 179.365 179.365 177.142 2.223 25153 8963 1 10 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.398 0.062 25153 8964 1 10 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.751 -0.521 25153 8965 1 10 . 1 1 98 98 LEU H H 98 7.453 7.453 8.742 -1.289 25153 8966 1 10 . 1 1 99 99 ASP N N 99 122.354 122.354 120.858 1.496 25153 8967 1 10 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.359 -0.426 25153 8968 1 10 . 1 1 99 99 ASP C C 99 178.800 178.800 177.259 1.541 25153 8969 1 10 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.536 1.644 25153 8970 1 10 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.365 -0.935 25153 8971 1 10 . 1 1 100 100 ALA N N 100 118.568 118.568 121.823 -3.255 25153 8972 1 10 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.060 -0.220 25153 8973 1 10 . 1 1 100 100 ALA C C 100 178.500 178.500 179.095 -0.595 25153 8974 1 10 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.172 -0.256 25153 8975 1 10 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.501 1.159 25153 8976 1 10 . 1 1 100 100 ALA H H 100 8.682 8.682 7.958 0.724 25153 8977 1 10 . 1 1 101 101 LEU N N 101 118.815 118.815 120.573 -1.758 25153 8978 1 10 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.987 -0.307 25153 8979 1 10 . 1 1 101 101 LEU C C 101 178.930 178.930 178.883 0.047 25153 8980 1 10 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.833 -0.133 25153 8981 1 10 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.533 0.867 25153 8982 1 10 . 1 1 101 101 LEU H H 101 6.637 6.637 7.343 -0.706 25153 8983 1 10 . 1 1 102 102 GLY N N 102 103.700 103.700 106.440 -2.740 25153 8984 1 10 . 1 1 102 102 GLY C C 102 175.530 175.530 176.159 -0.629 25153 8985 1 10 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.302 0.698 25153 8986 1 10 . 1 1 102 102 GLY H H 102 7.330 7.330 7.900 -0.570 25153 8987 1 10 . 1 1 103 103 MET N N 103 120.330 120.330 121.675 -1.345 25153 8988 1 10 . 1 1 103 103 MET HA H 103 4.254 4.254 4.244 0.010 25153 8989 1 10 . 1 1 103 103 MET C C 103 179.688 179.688 178.651 1.037 25153 8990 1 10 . 1 1 103 103 MET CA C 103 59.615 59.615 59.628 -0.013 25153 8991 1 10 . 1 1 103 103 MET CB C 103 33.290 33.290 32.605 0.685 25153 8992 1 10 . 1 1 103 103 MET H H 103 8.407 8.407 8.037 0.370 25153 8993 1 10 . 1 1 104 104 LEU N N 104 123.450 123.450 119.836 3.614 25153 8994 1 10 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.699 0.497 25153 8995 1 10 . 1 1 104 104 LEU C C 104 177.620 177.620 178.734 -1.114 25153 8996 1 10 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.957 0.013 25153 8997 1 10 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.248 0.052 25153 8998 1 10 . 1 1 104 104 LEU H H 104 8.330 8.330 8.802 -0.472 25153 8999 1 10 . 1 1 105 105 HIS N N 105 119.040 119.040 119.260 -0.220 25153 9000 1 10 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.074 -0.197 25153 9001 1 10 . 1 1 105 105 HIS C C 105 177.100 177.100 177.018 0.082 25153 9002 1 10 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.834 0.136 25153 9003 1 10 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.867 -1.274 25153 9004 1 10 . 1 1 105 105 HIS H H 105 8.050 8.050 8.450 -0.400 25153 9005 1 10 . 1 1 106 106 ASP N N 106 119.950 119.950 119.122 0.828 25153 9006 1 10 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.391 -0.061 25153 9007 1 10 . 1 1 106 106 ASP C C 106 179.300 179.300 178.408 0.892 25153 9008 1 10 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.276 0.534 25153 9009 1 10 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.153 -0.753 25153 9010 1 10 . 1 1 107 107 LYS N N 107 122.060 122.060 120.025 2.035 25153 9011 1 10 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.056 0.077 25153 9012 1 10 . 1 1 107 107 LYS C C 107 178.100 178.100 179.467 -1.367 25153 9013 1 10 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.699 -0.499 25153 9014 1 10 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.141 0.219 25153 9015 1 10 . 1 1 108 108 LEU N N 108 115.610 115.610 117.988 -2.378 25153 9016 1 10 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.113 -0.045 25153 9017 1 10 . 1 1 108 108 LEU C C 108 178.866 178.866 178.318 0.548 25153 9018 1 10 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.975 -1.021 25153 9019 1 10 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.531 0.630 25153 9020 1 10 . 1 1 108 108 LEU H H 108 7.828 7.828 8.481 -0.653 25153 9021 1 10 . 1 1 109 109 SER N N 109 116.362 116.362 114.795 1.567 25153 9022 1 10 . 1 1 109 109 SER HA H 109 4.299 4.299 4.324 -0.025 25153 9023 1 10 . 1 1 109 109 SER C C 109 175.660 175.660 176.891 -1.231 25153 9024 1 10 . 1 1 109 109 SER CA C 109 62.350 62.350 61.406 0.944 25153 9025 1 10 . 1 1 109 109 SER CB C 109 62.815 62.815 63.126 -0.311 25153 9026 1 10 . 1 1 109 109 SER H H 109 8.278 8.278 8.560 -0.282 25153 9027 1 10 . 1 1 110 110 THR N N 110 110.230 110.230 116.343 -6.113 25153 9028 1 10 . 1 1 110 110 THR HA H 110 4.615 4.615 4.271 0.344 25153 9029 1 10 . 1 1 110 110 THR C C 110 175.990 175.990 175.547 0.443 25153 9030 1 10 . 1 1 110 110 THR CA C 110 62.090 62.090 64.263 -2.173 25153 9031 1 10 . 1 1 110 110 THR CB C 110 68.800 68.800 68.635 0.165 25153 9032 1 10 . 1 1 110 110 THR H H 110 7.211 7.211 7.840 -0.629 25153 9033 1 10 . 1 1 111 111 LYS N N 111 119.900 119.900 119.216 0.684 25153 9034 1 10 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.352 0.160 25153 9035 1 10 . 1 1 111 111 LYS C C 111 176.916 176.916 176.538 0.378 25153 9036 1 10 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.796 -0.142 25153 9037 1 10 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.027 -1.184 25153 9038 1 10 . 1 1 112 112 GLY N N 112 107.910 107.910 107.977 -0.067 25153 9039 1 10 . 1 1 112 112 GLY C C 112 176.250 176.250 174.092 2.158 25153 9040 1 10 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.462 1.578 25153 9041 1 10 . 1 1 112 112 GLY H H 112 8.366 8.366 7.538 0.828 25153 9042 1 10 . 1 1 113 113 VAL N N 113 113.530 113.530 114.619 -1.089 25153 9043 1 10 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.377 0.097 25153 9044 1 10 . 1 1 113 113 VAL C C 113 174.630 174.630 174.747 -0.117 25153 9045 1 10 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.776 -1.325 25153 9046 1 10 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.714 -0.164 25153 9047 1 10 . 1 1 113 113 VAL H H 113 6.903 6.903 7.003 -0.100 25153 9048 1 10 . 1 1 114 114 LYS N N 114 123.020 123.020 119.540 3.480 25153 9049 1 10 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.549 -0.044 25153 9050 1 10 . 1 1 114 114 LYS C C 114 175.000 175.000 174.539 0.461 25153 9051 1 10 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.586 -0.386 25153 9052 1 10 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.759 -1.419 25153 9053 1 10 . 1 1 115 115 PHE N N 115 123.290 123.290 120.061 3.229 25153 9054 1 10 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.799 -0.086 25153 9055 1 10 . 1 1 115 115 PHE C C 115 177.605 177.605 176.034 1.571 25153 9056 1 10 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.137 2.473 25153 9057 1 10 . 1 1 115 115 PHE CB C 115 41.000 41.000 42.144 -1.144 25153 9058 1 10 . 1 1 115 115 PHE H H 115 8.494 8.494 8.441 0.053 25153 9059 1 10 . 1 1 116 116 VAL N N 116 115.790 115.790 114.463 1.327 25153 9060 1 10 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.697 -0.205 25153 9061 1 10 . 1 1 116 116 VAL C C 116 175.414 175.414 175.708 -0.294 25153 9062 1 10 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.374 -0.389 25153 9063 1 10 . 1 1 116 116 VAL CB C 116 34.100 34.100 35.033 -0.933 25153 9064 1 10 . 1 1 116 116 VAL H H 116 8.889 8.889 8.579 0.310 25153 9065 1 10 . 1 1 117 117 GLY N N 117 108.300 108.300 107.143 1.157 25153 9066 1 10 . 1 1 117 117 GLY C C 117 176.180 176.180 174.939 1.241 25153 9067 1 10 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.399 2.401 25153 9068 1 10 . 1 1 117 117 GLY H H 117 9.810 9.810 8.620 1.190 25153 9069 1 10 . 1 1 118 118 TYR N N 118 120.050 120.050 119.614 0.436 25153 9070 1 10 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.814 0.140 25153 9071 1 10 . 1 1 118 118 TYR C C 118 177.450 177.450 175.954 1.496 25153 9072 1 10 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.550 -1.310 25153 9073 1 10 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.131 -3.021 25153 9074 1 10 . 1 1 118 118 TYR H H 118 8.592 8.592 7.563 1.029 25153 9075 1 10 . 1 1 119 119 TRP N N 119 125.500 125.500 120.754 4.746 25153 9076 1 10 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.172 0.856 25153 9077 1 10 . 1 1 119 119 TRP C C 119 173.090 173.090 174.104 -1.014 25153 9078 1 10 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.465 -0.565 25153 9079 1 10 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.490 2.760 25153 9080 1 10 . 1 1 119 119 TRP H H 119 7.926 7.926 8.176 -0.250 25153 9081 1 10 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.753 0.057 25153 9082 1 10 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.971 0.709 25153 9083 1 10 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.237 0.013 25153 9084 1 10 . 1 1 121 121 THR N N 121 109.114 109.114 112.311 -3.197 25153 9085 1 10 . 1 1 121 121 THR HA H 121 4.142 4.142 3.478 0.664 25153 9086 1 10 . 1 1 121 121 THR C C 121 176.300 176.300 175.069 1.231 25153 9087 1 10 . 1 1 121 121 THR CA C 121 61.230 61.230 62.276 -1.046 25153 9088 1 10 . 1 1 121 121 THR CB C 121 69.890 69.890 68.480 1.410 25153 9089 1 10 . 1 1 121 121 THR H H 121 7.356 7.356 8.346 -0.990 25153 9090 1 10 . 1 1 122 122 GLU N N 122 123.980 123.980 121.346 2.634 25153 9091 1 10 . 1 1 122 122 GLU HA H 122 4.238 4.238 3.998 0.240 25153 9092 1 10 . 1 1 122 122 GLU C C 122 177.830 177.830 178.016 -0.186 25153 9093 1 10 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.676 0.554 25153 9094 1 10 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.866 -0.096 25153 9095 1 10 . 1 1 123 123 GLY N N 123 114.570 114.570 113.456 1.114 25153 9096 1 10 . 1 1 123 123 GLY C C 123 173.700 173.700 173.630 0.070 25153 9097 1 10 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.298 0.102 25153 9098 1 10 . 1 1 123 123 GLY H H 123 9.181 9.181 8.814 0.367 25153 9099 1 10 . 1 1 124 124 TYR N N 124 118.923 118.923 121.489 -2.566 25153 9100 1 10 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.693 0.617 25153 9101 1 10 . 1 1 124 124 TYR C C 124 175.680 175.680 175.259 0.421 25153 9102 1 10 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.726 -2.256 25153 9103 1 10 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.135 0.865 25153 9104 1 10 . 1 1 124 124 TYR H H 124 7.877 7.877 7.794 0.083 25153 9105 1 10 . 1 1 125 125 GLU N N 125 124.890 124.890 121.526 3.364 25153 9106 1 10 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.675 0.025 25153 9107 1 10 . 1 1 125 125 GLU C C 125 172.880 172.880 175.288 -2.408 25153 9108 1 10 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.753 -0.323 25153 9109 1 10 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.962 -0.542 25153 9110 1 10 . 1 1 126 126 PHE N N 126 119.166 119.166 120.563 -1.397 25153 9111 1 10 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.721 0.088 25153 9112 1 10 . 1 1 126 126 PHE C C 126 173.750 173.750 174.270 -0.520 25153 9113 1 10 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.354 -1.564 25153 9114 1 10 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.079 0.971 25153 9115 1 10 . 1 1 126 126 PHE H H 126 7.716 7.716 7.994 -0.278 25153 9116 1 10 . 1 1 127 127 THR N N 127 106.800 106.800 115.581 -8.781 25153 9117 1 10 . 1 1 127 127 THR HA H 127 4.400 4.400 3.398 1.002 25153 9118 1 10 . 1 1 127 127 THR C C 127 175.300 175.300 173.961 1.339 25153 9119 1 10 . 1 1 127 127 THR CA C 127 61.100 61.100 62.693 -1.593 25153 9120 1 10 . 1 1 127 127 THR CB C 127 70.600 70.600 67.906 2.694 25153 9121 1 10 . 1 1 127 127 THR H H 127 7.220 7.220 6.507 0.713 25153 9122 1 10 . 1 1 128 128 SER N N 128 118.360 118.360 115.227 3.133 25153 9123 1 10 . 1 1 128 128 SER HA H 128 4.680 4.680 4.496 0.184 25153 9124 1 10 . 1 1 128 128 SER C C 128 175.720 175.720 173.936 1.784 25153 9125 1 10 . 1 1 128 128 SER CA C 128 56.250 56.250 57.009 -0.759 25153 9126 1 10 . 1 1 128 128 SER CB C 128 65.635 65.635 64.364 1.271 25153 9127 1 10 . 1 1 128 128 SER H H 128 7.411 7.411 7.937 -0.526 25153 9128 1 10 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.547 0.228 25153 9129 1 10 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.403 -1.903 25153 9130 1 10 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.313 0.087 25153 9131 1 10 . 1 1 130 130 LYS N N 130 122.014 122.014 119.700 2.314 25153 9132 1 10 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.364 -0.131 25153 9133 1 10 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.338 3.362 25153 9134 1 10 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.037 -0.467 25153 9135 1 10 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.546 -0.028 25153 9136 1 10 . 1 1 131 131 PRO C C 131 174.000 174.000 175.123 -1.123 25153 9137 1 10 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.340 2.360 25153 9138 1 10 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.222 0.978 25153 9139 1 10 . 1 1 132 132 VAL N N 132 113.260 113.260 117.902 -4.642 25153 9140 1 10 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.816 0.384 25153 9141 1 10 . 1 1 132 132 VAL C C 132 175.210 175.210 174.974 0.236 25153 9142 1 10 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.418 -0.798 25153 9143 1 10 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.027 -1.047 25153 9144 1 10 . 1 1 132 132 VAL H H 132 6.697 6.697 7.584 -0.887 25153 9145 1 10 . 1 1 133 133 ILE N N 133 119.940 119.940 117.724 2.216 25153 9146 1 10 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.446 -0.066 25153 9147 1 10 . 1 1 133 133 ILE C C 133 175.440 175.440 175.881 -0.441 25153 9148 1 10 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.173 2.276 25153 9149 1 10 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.642 1.458 25153 9150 1 10 . 1 1 133 133 ILE H H 133 8.756 8.756 8.596 0.160 25153 9151 1 10 . 1 1 134 134 ALA N N 134 122.632 122.632 123.562 -0.930 25153 9152 1 10 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.768 0.192 25153 9153 1 10 . 1 1 134 134 ALA C C 134 178.312 178.312 177.465 0.847 25153 9154 1 10 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.632 -1.552 25153 9155 1 10 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.431 -0.595 25153 9156 1 10 . 1 1 134 134 ALA H H 134 8.523 8.523 8.342 0.181 25153 9157 1 10 . 1 1 135 135 ASP N N 135 117.366 117.366 122.724 -5.358 25153 9158 1 10 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.661 -0.409 25153 9159 1 10 . 1 1 135 135 ASP C C 135 176.387 176.387 176.642 -0.255 25153 9160 1 10 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.353 1.857 25153 9161 1 10 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.243 -1.543 25153 9162 1 10 . 1 1 136 136 GLY N N 136 104.310 104.310 108.050 -3.740 25153 9163 1 10 . 1 1 136 136 GLY C C 136 174.922 174.922 174.950 -0.028 25153 9164 1 10 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.379 -0.279 25153 9165 1 10 . 1 1 136 136 GLY H H 136 7.610 7.610 8.298 -0.688 25153 9166 1 10 . 1 1 137 137 GLN N N 137 118.784 118.784 117.742 1.042 25153 9167 1 10 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.438 -0.383 25153 9168 1 10 . 1 1 137 137 GLN C C 137 176.390 176.390 175.453 0.937 25153 9169 1 10 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.802 1.838 25153 9170 1 10 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.225 0.005 25153 9171 1 10 . 1 1 137 137 GLN H H 137 7.870 7.870 7.867 0.003 25153 9172 1 10 . 1 1 138 138 LEU N N 138 118.040 118.040 115.866 2.174 25153 9173 1 10 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.042 -0.055 25153 9174 1 10 . 1 1 138 138 LEU C C 138 175.913 175.913 175.085 0.828 25153 9175 1 10 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.219 0.380 25153 9176 1 10 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.942 1.458 25153 9177 1 10 . 1 1 138 138 LEU H H 138 7.356 7.356 7.200 0.156 25153 9178 1 10 . 1 1 139 139 PHE N N 139 119.060 119.060 119.293 -0.233 25153 9179 1 10 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.961 0.349 25153 9180 1 10 . 1 1 139 139 PHE C C 139 178.780 178.780 177.412 1.368 25153 9181 1 10 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.561 -0.711 25153 9182 1 10 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.810 3.650 25153 9183 1 10 . 1 1 139 139 PHE H H 139 10.094 10.094 8.925 1.169 25153 9184 1 10 . 1 1 140 140 VAL N N 140 109.690 109.690 116.519 -6.829 25153 9185 1 10 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.572 -0.091 25153 9186 1 10 . 1 1 140 140 VAL C C 140 172.790 172.790 175.530 -2.740 25153 9187 1 10 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.204 -1.204 25153 9188 1 10 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.560 -1.010 25153 9189 1 10 . 1 1 140 140 VAL H H 140 7.470 7.470 8.098 -0.628 25153 9190 1 10 . 1 1 141 141 GLY N N 141 107.060 107.060 105.058 2.002 25153 9191 1 10 . 1 1 141 141 GLY C C 141 171.513 171.513 172.620 -1.107 25153 9192 1 10 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.390 1.040 25153 9193 1 10 . 1 1 141 141 GLY H H 141 7.137 7.137 7.322 -0.185 25153 9194 1 10 . 1 1 142 142 LEU N N 142 117.863 117.863 120.377 -2.514 25153 9195 1 10 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.119 -1.144 25153 9196 1 10 . 1 1 142 142 LEU C C 142 173.640 173.640 175.067 -1.427 25153 9197 1 10 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.686 1.234 25153 9198 1 10 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.197 -4.647 25153 9199 1 10 . 1 1 142 142 LEU H H 142 7.517 7.517 7.746 -0.229 25153 9200 1 10 . 1 1 143 143 ALA N N 143 126.990 126.990 128.633 -1.643 25153 9201 1 10 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.415 -0.138 25153 9202 1 10 . 1 1 143 143 ALA C C 143 175.730 175.730 175.726 0.004 25153 9203 1 10 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.261 -0.821 25153 9204 1 10 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.594 3.716 25153 9205 1 10 . 1 1 143 143 ALA H H 143 5.186 5.186 8.128 -2.942 25153 9206 1 10 . 1 1 144 144 LEU N N 144 125.477 125.477 122.626 2.851 25153 9207 1 10 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.860 -0.080 25153 9208 1 10 . 1 1 144 144 LEU C C 144 174.473 174.473 175.376 -0.903 25153 9209 1 10 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.569 -0.329 25153 9210 1 10 . 1 1 144 144 LEU CB C 144 45.300 45.300 46.149 -0.849 25153 9211 1 10 . 1 1 144 144 LEU H H 144 8.758 8.758 7.901 0.857 25153 9212 1 10 . 1 1 145 145 ASP N N 145 118.915 118.915 119.151 -0.236 25153 9213 1 10 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.278 0.254 25153 9214 1 10 . 1 1 145 145 ASP C C 145 176.470 176.470 175.972 0.498 25153 9215 1 10 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.474 0.156 25153 9216 1 10 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.524 -0.524 25153 9217 1 10 . 1 1 146 146 GLU N N 146 124.813 124.813 124.100 0.713 25153 9218 1 10 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.563 -0.187 25153 9219 1 10 . 1 1 146 146 GLU C C 146 177.290 177.290 176.602 0.688 25153 9220 1 10 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.004 0.116 25153 9221 1 10 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.840 0.310 25153 9222 1 10 . 1 1 147 147 THR N N 147 118.328 118.328 114.359 3.969 25153 9223 1 10 . 1 1 147 147 THR HA H 147 4.200 4.200 4.557 -0.357 25153 9224 1 10 . 1 1 147 147 THR C C 147 175.683 175.683 174.876 0.807 25153 9225 1 10 . 1 1 147 147 THR CA C 147 66.250 66.250 63.626 2.624 25153 9226 1 10 . 1 1 147 147 THR CB C 147 69.600 69.600 69.626 -0.026 25153 9227 1 10 . 1 1 147 147 THR H H 147 8.562 8.562 9.139 -0.577 25153 9228 1 10 . 1 1 148 148 ASN N N 148 115.550 115.550 118.135 -2.585 25153 9229 1 10 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.877 0.110 25153 9230 1 10 . 1 1 148 148 ASN C C 148 175.870 175.870 175.351 0.519 25153 9231 1 10 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.592 -0.892 25153 9232 1 10 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.669 2.212 25153 9233 1 10 . 1 1 148 148 ASN H H 148 9.118 9.118 8.659 0.459 25153 9234 1 10 . 1 1 149 149 GLN N N 149 117.400 117.400 120.436 -3.036 25153 9235 1 10 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.236 0.607 25153 9236 1 10 . 1 1 149 149 GLN C C 149 177.780 177.780 176.294 1.486 25153 9237 1 10 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.149 -2.249 25153 9238 1 10 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.676 0.624 25153 9239 1 10 . 1 1 149 149 GLN H H 149 7.555 7.555 8.397 -0.842 25153 9240 1 10 . 1 1 150 150 TYR N N 150 120.674 120.674 116.562 4.112 25153 9241 1 10 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.421 0.107 25153 9242 1 10 . 1 1 150 150 TYR C C 150 177.830 177.830 176.528 1.302 25153 9243 1 10 . 1 1 150 150 TYR CA C 150 58.487 58.487 57.990 0.497 25153 9244 1 10 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.865 -0.265 25153 9245 1 10 . 1 1 150 150 TYR H H 150 6.983 6.983 7.734 -0.751 25153 9246 1 10 . 1 1 151 151 ASP N N 151 120.810 120.810 119.601 1.209 25153 9247 1 10 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.688 -0.173 25153 9248 1 10 . 1 1 151 151 ASP C C 151 176.400 176.400 177.253 -0.853 25153 9249 1 10 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.861 -0.461 25153 9250 1 10 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.615 -2.535 25153 9251 1 10 . 1 1 152 152 LEU N N 152 118.083 118.083 115.772 2.311 25153 9252 1 10 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.772 -0.096 25153 9253 1 10 . 1 1 152 152 LEU C C 152 178.470 178.470 178.429 0.041 25153 9254 1 10 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.746 -1.146 25153 9255 1 10 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.422 -0.822 25153 9256 1 10 . 1 1 152 152 LEU H H 152 7.453 7.453 7.535 -0.082 25153 9257 1 10 . 1 1 153 153 SER N N 153 116.407 116.407 117.713 -1.306 25153 9258 1 10 . 1 1 153 153 SER HA H 153 3.960 3.960 4.032 -0.072 25153 9259 1 10 . 1 1 153 153 SER C C 153 174.590 174.590 175.802 -1.212 25153 9260 1 10 . 1 1 153 153 SER CA C 153 63.400 63.400 61.958 1.442 25153 9261 1 10 . 1 1 153 153 SER CB C 153 63.100 63.100 62.560 0.540 25153 9262 1 10 . 1 1 153 153 SER H H 153 7.360 7.360 8.327 -0.967 25153 9263 1 10 . 1 1 154 154 ASP N N 154 121.960 121.960 122.152 -0.192 25153 9264 1 10 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.313 -0.003 25153 9265 1 10 . 1 1 154 154 ASP C C 154 178.640 178.640 177.862 0.778 25153 9266 1 10 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.251 1.749 25153 9267 1 10 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.970 -1.400 25153 9268 1 10 . 1 1 155 155 GLU N N 155 121.310 121.310 118.347 2.963 25153 9269 1 10 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.106 0.079 25153 9270 1 10 . 1 1 155 155 GLU C C 155 179.600 179.600 178.915 0.685 25153 9271 1 10 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.121 0.329 25153 9272 1 10 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.408 -0.008 25153 9273 1 10 . 1 1 156 156 ARG N N 156 121.394 121.394 119.475 1.919 25153 9274 1 10 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.629 -0.329 25153 9275 1 10 . 1 1 156 156 ARG C C 156 177.330 177.330 178.572 -1.242 25153 9276 1 10 . 1 1 156 156 ARG CA C 156 60.460 60.460 55.918 4.542 25153 9277 1 10 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.836 0.924 25153 9278 1 10 . 1 1 157 157 ILE N N 157 118.390 118.390 122.035 -3.645 25153 9279 1 10 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.782 -0.348 25153 9280 1 10 . 1 1 157 157 ILE C C 157 178.814 178.814 177.451 1.363 25153 9281 1 10 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.202 0.492 25153 9282 1 10 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.912 0.941 25153 9283 1 10 . 1 1 157 157 ILE H H 157 8.966 8.966 7.978 0.988 25153 9284 1 10 . 1 1 158 158 GLN N N 158 120.060 120.060 119.193 0.867 25153 9285 1 10 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.958 -0.002 25153 9286 1 10 . 1 1 158 158 GLN C C 158 178.843 178.843 178.465 0.378 25153 9287 1 10 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.265 1.335 25153 9288 1 10 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.210 0.180 25153 9289 1 10 . 1 1 158 158 GLN H H 158 8.394 8.394 7.967 0.427 25153 9290 1 10 . 1 1 159 159 SER N N 159 115.613 115.613 115.255 0.358 25153 9291 1 10 . 1 1 159 159 SER HA H 159 4.455 4.455 4.374 0.081 25153 9292 1 10 . 1 1 159 159 SER C C 159 177.330 177.330 176.631 0.699 25153 9293 1 10 . 1 1 159 159 SER CA C 159 62.400 62.400 60.919 1.481 25153 9294 1 10 . 1 1 159 159 SER CB C 159 63.760 63.760 63.202 0.558 25153 9295 1 10 . 1 1 159 159 SER H H 159 8.460 8.460 7.894 0.566 25153 9296 1 10 . 1 1 160 160 TRP N N 160 126.820 126.820 125.449 1.371 25153 9297 1 10 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.112 0.353 25153 9298 1 10 . 1 1 160 160 TRP C C 160 178.050 178.050 177.879 0.171 25153 9299 1 10 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.845 0.855 25153 9300 1 10 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.279 0.081 25153 9301 1 10 . 1 1 160 160 TRP H H 160 9.318 9.318 7.678 1.640 25153 9302 1 10 . 1 1 161 161 CYS N N 161 116.750 116.750 117.734 -0.984 25153 9303 1 10 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.727 0.156 25153 9304 1 10 . 1 1 161 161 CYS C C 161 176.270 176.270 177.038 -0.768 25153 9305 1 10 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.334 1.026 25153 9306 1 10 . 1 1 161 161 CYS CB C 161 27.880 27.880 27.015 0.865 25153 9307 1 10 . 1 1 161 161 CYS H H 161 8.950 8.950 9.066 -0.116 25153 9308 1 10 . 1 1 162 162 GLU N N 162 118.096 118.096 118.981 -0.885 25153 9309 1 10 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.061 -0.131 25153 9310 1 10 . 1 1 162 162 GLU C C 162 178.680 178.680 177.733 0.947 25153 9311 1 10 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.061 0.669 25153 9312 1 10 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.542 -0.112 25153 9313 1 10 . 1 1 163 163 GLN N N 163 120.790 120.790 118.077 2.713 25153 9314 1 10 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.121 0.056 25153 9315 1 10 . 1 1 163 163 GLN C C 163 179.690 179.690 178.017 1.673 25153 9316 1 10 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.206 1.334 25153 9317 1 10 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.929 0.071 25153 9318 1 10 . 1 1 163 163 GLN H H 163 8.205 8.205 7.527 0.678 25153 9319 1 10 . 1 1 164 164 ILE N N 164 114.860 114.860 118.861 -4.001 25153 9320 1 10 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.871 0.172 25153 9321 1 10 . 1 1 164 164 ILE C C 164 178.680 178.680 177.349 1.331 25153 9322 1 10 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.029 2.181 25153 9323 1 10 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.606 0.094 25153 9324 1 10 . 1 1 164 164 ILE H H 164 9.005 9.005 7.997 1.008 25153 9325 1 10 . 1 1 165 165 LEU N N 165 123.900 123.900 116.074 7.826 25153 9326 1 10 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.210 -0.060 25153 9327 1 10 . 1 1 165 165 LEU C C 165 180.520 180.520 177.296 3.224 25153 9328 1 10 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.211 1.089 25153 9329 1 10 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.287 -0.237 25153 9330 1 10 . 1 1 165 165 LEU H H 165 7.825 7.825 8.004 -0.179 25153 9331 1 10 . 1 1 166 166 ASN N N 166 120.112 120.112 117.743 2.369 25153 9332 1 10 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.775 -0.192 25153 9333 1 10 . 1 1 166 166 ASN C C 166 178.440 178.440 177.114 1.326 25153 9334 1 10 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.787 0.633 25153 9335 1 10 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.853 -1.433 25153 9336 1 10 . 1 1 166 166 ASN H H 166 7.760 7.760 7.895 -0.135 25153 9337 1 10 . 1 1 167 167 GLU N N 167 121.370 121.370 122.109 -0.739 25153 9338 1 10 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.971 0.132 25153 9339 1 10 . 1 1 167 167 GLU C C 167 180.332 180.332 179.305 1.027 25153 9340 1 10 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.949 0.201 25153 9341 1 10 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.698 1.322 25153 9342 1 10 . 1 1 168 168 MET N N 168 118.532 118.532 117.191 1.341 25153 9343 1 10 . 1 1 168 168 MET HA H 168 4.015 4.015 4.235 -0.220 25153 9344 1 10 . 1 1 168 168 MET C C 168 176.600 176.600 178.162 -1.562 25153 9345 1 10 . 1 1 168 168 MET CA C 168 59.300 59.300 59.518 -0.218 25153 9346 1 10 . 1 1 168 168 MET CB C 168 33.400 33.400 32.696 0.705 25153 9347 1 10 . 1 1 168 168 MET H H 168 8.718 8.718 8.489 0.229 25153 9348 1 10 . 1 1 169 169 ALA N N 169 121.922 121.922 122.448 -0.526 25153 9349 1 10 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.151 0.023 25153 9350 1 10 . 1 1 169 169 ALA C C 169 179.410 179.410 179.724 -0.314 25153 9351 1 10 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.894 -0.494 25153 9352 1 10 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.441 -0.031 25153 9353 1 10 . 1 1 169 169 ALA H H 169 7.448 7.448 7.816 -0.368 25153 9354 1 10 . 1 1 170 170 GLU N N 170 117.300 117.300 116.807 0.493 25153 9355 1 10 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.063 0.032 25153 9356 1 10 . 1 1 170 170 GLU C C 170 177.470 177.470 179.219 -1.749 25153 9357 1 10 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.941 -0.991 25153 9358 1 10 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.369 0.406 25153 9359 1 10 . 1 1 171 171 HIS N N 171 117.944 117.944 119.259 -1.315 25153 9360 1 10 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.351 0.149 25153 9361 1 10 . 1 1 171 171 HIS C C 171 175.120 175.120 176.808 -1.688 25153 9362 1 10 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.964 -1.764 25153 9363 1 10 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.190 0.410 25153 9364 1 10 . 1 1 171 171 HIS H H 171 7.788 7.788 7.817 -0.029 25153 9365 1 10 . 1 1 172 172 TYR N N 172 120.040 120.040 117.988 2.052 25153 9366 1 10 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.495 0.098 25153 9367 1 10 . 1 1 172 172 TYR C C 172 174.612 174.612 175.700 -1.088 25153 9368 1 10 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.511 -0.531 25153 9369 1 10 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.608 0.372 25153 9370 1 10 . 1 1 172 172 TYR H H 172 7.820 7.820 7.986 -0.166 25153 9371 1 11 . 1 1 2 2 ASN N N 2 123.320 123.320 119.764 3.556 25153 9372 1 11 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.145 0.063 25153 9373 1 11 . 1 1 2 2 ASN C C 2 174.590 174.590 174.535 0.055 25153 9374 1 11 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.744 0.256 25153 9375 1 11 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.320 -0.350 25153 9376 1 11 . 1 1 2 2 ASN H H 2 9.428 9.428 8.679 0.749 25153 9377 1 11 . 1 1 3 3 MET N N 3 120.920 120.920 119.276 1.644 25153 9378 1 11 . 1 1 3 3 MET HA H 3 5.530 5.530 5.307 0.223 25153 9379 1 11 . 1 1 3 3 MET C C 3 174.400 174.400 175.145 -0.745 25153 9380 1 11 . 1 1 3 3 MET CA C 3 54.643 54.643 54.169 0.474 25153 9381 1 11 . 1 1 3 3 MET CB C 3 34.637 34.637 37.231 -2.594 25153 9382 1 11 . 1 1 3 3 MET H H 3 8.751 8.751 9.146 -0.395 25153 9383 1 11 . 1 1 4 4 GLY N N 4 115.542 115.542 109.149 6.393 25153 9384 1 11 . 1 1 4 4 GLY C C 4 170.413 170.413 172.168 -1.755 25153 9385 1 11 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.824 -0.722 25153 9386 1 11 . 1 1 4 4 GLY H H 4 8.927 8.927 8.988 -0.061 25153 9387 1 11 . 1 1 5 5 LEU N N 5 131.030 131.030 128.002 3.028 25153 9388 1 11 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.302 1.100 25153 9389 1 11 . 1 1 5 5 LEU C C 5 175.952 175.952 174.508 1.444 25153 9390 1 11 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.107 0.343 25153 9391 1 11 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.060 2.532 25153 9392 1 11 . 1 1 5 5 LEU H H 5 8.928 8.928 8.687 0.241 25153 9393 1 11 . 1 1 6 6 PHE N N 6 125.790 125.790 126.120 -0.330 25153 9394 1 11 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.726 0.014 25153 9395 1 11 . 1 1 6 6 PHE C C 6 174.300 174.300 175.874 -1.574 25153 9396 1 11 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.306 -0.986 25153 9397 1 11 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.692 -0.462 25153 9398 1 11 . 1 1 6 6 PHE H H 6 9.237 9.237 9.510 -0.273 25153 9399 1 11 . 1 1 7 7 TYR N N 7 117.289 117.289 117.001 0.288 25153 9400 1 11 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.832 0.133 25153 9401 1 11 . 1 1 7 7 TYR C C 7 171.262 171.262 173.361 -2.099 25153 9402 1 11 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.291 -0.891 25153 9403 1 11 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.163 0.077 25153 9404 1 11 . 1 1 7 7 TYR H H 7 8.125 8.125 8.286 -0.161 25153 9405 1 11 . 1 1 8 8 GLY N N 8 107.420 107.420 105.642 1.778 25153 9406 1 11 . 1 1 8 8 GLY C C 8 172.000 172.000 172.366 -0.366 25153 9407 1 11 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.294 -0.350 25153 9408 1 11 . 1 1 8 8 GLY H H 8 7.031 7.031 8.450 -1.419 25153 9409 1 11 . 1 1 9 9 SER N N 9 118.150 118.150 115.758 2.392 25153 9410 1 11 . 1 1 9 9 SER HA H 9 5.200 5.200 5.033 0.167 25153 9411 1 11 . 1 1 9 9 SER C C 9 175.000 175.000 173.323 1.677 25153 9412 1 11 . 1 1 9 9 SER CA C 9 57.570 57.570 57.260 0.310 25153 9413 1 11 . 1 1 9 9 SER CB C 9 66.700 66.700 65.483 1.217 25153 9414 1 11 . 1 1 9 9 SER H H 9 9.604 9.604 8.224 1.380 25153 9415 1 11 . 1 1 10 10 SER N N 10 131.193 131.193 117.456 13.737 25153 9416 1 11 . 1 1 10 10 SER HA H 10 4.775 4.775 4.683 0.092 25153 9417 1 11 . 1 1 10 10 SER C C 10 175.730 175.730 175.981 -0.251 25153 9418 1 11 . 1 1 10 10 SER CA C 10 61.750 61.750 59.679 2.071 25153 9419 1 11 . 1 1 10 10 SER CB C 10 64.400 64.400 64.891 -0.491 25153 9420 1 11 . 1 1 10 10 SER H H 10 11.636 11.636 9.029 2.607 25153 9421 1 11 . 1 1 11 11 THR N N 11 115.848 115.848 116.246 -0.398 25153 9422 1 11 . 1 1 11 11 THR HA H 11 4.770 4.770 4.082 0.688 25153 9423 1 11 . 1 1 11 11 THR C C 11 173.700 173.700 175.113 -1.413 25153 9424 1 11 . 1 1 11 11 THR CA C 11 60.700 60.700 63.123 -2.423 25153 9425 1 11 . 1 1 11 11 THR CB C 11 67.430 67.430 68.119 -0.689 25153 9426 1 11 . 1 1 11 11 THR H H 11 9.550 9.550 8.504 1.046 25153 9427 1 11 . 1 1 12 12 CYS N N 12 109.780 109.780 116.736 -6.956 25153 9428 1 11 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.127 -0.057 25153 9429 1 11 . 1 1 12 12 CYS C C 12 176.220 176.220 175.130 1.090 25153 9430 1 11 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.367 3.232 25153 9431 1 11 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.555 0.845 25153 9432 1 11 . 1 1 12 12 CYS H H 12 7.437 7.437 8.013 -0.576 25153 9433 1 11 . 1 1 13 13 TYR N N 13 127.830 127.830 119.953 7.877 25153 9434 1 11 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.202 -0.099 25153 9435 1 11 . 1 1 13 13 TYR C C 13 180.880 180.880 177.759 3.121 25153 9436 1 11 . 1 1 13 13 TYR CA C 13 65.100 65.100 60.478 4.622 25153 9437 1 11 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.272 -0.437 25153 9438 1 11 . 1 1 13 13 TYR H H 13 10.886 10.886 7.579 3.307 25153 9439 1 11 . 1 1 14 14 THR N N 14 124.428 124.428 113.738 10.690 25153 9440 1 11 . 1 1 14 14 THR HA H 14 4.160 4.160 4.167 -0.007 25153 9441 1 11 . 1 1 14 14 THR C C 14 177.760 177.760 176.182 1.578 25153 9442 1 11 . 1 1 14 14 THR CA C 14 67.823 67.823 66.803 1.020 25153 9443 1 11 . 1 1 14 14 THR CB C 14 68.040 68.040 68.526 -0.486 25153 9444 1 11 . 1 1 14 14 THR H H 14 11.405 11.405 8.139 3.266 25153 9445 1 11 . 1 1 15 15 GLU N N 15 123.050 123.050 122.915 0.135 25153 9446 1 11 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.143 -0.253 25153 9447 1 11 . 1 1 15 15 GLU C C 15 176.392 176.392 178.156 -1.764 25153 9448 1 11 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.349 -0.149 25153 9449 1 11 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.257 1.193 25153 9450 1 11 . 1 1 16 16 MET N N 16 120.173 120.173 118.400 1.773 25153 9451 1 11 . 1 1 16 16 MET HA H 16 4.050 4.050 4.150 -0.100 25153 9452 1 11 . 1 1 16 16 MET C C 16 179.940 179.940 178.680 1.260 25153 9453 1 11 . 1 1 16 16 MET CA C 16 59.240 59.240 59.175 0.065 25153 9454 1 11 . 1 1 16 16 MET CB C 16 32.970 32.970 32.865 0.105 25153 9455 1 11 . 1 1 16 16 MET H H 16 8.469 8.469 8.364 0.105 25153 9456 1 11 . 1 1 17 17 ALA N N 17 121.930 121.930 121.894 0.036 25153 9457 1 11 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.854 -0.018 25153 9458 1 11 . 1 1 17 17 ALA C C 17 177.900 177.900 178.758 -0.858 25153 9459 1 11 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.165 0.035 25153 9460 1 11 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.108 -0.108 25153 9461 1 11 . 1 1 17 17 ALA H H 17 7.880 7.880 8.346 -0.466 25153 9462 1 11 . 1 1 18 18 ALA N N 18 121.477 121.477 121.427 0.050 25153 9463 1 11 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.858 -0.121 25153 9464 1 11 . 1 1 18 18 ALA C C 18 179.380 179.380 179.582 -0.202 25153 9465 1 11 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.175 -0.175 25153 9466 1 11 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.809 1.021 25153 9467 1 11 . 1 1 18 18 ALA H H 18 7.374 7.374 8.223 -0.849 25153 9468 1 11 . 1 1 19 19 GLU N N 19 116.650 116.650 118.090 -1.440 25153 9469 1 11 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.871 -0.255 25153 9470 1 11 . 1 1 19 19 GLU C C 19 178.479 178.479 179.650 -1.171 25153 9471 1 11 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.483 0.247 25153 9472 1 11 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.354 -0.054 25153 9473 1 11 . 1 1 20 20 LYS N N 20 119.470 119.470 120.125 -0.655 25153 9474 1 11 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.001 0.049 25153 9475 1 11 . 1 1 20 20 LYS C C 20 179.116 179.116 178.857 0.259 25153 9476 1 11 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.714 0.116 25153 9477 1 11 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.494 0.356 25153 9478 1 11 . 1 1 21 21 ILE N N 21 121.030 121.030 120.779 0.251 25153 9479 1 11 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.680 -0.290 25153 9480 1 11 . 1 1 21 21 ILE C C 21 177.580 177.580 178.191 -0.611 25153 9481 1 11 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.681 0.139 25153 9482 1 11 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.896 0.452 25153 9483 1 11 . 1 1 21 21 ILE H H 21 8.100 8.100 8.643 -0.543 25153 9484 1 11 . 1 1 22 22 ARG N N 22 119.720 119.720 119.342 0.378 25153 9485 1 11 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.899 -0.344 25153 9486 1 11 . 1 1 22 22 ARG C C 22 177.320 177.320 178.294 -0.974 25153 9487 1 11 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.086 0.634 25153 9488 1 11 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.270 -0.338 25153 9489 1 11 . 1 1 23 23 ASP N N 23 118.730 118.730 119.275 -0.545 25153 9490 1 11 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.428 -0.065 25153 9491 1 11 . 1 1 23 23 ASP C C 23 178.330 178.330 178.679 -0.349 25153 9492 1 11 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.296 -0.346 25153 9493 1 11 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.878 -0.638 25153 9494 1 11 . 1 1 24 24 ILE N N 24 121.090 121.090 119.301 1.789 25153 9495 1 11 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.757 0.039 25153 9496 1 11 . 1 1 24 24 ILE C C 24 178.250 178.250 177.925 0.325 25153 9497 1 11 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.945 -0.795 25153 9498 1 11 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.350 0.130 25153 9499 1 11 . 1 1 24 24 ILE H H 24 7.910 7.910 8.113 -0.203 25153 9500 1 11 . 1 1 25 25 ILE N N 25 121.406 121.406 117.204 4.202 25153 9501 1 11 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.883 -0.237 25153 9502 1 11 . 1 1 25 25 ILE C C 25 176.800 176.800 176.743 0.057 25153 9503 1 11 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.031 2.669 25153 9504 1 11 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.974 -0.784 25153 9505 1 11 . 1 1 25 25 ILE H H 25 8.476 8.476 8.089 0.387 25153 9506 1 11 . 1 1 26 26 GLY N N 26 108.900 108.900 105.109 3.791 25153 9507 1 11 . 1 1 26 26 GLY C C 26 173.710 173.710 172.275 1.435 25153 9508 1 11 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.774 -0.444 25153 9509 1 11 . 1 1 26 26 GLY H H 26 8.016 8.016 7.766 0.250 25153 9510 1 11 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.476 -0.138 25153 9511 1 11 . 1 1 27 27 PRO C C 27 177.200 177.200 177.099 0.101 25153 9512 1 11 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.760 0.926 25153 9513 1 11 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.106 0.094 25153 9514 1 11 . 1 1 28 28 GLU N N 28 116.295 116.295 117.928 -1.633 25153 9515 1 11 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.212 0.058 25153 9516 1 11 . 1 1 28 28 GLU C C 28 176.980 176.980 177.170 -0.190 25153 9517 1 11 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.360 -0.620 25153 9518 1 11 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.584 -0.914 25153 9519 1 11 . 1 1 29 29 LEU N N 29 120.250 120.250 112.688 7.562 25153 9520 1 11 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.652 -0.016 25153 9521 1 11 . 1 1 29 29 LEU C C 29 175.770 175.770 175.741 0.029 25153 9522 1 11 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.501 0.299 25153 9523 1 11 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.065 1.035 25153 9524 1 11 . 1 1 29 29 LEU H H 29 7.940 7.940 7.524 0.416 25153 9525 1 11 . 1 1 30 30 VAL N N 30 118.693 118.693 121.058 -2.365 25153 9526 1 11 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.776 -0.128 25153 9527 1 11 . 1 1 30 30 VAL C C 30 174.347 174.347 175.709 -1.362 25153 9528 1 11 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.645 -0.777 25153 9529 1 11 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.111 1.469 25153 9530 1 11 . 1 1 30 30 VAL H H 30 7.434 7.434 8.031 -0.597 25153 9531 1 11 . 1 1 31 31 THR N N 31 123.800 123.800 121.690 2.110 25153 9532 1 11 . 1 1 31 31 THR HA H 31 4.362 4.362 4.543 -0.181 25153 9533 1 11 . 1 1 31 31 THR C C 31 172.964 172.964 173.314 -0.350 25153 9534 1 11 . 1 1 31 31 THR CA C 31 61.720 61.720 60.853 0.867 25153 9535 1 11 . 1 1 31 31 THR CB C 31 70.485 70.485 70.772 -0.287 25153 9536 1 11 . 1 1 31 31 THR H H 31 7.844 7.844 8.190 -0.346 25153 9537 1 11 . 1 1 32 32 LEU N N 32 127.800 127.800 126.812 0.988 25153 9538 1 11 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.566 0.118 25153 9539 1 11 . 1 1 32 32 LEU C C 32 176.600 176.600 176.402 0.198 25153 9540 1 11 . 1 1 32 32 LEU CA C 32 55.155 55.155 54.894 0.261 25153 9541 1 11 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.785 1.065 25153 9542 1 11 . 1 1 32 32 LEU H H 32 8.660 8.660 8.574 0.086 25153 9543 1 11 . 1 1 33 33 HIS N N 33 119.670 119.670 120.054 -0.384 25153 9544 1 11 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.802 -0.402 25153 9545 1 11 . 1 1 33 33 HIS C C 33 171.667 171.667 173.223 -1.556 25153 9546 1 11 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.059 0.142 25153 9547 1 11 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.632 0.568 25153 9548 1 11 . 1 1 33 33 HIS H H 33 9.060 9.060 8.634 0.426 25153 9549 1 11 . 1 1 34 34 ASN N N 34 124.068 124.068 123.080 0.988 25153 9550 1 11 . 1 1 34 34 ASN HA H 34 3.434 3.434 3.970 -0.536 25153 9551 1 11 . 1 1 34 34 ASN C C 34 178.000 178.000 175.829 2.171 25153 9552 1 11 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.006 -0.577 25153 9553 1 11 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.244 -0.684 25153 9554 1 11 . 1 1 34 34 ASN H H 34 8.780 8.780 8.601 0.179 25153 9555 1 11 . 1 1 35 35 LEU N N 35 129.040 129.040 126.473 2.567 25153 9556 1 11 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.213 0.102 25153 9557 1 11 . 1 1 35 35 LEU C C 35 177.700 177.700 177.805 -0.105 25153 9558 1 11 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.256 0.224 25153 9559 1 11 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.795 1.504 25153 9560 1 11 . 1 1 35 35 LEU H H 35 8.821 8.821 8.272 0.549 25153 9561 1 11 . 1 1 36 36 LYS N N 36 121.043 121.043 116.628 4.415 25153 9562 1 11 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.993 -0.113 25153 9563 1 11 . 1 1 36 36 LYS C C 36 176.230 176.230 177.211 -0.981 25153 9564 1 11 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.535 0.885 25153 9565 1 11 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.559 0.711 25153 9566 1 11 . 1 1 37 37 ASP N N 37 114.965 114.965 118.100 -3.135 25153 9567 1 11 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.787 -0.010 25153 9568 1 11 . 1 1 37 37 ASP C C 37 175.440 175.440 175.963 -0.523 25153 9569 1 11 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.504 0.207 25153 9570 1 11 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.549 1.151 25153 9571 1 11 . 1 1 38 38 ASP N N 38 121.650 121.650 121.687 -0.037 25153 9572 1 11 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.879 -0.009 25153 9573 1 11 . 1 1 38 38 ASP C C 38 174.852 174.852 175.916 -1.064 25153 9574 1 11 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.591 -1.511 25153 9575 1 11 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.347 -0.237 25153 9576 1 11 . 1 1 39 39 SER N N 39 115.207 115.207 117.886 -2.679 25153 9577 1 11 . 1 1 39 39 SER HA H 39 4.585 4.585 4.720 -0.135 25153 9578 1 11 . 1 1 39 39 SER C C 39 175.040 175.040 174.318 0.722 25153 9579 1 11 . 1 1 39 39 SER CA C 39 54.960 54.960 56.176 -1.216 25153 9580 1 11 . 1 1 39 39 SER CB C 39 64.720 64.720 63.724 0.996 25153 9581 1 11 . 1 1 39 39 SER H H 39 8.351 8.351 8.606 -0.255 25153 9582 1 11 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.202 -0.197 25153 9583 1 11 . 1 1 40 40 PRO C C 40 176.730 176.730 177.804 -1.074 25153 9584 1 11 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.047 -0.147 25153 9585 1 11 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.702 -0.302 25153 9586 1 11 . 1 1 41 41 LYS N N 41 121.150 121.150 119.965 1.185 25153 9587 1 11 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.999 -0.087 25153 9588 1 11 . 1 1 41 41 LYS C C 41 179.600 179.600 178.551 1.049 25153 9589 1 11 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.158 -0.958 25153 9590 1 11 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.828 0.172 25153 9591 1 11 . 1 1 42 42 LEU N N 42 118.103 118.103 116.273 1.830 25153 9592 1 11 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.190 -0.153 25153 9593 1 11 . 1 1 42 42 LEU C C 42 178.760 178.760 178.695 0.065 25153 9594 1 11 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.385 -0.205 25153 9595 1 11 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.538 1.435 25153 9596 1 11 . 1 1 42 42 LEU H H 42 7.600 7.600 7.497 0.103 25153 9597 1 11 . 1 1 43 43 MET N N 43 118.917 118.917 116.933 1.984 25153 9598 1 11 . 1 1 43 43 MET HA H 43 3.750 3.750 4.448 -0.698 25153 9599 1 11 . 1 1 43 43 MET C C 43 177.680 177.680 176.754 0.926 25153 9600 1 11 . 1 1 43 43 MET CA C 43 59.730 59.730 57.915 1.815 25153 9601 1 11 . 1 1 43 43 MET CB C 43 32.700 32.700 31.926 0.774 25153 9602 1 11 . 1 1 43 43 MET H H 43 8.202 8.202 8.062 0.140 25153 9603 1 11 . 1 1 44 44 GLU N N 44 110.924 110.924 117.863 -6.939 25153 9604 1 11 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.211 -0.471 25153 9605 1 11 . 1 1 44 44 GLU C C 44 178.130 178.130 178.956 -0.826 25153 9606 1 11 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.398 1.002 25153 9607 1 11 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.943 -0.393 25153 9608 1 11 . 1 1 45 45 GLN N N 45 115.756 115.756 118.399 -2.643 25153 9609 1 11 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.044 0.139 25153 9610 1 11 . 1 1 45 45 GLN C C 45 175.414 175.414 177.265 -1.851 25153 9611 1 11 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.463 -1.283 25153 9612 1 11 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.150 -0.550 25153 9613 1 11 . 1 1 45 45 GLN H H 45 7.516 7.516 7.486 0.030 25153 9614 1 11 . 1 1 46 46 TYR N N 46 117.860 117.860 118.745 -0.885 25153 9615 1 11 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.326 0.337 25153 9616 1 11 . 1 1 46 46 TYR C C 46 175.500 175.500 177.259 -1.759 25153 9617 1 11 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.632 -1.146 25153 9618 1 11 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.177 3.293 25153 9619 1 11 . 1 1 46 46 TYR H H 46 6.996 6.996 7.148 -0.152 25153 9620 1 11 . 1 1 47 47 ASP N N 47 121.683 121.683 121.335 0.348 25153 9621 1 11 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.652 0.048 25153 9622 1 11 . 1 1 47 47 ASP C C 47 175.610 175.610 175.100 0.510 25153 9623 1 11 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.215 -0.515 25153 9624 1 11 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.054 0.946 25153 9625 1 11 . 1 1 48 48 VAL N N 48 118.628 118.628 116.753 1.875 25153 9626 1 11 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.803 0.231 25153 9627 1 11 . 1 1 48 48 VAL C C 48 174.190 174.190 174.033 0.157 25153 9628 1 11 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.356 -1.166 25153 9629 1 11 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.884 0.216 25153 9630 1 11 . 1 1 48 48 VAL H H 48 7.628 7.628 7.452 0.176 25153 9631 1 11 . 1 1 49 49 LEU N N 49 128.190 128.190 124.926 3.264 25153 9632 1 11 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.514 0.089 25153 9633 1 11 . 1 1 49 49 LEU C C 49 174.880 174.880 175.857 -0.977 25153 9634 1 11 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.913 -0.672 25153 9635 1 11 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.412 -0.072 25153 9636 1 11 . 1 1 49 49 LEU H H 49 9.407 9.407 9.218 0.189 25153 9637 1 11 . 1 1 50 50 ILE N N 50 124.550 124.550 120.851 3.699 25153 9638 1 11 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.022 0.678 25153 9639 1 11 . 1 1 50 50 ILE C C 50 175.300 175.300 174.668 0.632 25153 9640 1 11 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.000 -1.136 25153 9641 1 11 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.994 -0.744 25153 9642 1 11 . 1 1 50 50 ILE H H 50 9.238 9.238 9.234 0.004 25153 9643 1 11 . 1 1 51 51 LEU N N 51 127.460 127.460 128.208 -0.748 25153 9644 1 11 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.773 0.412 25153 9645 1 11 . 1 1 51 51 LEU C C 51 174.544 174.544 175.738 -1.194 25153 9646 1 11 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.686 -0.866 25153 9647 1 11 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.328 -2.691 25153 9648 1 11 . 1 1 51 51 LEU H H 51 9.228 9.228 9.291 -0.063 25153 9649 1 11 . 1 1 52 52 GLY N N 52 107.760 107.760 111.433 -3.673 25153 9650 1 11 . 1 1 52 52 GLY C C 52 174.710 174.710 172.700 2.010 25153 9651 1 11 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.688 0.182 25153 9652 1 11 . 1 1 52 52 GLY H H 52 8.860 8.860 8.987 -0.127 25153 9653 1 11 . 1 1 53 53 ILE N N 53 123.890 123.890 120.668 3.222 25153 9654 1 11 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.783 0.487 25153 9655 1 11 . 1 1 53 53 ILE C C 53 172.630 172.630 173.255 -0.625 25153 9656 1 11 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.596 0.083 25153 9657 1 11 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.973 4.187 25153 9658 1 11 . 1 1 53 53 ILE H H 53 8.458 8.458 8.298 0.160 25153 9659 1 11 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.940 0.448 25153 9660 1 11 . 1 1 54 54 PRO C C 54 175.000 175.000 176.507 -1.507 25153 9661 1 11 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.784 -0.184 25153 9662 1 11 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.810 -0.510 25153 9663 1 11 . 1 1 55 55 THR N N 55 112.754 112.754 119.154 -6.400 25153 9664 1 11 . 1 1 55 55 THR HA H 55 4.452 4.452 4.723 -0.271 25153 9665 1 11 . 1 1 55 55 THR C C 55 172.480 172.480 174.069 -1.589 25153 9666 1 11 . 1 1 55 55 THR CA C 55 62.350 62.350 63.005 -0.655 25153 9667 1 11 . 1 1 55 55 THR CB C 55 70.230 70.230 69.960 0.271 25153 9668 1 11 . 1 1 55 55 THR H H 55 6.523 6.523 8.235 -1.712 25153 9669 1 11 . 1 1 56 56 TRP N N 56 130.044 130.044 127.205 2.839 25153 9670 1 11 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.529 -1.814 25153 9671 1 11 . 1 1 56 56 TRP C C 56 172.890 172.890 175.221 -2.331 25153 9672 1 11 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.678 -0.028 25153 9673 1 11 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.534 1.466 25153 9674 1 11 . 1 1 56 56 TRP H H 56 8.450 8.450 8.738 -0.288 25153 9675 1 11 . 1 1 57 57 ASP N N 57 115.275 115.275 119.738 -4.463 25153 9676 1 11 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.004 0.348 25153 9677 1 11 . 1 1 57 57 ASP C C 57 173.660 173.660 174.471 -0.811 25153 9678 1 11 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.186 1.044 25153 9679 1 11 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.670 0.500 25153 9680 1 11 . 1 1 58 58 PHE N N 58 112.840 112.840 116.185 -3.345 25153 9681 1 11 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.569 -0.245 25153 9682 1 11 . 1 1 58 58 PHE C C 58 175.730 175.730 176.090 -0.360 25153 9683 1 11 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.840 0.983 25153 9684 1 11 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.065 -2.311 25153 9685 1 11 . 1 1 58 58 PHE H H 58 7.640 7.640 7.418 0.222 25153 9686 1 11 . 1 1 59 59 GLY N N 59 104.940 104.940 105.890 -0.950 25153 9687 1 11 . 1 1 59 59 GLY C C 59 173.750 173.750 174.652 -0.902 25153 9688 1 11 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.512 0.778 25153 9689 1 11 . 1 1 59 59 GLY H H 59 8.024 8.024 8.583 -0.559 25153 9690 1 11 . 1 1 60 60 GLU N N 60 120.045 120.045 119.246 0.799 25153 9691 1 11 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.522 -0.109 25153 9692 1 11 . 1 1 60 60 GLU C C 60 176.050 176.050 175.955 0.095 25153 9693 1 11 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.100 -0.480 25153 9694 1 11 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.267 -0.656 25153 9695 1 11 . 1 1 61 61 ILE N N 61 120.790 120.790 120.360 0.430 25153 9696 1 11 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.123 -0.656 25153 9697 1 11 . 1 1 61 61 ILE C C 61 175.130 175.130 176.135 -1.005 25153 9698 1 11 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.220 0.327 25153 9699 1 11 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.002 -0.152 25153 9700 1 11 . 1 1 61 61 ILE H H 61 8.200 8.200 8.410 -0.210 25153 9701 1 11 . 1 1 62 62 GLN N N 62 124.520 124.520 124.008 0.512 25153 9702 1 11 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.148 -0.192 25153 9703 1 11 . 1 1 62 62 GLN C C 62 177.160 177.160 177.078 0.082 25153 9704 1 11 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.533 2.077 25153 9705 1 11 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.233 -2.583 25153 9706 1 11 . 1 1 62 62 GLN H H 62 5.667 5.667 8.791 -3.124 25153 9707 1 11 . 1 1 63 63 GLU N N 63 124.570 124.570 126.135 -1.565 25153 9708 1 11 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.138 -0.152 25153 9709 1 11 . 1 1 63 63 GLU C C 63 177.300 177.300 177.460 -0.160 25153 9710 1 11 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.159 1.561 25153 9711 1 11 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.144 0.976 25153 9712 1 11 . 1 1 64 64 ASP N N 64 119.060 119.060 119.112 -0.052 25153 9713 1 11 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.380 0.240 25153 9714 1 11 . 1 1 64 64 ASP C C 64 179.180 179.180 177.157 2.023 25153 9715 1 11 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.203 1.747 25153 9716 1 11 . 1 1 64 64 ASP CB C 64 40.950 40.950 39.881 1.069 25153 9717 1 11 . 1 1 65 65 TRP N N 65 121.070 121.070 121.538 -0.468 25153 9718 1 11 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.510 -0.170 25153 9719 1 11 . 1 1 65 65 TRP C C 65 178.970 178.970 178.625 0.345 25153 9720 1 11 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.566 0.255 25153 9721 1 11 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.490 -0.090 25153 9722 1 11 . 1 1 65 65 TRP H H 65 7.350 7.350 7.796 -0.446 25153 9723 1 11 . 1 1 66 66 GLU N N 66 120.900 120.900 118.708 2.192 25153 9724 1 11 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.878 -0.038 25153 9725 1 11 . 1 1 66 66 GLU C C 66 178.750 178.750 179.107 -0.357 25153 9726 1 11 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.439 0.561 25153 9727 1 11 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.265 -0.405 25153 9728 1 11 . 1 1 67 67 ALA N N 67 119.130 119.130 119.946 -0.816 25153 9729 1 11 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.250 0.003 25153 9730 1 11 . 1 1 67 67 ALA C C 67 179.410 179.410 179.103 0.307 25153 9731 1 11 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.700 -0.120 25153 9732 1 11 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.850 -0.040 25153 9733 1 11 . 1 1 67 67 ALA H H 67 7.640 7.640 7.988 -0.348 25153 9734 1 11 . 1 1 68 68 VAL N N 68 106.845 106.845 111.460 -4.615 25153 9735 1 11 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.470 0.340 25153 9736 1 11 . 1 1 68 68 VAL C C 68 176.750 176.750 177.242 -0.492 25153 9737 1 11 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.570 -2.960 25153 9738 1 11 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.523 0.097 25153 9739 1 11 . 1 1 68 68 VAL H H 68 7.219 7.219 7.543 -0.324 25153 9740 1 11 . 1 1 69 69 TRP N N 69 127.630 127.630 124.090 3.540 25153 9741 1 11 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.313 -0.075 25153 9742 1 11 . 1 1 69 69 TRP C C 69 178.670 178.670 177.189 1.481 25153 9743 1 11 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.087 -0.867 25153 9744 1 11 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.524 2.106 25153 9745 1 11 . 1 1 69 69 TRP H H 69 7.832 7.832 8.550 -0.718 25153 9746 1 11 . 1 1 70 70 ASP N N 70 114.544 114.544 118.714 -4.170 25153 9747 1 11 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.432 0.090 25153 9748 1 11 . 1 1 70 70 ASP C C 70 178.670 178.670 178.934 -0.264 25153 9749 1 11 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.415 -1.415 25153 9750 1 11 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.912 -1.062 25153 9751 1 11 . 1 1 71 71 GLN N N 71 120.040 120.040 119.479 0.561 25153 9752 1 11 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.088 0.096 25153 9753 1 11 . 1 1 71 71 GLN C C 71 178.910 178.910 178.836 0.074 25153 9754 1 11 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.466 -0.856 25153 9755 1 11 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.806 0.294 25153 9756 1 11 . 1 1 71 71 GLN H H 71 7.995 7.995 7.706 0.289 25153 9757 1 11 . 1 1 72 72 LEU N N 72 117.400 117.400 118.817 -1.417 25153 9758 1 11 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.912 -0.099 25153 9759 1 11 . 1 1 72 72 LEU C C 72 178.650 178.650 178.019 0.631 25153 9760 1 11 . 1 1 72 72 LEU CA C 72 57.200 57.200 56.959 0.241 25153 9761 1 11 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.379 0.031 25153 9762 1 11 . 1 1 72 72 LEU H H 72 7.450 7.450 7.648 -0.198 25153 9763 1 11 . 1 1 73 73 ASP N N 73 115.750 115.750 117.224 -1.474 25153 9764 1 11 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.426 -0.258 25153 9765 1 11 . 1 1 73 73 ASP C C 73 177.560 177.560 177.182 0.378 25153 9766 1 11 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.395 1.006 25153 9767 1 11 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.605 -1.505 25153 9768 1 11 . 1 1 74 74 ASP N N 74 117.223 117.223 119.575 -2.352 25153 9769 1 11 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.617 0.086 25153 9770 1 11 . 1 1 74 74 ASP C C 74 176.388 176.388 176.925 -0.537 25153 9771 1 11 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.758 -0.258 25153 9772 1 11 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.590 0.110 25153 9773 1 11 . 1 1 75 75 LEU N N 75 118.316 118.316 118.451 -0.135 25153 9774 1 11 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.528 -0.243 25153 9775 1 11 . 1 1 75 75 LEU C C 75 176.820 176.820 175.609 1.211 25153 9776 1 11 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.410 -0.010 25153 9777 1 11 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.891 0.389 25153 9778 1 11 . 1 1 75 75 LEU H H 75 6.960 6.960 7.298 -0.338 25153 9779 1 11 . 1 1 76 76 ASN N N 76 123.045 123.045 117.078 5.967 25153 9780 1 11 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.744 0.146 25153 9781 1 11 . 1 1 76 76 ASN C C 76 174.950 174.950 174.056 0.894 25153 9782 1 11 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.628 -0.578 25153 9783 1 11 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.783 -1.283 25153 9784 1 11 . 1 1 76 76 ASN H H 76 9.890 9.890 8.656 1.234 25153 9785 1 11 . 1 1 77 77 LEU N N 77 123.494 123.494 121.793 1.701 25153 9786 1 11 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.558 -0.188 25153 9787 1 11 . 1 1 77 77 LEU C C 77 175.040 175.040 176.300 -1.260 25153 9788 1 11 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.709 -1.459 25153 9789 1 11 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.767 0.133 25153 9790 1 11 . 1 1 77 77 LEU H H 77 8.730 8.730 8.660 0.070 25153 9791 1 11 . 1 1 78 78 GLU N N 78 120.870 120.870 121.781 -0.911 25153 9792 1 11 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.384 -0.484 25153 9793 1 11 . 1 1 78 78 GLU C C 78 178.660 178.660 177.776 0.884 25153 9794 1 11 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.603 1.157 25153 9795 1 11 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.140 0.260 25153 9796 1 11 . 1 1 79 79 GLY N N 79 113.240 113.240 114.150 -0.910 25153 9797 1 11 . 1 1 79 79 GLY C C 79 174.460 174.460 174.347 0.113 25153 9798 1 11 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.294 0.136 25153 9799 1 11 . 1 1 79 79 GLY H H 79 8.474 8.474 8.797 -0.323 25153 9800 1 11 . 1 1 80 80 LYS N N 80 120.295 120.295 119.760 0.535 25153 9801 1 11 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.517 -0.159 25153 9802 1 11 . 1 1 80 80 LYS C C 80 175.360 175.360 176.184 -0.824 25153 9803 1 11 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.196 0.774 25153 9804 1 11 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.812 -0.612 25153 9805 1 11 . 1 1 81 81 ILE N N 81 122.400 122.400 122.176 0.224 25153 9806 1 11 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.656 0.137 25153 9807 1 11 . 1 1 81 81 ILE C C 81 174.760 174.760 175.446 -0.686 25153 9808 1 11 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.593 -1.763 25153 9809 1 11 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.893 -0.193 25153 9810 1 11 . 1 1 81 81 ILE H H 81 7.400 7.400 7.784 -0.384 25153 9811 1 11 . 1 1 82 82 VAL N N 82 127.840 127.840 126.198 1.642 25153 9812 1 11 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.088 0.174 25153 9813 1 11 . 1 1 82 82 VAL C C 82 172.724 172.724 174.306 -1.582 25153 9814 1 11 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.544 -0.133 25153 9815 1 11 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.440 -0.040 25153 9816 1 11 . 1 1 82 82 VAL H H 82 8.790 8.790 8.828 -0.038 25153 9817 1 11 . 1 1 83 83 ALA N N 83 131.347 131.347 129.875 1.472 25153 9818 1 11 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.323 0.059 25153 9819 1 11 . 1 1 83 83 ALA C C 83 175.750 175.750 176.222 -0.472 25153 9820 1 11 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.130 -0.260 25153 9821 1 11 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.712 2.738 25153 9822 1 11 . 1 1 83 83 ALA H H 83 9.300 9.300 8.902 0.398 25153 9823 1 11 . 1 1 84 84 LEU N N 84 124.200 124.200 126.833 -2.633 25153 9824 1 11 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.579 -0.059 25153 9825 1 11 . 1 1 84 84 LEU C C 84 175.760 175.760 176.607 -0.847 25153 9826 1 11 . 1 1 84 84 LEU CA C 84 53.500 53.500 54.082 -0.582 25153 9827 1 11 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.642 1.258 25153 9828 1 11 . 1 1 84 84 LEU H H 84 10.287 10.287 8.987 1.300 25153 9829 1 11 . 1 1 85 85 TYR N N 85 115.912 115.912 118.753 -2.841 25153 9830 1 11 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.248 -0.288 25153 9831 1 11 . 1 1 85 85 TYR C C 85 172.372 172.372 173.704 -1.332 25153 9832 1 11 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.243 0.857 25153 9833 1 11 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.335 1.695 25153 9834 1 11 . 1 1 85 85 TYR H H 85 9.257 9.257 8.947 0.310 25153 9835 1 11 . 1 1 86 86 GLY N N 86 107.800 107.800 105.377 2.423 25153 9836 1 11 . 1 1 86 86 GLY C C 86 170.330 170.330 171.496 -1.166 25153 9837 1 11 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.856 -0.486 25153 9838 1 11 . 1 1 86 86 GLY H H 86 9.027 9.027 8.725 0.302 25153 9839 1 11 . 1 1 87 87 LEU N N 87 123.458 123.458 118.238 5.220 25153 9840 1 11 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.238 0.227 25153 9841 1 11 . 1 1 87 87 LEU C C 87 178.100 178.100 175.786 2.314 25153 9842 1 11 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.940 0.650 25153 9843 1 11 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.634 -0.294 25153 9844 1 11 . 1 1 87 87 LEU H H 87 6.580 6.580 7.814 -1.234 25153 9845 1 11 . 1 1 88 88 GLY N N 88 108.966 108.966 107.527 1.439 25153 9846 1 11 . 1 1 88 88 GLY C C 88 172.820 172.820 171.752 1.068 25153 9847 1 11 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.350 1.310 25153 9848 1 11 . 1 1 88 88 GLY H H 88 8.070 8.070 8.344 -0.274 25153 9849 1 11 . 1 1 89 89 ASP N N 89 121.150 121.150 116.901 4.249 25153 9850 1 11 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.104 0.142 25153 9851 1 11 . 1 1 89 89 ASP C C 89 176.220 176.220 176.248 -0.028 25153 9852 1 11 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.067 -0.597 25153 9853 1 11 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.986 -1.506 25153 9854 1 11 . 1 1 90 90 GLN N N 90 123.970 123.970 122.317 1.653 25153 9855 1 11 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.198 -0.710 25153 9856 1 11 . 1 1 90 90 GLN C C 90 173.646 173.646 176.499 -2.853 25153 9857 1 11 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.599 0.712 25153 9858 1 11 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.835 -0.625 25153 9859 1 11 . 1 1 90 90 GLN H H 90 8.623 8.623 8.842 -0.219 25153 9860 1 11 . 1 1 91 91 LEU N N 91 118.017 118.017 120.233 -2.216 25153 9861 1 11 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.086 0.289 25153 9862 1 11 . 1 1 91 91 LEU C C 91 180.160 180.160 178.636 1.524 25153 9863 1 11 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.494 -0.434 25153 9864 1 11 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.980 -0.430 25153 9865 1 11 . 1 1 91 91 LEU H H 91 7.046 7.046 8.880 -1.834 25153 9866 1 11 . 1 1 92 92 GLY N N 92 110.028 110.028 103.972 6.056 25153 9867 1 11 . 1 1 92 92 GLY C C 92 174.912 174.912 174.541 0.371 25153 9868 1 11 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.172 1.008 25153 9869 1 11 . 1 1 92 92 GLY H H 92 9.238 9.238 8.693 0.545 25153 9870 1 11 . 1 1 93 93 TYR N N 93 115.910 115.910 118.558 -2.648 25153 9871 1 11 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.426 -0.417 25153 9872 1 11 . 1 1 93 93 TYR C C 93 176.850 176.850 176.604 0.246 25153 9873 1 11 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.462 0.267 25153 9874 1 11 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.800 -0.670 25153 9875 1 11 . 1 1 93 93 TYR H H 93 6.962 6.962 7.574 -0.612 25153 9876 1 11 . 1 1 94 94 GLY N N 94 111.630 111.630 109.572 2.058 25153 9877 1 11 . 1 1 94 94 GLY C C 94 177.777 177.777 175.489 2.288 25153 9878 1 11 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.488 2.542 25153 9879 1 11 . 1 1 94 94 GLY H H 94 7.835 7.835 8.185 -0.350 25153 9880 1 11 . 1 1 95 95 GLU N N 95 122.450 122.450 120.184 2.266 25153 9881 1 11 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.844 0.074 25153 9882 1 11 . 1 1 95 95 GLU C C 95 175.300 175.300 176.788 -1.488 25153 9883 1 11 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.073 0.027 25153 9884 1 11 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.544 -1.033 25153 9885 1 11 . 1 1 96 96 TRP N N 96 118.790 118.790 117.187 1.603 25153 9886 1 11 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.917 0.527 25153 9887 1 11 . 1 1 96 96 TRP C C 96 179.280 179.280 176.906 2.374 25153 9888 1 11 . 1 1 96 96 TRP CA C 96 57.015 57.015 57.786 -0.771 25153 9889 1 11 . 1 1 96 96 TRP CB C 96 30.020 30.020 31.407 -1.387 25153 9890 1 11 . 1 1 96 96 TRP H H 96 8.070 8.070 7.924 0.146 25153 9891 1 11 . 1 1 97 97 PHE N N 97 128.067 128.067 118.487 9.580 25153 9892 1 11 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.184 1.121 25153 9893 1 11 . 1 1 97 97 PHE C C 97 173.227 173.227 176.868 -3.641 25153 9894 1 11 . 1 1 97 97 PHE CA C 97 56.720 56.720 60.235 -3.515 25153 9895 1 11 . 1 1 97 97 PHE CB C 97 39.940 39.940 38.252 1.688 25153 9896 1 11 . 1 1 97 97 PHE H H 97 7.165 7.165 9.068 -1.903 25153 9897 1 11 . 1 1 98 98 LEU N N 98 114.306 114.306 122.580 -8.274 25153 9898 1 11 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.921 -0.431 25153 9899 1 11 . 1 1 98 98 LEU C C 98 179.365 179.365 177.865 1.500 25153 9900 1 11 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.067 0.393 25153 9901 1 11 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.625 -0.395 25153 9902 1 11 . 1 1 98 98 LEU H H 98 7.453 7.453 8.239 -0.786 25153 9903 1 11 . 1 1 99 99 ASP N N 99 122.354 122.354 122.136 0.218 25153 9904 1 11 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.340 -0.407 25153 9905 1 11 . 1 1 99 99 ASP C C 99 178.800 178.800 177.566 1.234 25153 9906 1 11 . 1 1 99 99 ASP CA C 99 59.180 59.180 58.185 0.995 25153 9907 1 11 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.626 -1.196 25153 9908 1 11 . 1 1 100 100 ALA N N 100 118.568 118.568 121.752 -3.184 25153 9909 1 11 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.043 -0.203 25153 9910 1 11 . 1 1 100 100 ALA C C 100 178.500 178.500 179.325 -0.825 25153 9911 1 11 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.927 -0.011 25153 9912 1 11 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.436 1.224 25153 9913 1 11 . 1 1 100 100 ALA H H 100 8.682 8.682 7.989 0.693 25153 9914 1 11 . 1 1 101 101 LEU N N 101 118.815 118.815 120.590 -1.775 25153 9915 1 11 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.996 -0.316 25153 9916 1 11 . 1 1 101 101 LEU C C 101 178.930 178.930 178.775 0.155 25153 9917 1 11 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.775 -0.075 25153 9918 1 11 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.543 0.857 25153 9919 1 11 . 1 1 101 101 LEU H H 101 6.637 6.637 7.646 -1.009 25153 9920 1 11 . 1 1 102 102 GLY N N 102 103.700 103.700 106.440 -2.740 25153 9921 1 11 . 1 1 102 102 GLY C C 102 175.530 175.530 176.150 -0.620 25153 9922 1 11 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.262 0.738 25153 9923 1 11 . 1 1 102 102 GLY H H 102 7.330 7.330 7.777 -0.447 25153 9924 1 11 . 1 1 103 103 MET N N 103 120.330 120.330 121.762 -1.432 25153 9925 1 11 . 1 1 103 103 MET HA H 103 4.254 4.254 4.188 0.066 25153 9926 1 11 . 1 1 103 103 MET C C 103 179.688 179.688 178.556 1.132 25153 9927 1 11 . 1 1 103 103 MET CA C 103 59.615 59.615 59.656 -0.041 25153 9928 1 11 . 1 1 103 103 MET CB C 103 33.290 33.290 32.653 0.638 25153 9929 1 11 . 1 1 103 103 MET H H 103 8.407 8.407 8.113 0.294 25153 9930 1 11 . 1 1 104 104 LEU N N 104 123.450 123.450 119.743 3.707 25153 9931 1 11 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.802 0.394 25153 9932 1 11 . 1 1 104 104 LEU C C 104 177.620 177.620 178.784 -1.164 25153 9933 1 11 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.749 0.221 25153 9934 1 11 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.521 -0.221 25153 9935 1 11 . 1 1 104 104 LEU H H 104 8.330 8.330 8.628 -0.298 25153 9936 1 11 . 1 1 105 105 HIS N N 105 119.040 119.040 119.393 -0.353 25153 9937 1 11 . 1 1 105 105 HIS HA H 105 3.877 3.877 3.987 -0.110 25153 9938 1 11 . 1 1 105 105 HIS C C 105 177.100 177.100 177.028 0.072 25153 9939 1 11 . 1 1 105 105 HIS CA C 105 60.970 60.970 61.108 -0.138 25153 9940 1 11 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.710 -1.117 25153 9941 1 11 . 1 1 105 105 HIS H H 105 8.050 8.050 8.459 -0.409 25153 9942 1 11 . 1 1 106 106 ASP N N 106 119.950 119.950 118.738 1.212 25153 9943 1 11 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.401 -0.071 25153 9944 1 11 . 1 1 106 106 ASP C C 106 179.300 179.300 178.462 0.838 25153 9945 1 11 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.158 0.652 25153 9946 1 11 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.165 -0.765 25153 9947 1 11 . 1 1 107 107 LYS N N 107 122.060 122.060 120.005 2.055 25153 9948 1 11 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.058 0.075 25153 9949 1 11 . 1 1 107 107 LYS C C 107 178.100 178.100 179.407 -1.307 25153 9950 1 11 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.801 -0.601 25153 9951 1 11 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.219 0.140 25153 9952 1 11 . 1 1 108 108 LEU N N 108 115.610 115.610 118.030 -2.420 25153 9953 1 11 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.156 -0.088 25153 9954 1 11 . 1 1 108 108 LEU C C 108 178.866 178.866 178.294 0.572 25153 9955 1 11 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.744 -0.790 25153 9956 1 11 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.547 0.613 25153 9957 1 11 . 1 1 108 108 LEU H H 108 7.828 7.828 8.291 -0.463 25153 9958 1 11 . 1 1 109 109 SER N N 109 116.362 116.362 115.366 0.996 25153 9959 1 11 . 1 1 109 109 SER HA H 109 4.299 4.299 4.294 0.005 25153 9960 1 11 . 1 1 109 109 SER C C 109 175.660 175.660 176.837 -1.177 25153 9961 1 11 . 1 1 109 109 SER CA C 109 62.350 62.350 61.346 1.004 25153 9962 1 11 . 1 1 109 109 SER CB C 109 62.815 62.815 63.111 -0.297 25153 9963 1 11 . 1 1 109 109 SER H H 109 8.278 8.278 8.675 -0.397 25153 9964 1 11 . 1 1 110 110 THR N N 110 110.230 110.230 116.342 -6.112 25153 9965 1 11 . 1 1 110 110 THR HA H 110 4.615 4.615 4.260 0.355 25153 9966 1 11 . 1 1 110 110 THR C C 110 175.990 175.990 175.483 0.507 25153 9967 1 11 . 1 1 110 110 THR CA C 110 62.090 62.090 64.558 -2.468 25153 9968 1 11 . 1 1 110 110 THR CB C 110 68.800 68.800 68.830 -0.030 25153 9969 1 11 . 1 1 110 110 THR H H 110 7.211 7.211 7.884 -0.673 25153 9970 1 11 . 1 1 111 111 LYS N N 111 119.900 119.900 119.524 0.376 25153 9971 1 11 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.369 0.143 25153 9972 1 11 . 1 1 111 111 LYS C C 111 176.916 176.916 176.351 0.565 25153 9973 1 11 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.333 0.321 25153 9974 1 11 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.184 -1.341 25153 9975 1 11 . 1 1 112 112 GLY N N 112 107.910 107.910 108.090 -0.180 25153 9976 1 11 . 1 1 112 112 GLY C C 112 176.250 176.250 174.029 2.221 25153 9977 1 11 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.550 1.490 25153 9978 1 11 . 1 1 112 112 GLY H H 112 8.366 8.366 7.611 0.755 25153 9979 1 11 . 1 1 113 113 VAL N N 113 113.530 113.530 114.677 -1.147 25153 9980 1 11 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.436 0.038 25153 9981 1 11 . 1 1 113 113 VAL C C 113 174.630 174.630 174.647 -0.017 25153 9982 1 11 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.648 -1.198 25153 9983 1 11 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.809 -0.259 25153 9984 1 11 . 1 1 113 113 VAL H H 113 6.903 6.903 6.935 -0.032 25153 9985 1 11 . 1 1 114 114 LYS N N 114 123.020 123.020 119.179 3.841 25153 9986 1 11 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.539 -0.034 25153 9987 1 11 . 1 1 114 114 LYS C C 114 175.000 175.000 174.681 0.319 25153 9988 1 11 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.532 -0.332 25153 9989 1 11 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.770 -1.431 25153 9990 1 11 . 1 1 115 115 PHE N N 115 123.290 123.290 120.384 2.906 25153 9991 1 11 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.685 0.028 25153 9992 1 11 . 1 1 115 115 PHE C C 115 177.605 177.605 176.526 1.079 25153 9993 1 11 . 1 1 115 115 PHE CA C 115 58.610 58.610 57.155 1.455 25153 9994 1 11 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.736 -0.736 25153 9995 1 11 . 1 1 115 115 PHE H H 115 8.494 8.494 8.590 -0.096 25153 9996 1 11 . 1 1 116 116 VAL N N 116 115.790 115.790 115.694 0.096 25153 9997 1 11 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.389 0.103 25153 9998 1 11 . 1 1 116 116 VAL C C 116 175.414 175.414 175.889 -0.475 25153 9999 1 11 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.759 -0.773 25153 10000 1 11 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.524 -0.424 25153 10001 1 11 . 1 1 116 116 VAL H H 116 8.889 8.889 8.575 0.314 25153 10002 1 11 . 1 1 117 117 GLY N N 117 108.300 108.300 107.300 1.000 25153 10003 1 11 . 1 1 117 117 GLY C C 117 176.180 176.180 174.705 1.475 25153 10004 1 11 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.463 2.337 25153 10005 1 11 . 1 1 117 117 GLY H H 117 9.810 9.810 8.618 1.192 25153 10006 1 11 . 1 1 118 118 TYR N N 118 120.050 120.050 119.973 0.077 25153 10007 1 11 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.655 0.299 25153 10008 1 11 . 1 1 118 118 TYR C C 118 177.450 177.450 175.920 1.530 25153 10009 1 11 . 1 1 118 118 TYR CA C 118 56.240 56.240 59.450 -3.210 25153 10010 1 11 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.267 -3.157 25153 10011 1 11 . 1 1 118 118 TYR H H 118 8.592 8.592 7.571 1.021 25153 10012 1 11 . 1 1 119 119 TRP N N 119 125.500 125.500 122.028 3.472 25153 10013 1 11 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.173 0.855 25153 10014 1 11 . 1 1 119 119 TRP C C 119 173.090 173.090 173.769 -0.679 25153 10015 1 11 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.527 -0.627 25153 10016 1 11 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.523 2.727 25153 10017 1 11 . 1 1 119 119 TRP H H 119 7.926 7.926 8.265 -0.339 25153 10018 1 11 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.752 0.058 25153 10019 1 11 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.923 0.757 25153 10020 1 11 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.259 -0.009 25153 10021 1 11 . 1 1 121 121 THR N N 121 109.114 109.114 114.069 -4.955 25153 10022 1 11 . 1 1 121 121 THR HA H 121 4.142 4.142 3.512 0.630 25153 10023 1 11 . 1 1 121 121 THR C C 121 176.300 176.300 175.174 1.126 25153 10024 1 11 . 1 1 121 121 THR CA C 121 61.230 61.230 62.644 -1.414 25153 10025 1 11 . 1 1 121 121 THR CB C 121 69.890 69.890 68.216 1.674 25153 10026 1 11 . 1 1 121 121 THR H H 121 7.356 7.356 8.448 -1.092 25153 10027 1 11 . 1 1 122 122 GLU N N 122 123.980 123.980 121.943 2.037 25153 10028 1 11 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.042 0.196 25153 10029 1 11 . 1 1 122 122 GLU C C 122 177.830 177.830 177.833 -0.003 25153 10030 1 11 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.603 0.627 25153 10031 1 11 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.887 -0.117 25153 10032 1 11 . 1 1 123 123 GLY N N 123 114.570 114.570 112.593 1.977 25153 10033 1 11 . 1 1 123 123 GLY C C 123 173.700 173.700 174.274 -0.574 25153 10034 1 11 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.788 -0.389 25153 10035 1 11 . 1 1 123 123 GLY H H 123 9.181 9.181 8.840 0.341 25153 10036 1 11 . 1 1 124 124 TYR N N 124 118.923 118.923 120.388 -1.465 25153 10037 1 11 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.678 0.632 25153 10038 1 11 . 1 1 124 124 TYR C C 124 175.680 175.680 175.452 0.228 25153 10039 1 11 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.679 -2.209 25153 10040 1 11 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.382 0.618 25153 10041 1 11 . 1 1 124 124 TYR H H 124 7.877 7.877 7.771 0.105 25153 10042 1 11 . 1 1 125 125 GLU N N 125 124.890 124.890 121.002 3.888 25153 10043 1 11 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.619 0.081 25153 10044 1 11 . 1 1 125 125 GLU C C 125 172.880 172.880 175.207 -2.327 25153 10045 1 11 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.869 -0.439 25153 10046 1 11 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.160 -0.740 25153 10047 1 11 . 1 1 126 126 PHE N N 126 119.166 119.166 117.887 1.279 25153 10048 1 11 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.509 0.300 25153 10049 1 11 . 1 1 126 126 PHE C C 126 173.750 173.750 175.187 -1.437 25153 10050 1 11 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.436 -1.646 25153 10051 1 11 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.260 0.790 25153 10052 1 11 . 1 1 126 126 PHE H H 126 7.716 7.716 8.069 -0.353 25153 10053 1 11 . 1 1 127 127 THR N N 127 106.800 106.800 114.419 -7.619 25153 10054 1 11 . 1 1 127 127 THR HA H 127 4.400 4.400 3.340 1.060 25153 10055 1 11 . 1 1 127 127 THR C C 127 175.300 175.300 173.730 1.570 25153 10056 1 11 . 1 1 127 127 THR CA C 127 61.100 61.100 62.823 -1.723 25153 10057 1 11 . 1 1 127 127 THR CB C 127 70.600 70.600 68.172 2.428 25153 10058 1 11 . 1 1 127 127 THR H H 127 7.220 7.220 6.867 0.353 25153 10059 1 11 . 1 1 128 128 SER N N 128 118.360 118.360 116.354 2.006 25153 10060 1 11 . 1 1 128 128 SER HA H 128 4.680 4.680 4.651 0.029 25153 10061 1 11 . 1 1 128 128 SER C C 128 175.720 175.720 173.458 2.262 25153 10062 1 11 . 1 1 128 128 SER CA C 128 56.250 56.250 57.754 -1.504 25153 10063 1 11 . 1 1 128 128 SER CB C 128 65.635 65.635 63.585 2.050 25153 10064 1 11 . 1 1 128 128 SER H H 128 7.411 7.411 8.114 -0.703 25153 10065 1 11 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.661 0.114 25153 10066 1 11 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.094 -1.594 25153 10067 1 11 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.406 -0.006 25153 10068 1 11 . 1 1 130 130 LYS N N 130 122.014 122.014 120.060 1.954 25153 10069 1 11 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.375 -0.142 25153 10070 1 11 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.371 3.329 25153 10071 1 11 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.988 -0.418 25153 10072 1 11 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.592 -0.074 25153 10073 1 11 . 1 1 131 131 PRO C C 131 174.000 174.000 175.248 -1.248 25153 10074 1 11 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.444 2.256 25153 10075 1 11 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.298 0.902 25153 10076 1 11 . 1 1 132 132 VAL N N 132 113.260 113.260 116.336 -3.076 25153 10077 1 11 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.940 0.260 25153 10078 1 11 . 1 1 132 132 VAL C C 132 175.210 175.210 174.900 0.310 25153 10079 1 11 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.938 -0.318 25153 10080 1 11 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.906 -0.926 25153 10081 1 11 . 1 1 132 132 VAL H H 132 6.697 6.697 7.650 -0.953 25153 10082 1 11 . 1 1 133 133 ILE N N 133 119.940 119.940 116.957 2.983 25153 10083 1 11 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.576 -0.196 25153 10084 1 11 . 1 1 133 133 ILE C C 133 175.440 175.440 175.245 0.195 25153 10085 1 11 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.075 1.375 25153 10086 1 11 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.103 1.996 25153 10087 1 11 . 1 1 133 133 ILE H H 133 8.756 8.756 8.754 0.002 25153 10088 1 11 . 1 1 134 134 ALA N N 134 122.632 122.632 123.907 -1.275 25153 10089 1 11 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.885 0.075 25153 10090 1 11 . 1 1 134 134 ALA C C 134 178.312 178.312 177.216 1.096 25153 10091 1 11 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.585 -1.505 25153 10092 1 11 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.213 -0.377 25153 10093 1 11 . 1 1 134 134 ALA H H 134 8.523 8.523 8.485 0.038 25153 10094 1 11 . 1 1 135 135 ASP N N 135 117.366 117.366 122.672 -5.306 25153 10095 1 11 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.665 -0.413 25153 10096 1 11 . 1 1 135 135 ASP C C 135 176.387 176.387 176.647 -0.260 25153 10097 1 11 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.357 1.853 25153 10098 1 11 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.243 -1.544 25153 10099 1 11 . 1 1 136 136 GLY N N 136 104.310 104.310 108.080 -3.770 25153 10100 1 11 . 1 1 136 136 GLY C C 136 174.922 174.922 174.934 -0.012 25153 10101 1 11 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.401 -0.301 25153 10102 1 11 . 1 1 136 136 GLY H H 136 7.610 7.610 8.351 -0.741 25153 10103 1 11 . 1 1 137 137 GLN N N 137 118.784 118.784 117.767 1.017 25153 10104 1 11 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.432 -0.377 25153 10105 1 11 . 1 1 137 137 GLN C C 137 176.390 176.390 175.444 0.946 25153 10106 1 11 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.800 1.840 25153 10107 1 11 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.222 0.008 25153 10108 1 11 . 1 1 137 137 GLN H H 137 7.870 7.870 7.887 -0.017 25153 10109 1 11 . 1 1 138 138 LEU N N 138 118.040 118.040 116.065 1.975 25153 10110 1 11 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.005 -0.018 25153 10111 1 11 . 1 1 138 138 LEU C C 138 175.913 175.913 175.215 0.698 25153 10112 1 11 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.215 0.385 25153 10113 1 11 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.849 1.551 25153 10114 1 11 . 1 1 138 138 LEU H H 138 7.356 7.356 7.214 0.142 25153 10115 1 11 . 1 1 139 139 PHE N N 139 119.060 119.060 119.327 -0.267 25153 10116 1 11 . 1 1 139 139 PHE HA H 139 5.310 5.310 5.002 0.308 25153 10117 1 11 . 1 1 139 139 PHE C C 139 178.780 178.780 177.850 0.930 25153 10118 1 11 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.859 -1.010 25153 10119 1 11 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.705 3.755 25153 10120 1 11 . 1 1 139 139 PHE H H 139 10.094 10.094 8.993 1.101 25153 10121 1 11 . 1 1 140 140 VAL N N 140 109.690 109.690 116.128 -6.438 25153 10122 1 11 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.821 -0.340 25153 10123 1 11 . 1 1 140 140 VAL C C 140 172.790 172.790 175.518 -2.728 25153 10124 1 11 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.434 -1.434 25153 10125 1 11 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.501 -0.951 25153 10126 1 11 . 1 1 140 140 VAL H H 140 7.470 7.470 8.101 -0.631 25153 10127 1 11 . 1 1 141 141 GLY N N 141 107.060 107.060 105.085 1.975 25153 10128 1 11 . 1 1 141 141 GLY C C 141 171.513 171.513 172.646 -1.133 25153 10129 1 11 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.093 1.337 25153 10130 1 11 . 1 1 141 141 GLY H H 141 7.137 7.137 7.305 -0.168 25153 10131 1 11 . 1 1 142 142 LEU N N 142 117.863 117.863 119.923 -2.060 25153 10132 1 11 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.060 -1.085 25153 10133 1 11 . 1 1 142 142 LEU C C 142 173.640 173.640 175.140 -1.500 25153 10134 1 11 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.928 0.991 25153 10135 1 11 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.181 -4.630 25153 10136 1 11 . 1 1 142 142 LEU H H 142 7.517 7.517 7.361 0.156 25153 10137 1 11 . 1 1 143 143 ALA N N 143 126.990 126.990 129.129 -2.139 25153 10138 1 11 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.628 -0.351 25153 10139 1 11 . 1 1 143 143 ALA C C 143 175.730 175.730 175.736 -0.006 25153 10140 1 11 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.209 -0.770 25153 10141 1 11 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.623 3.687 25153 10142 1 11 . 1 1 143 143 ALA H H 143 5.186 5.186 8.140 -2.954 25153 10143 1 11 . 1 1 144 144 LEU N N 144 125.477 125.477 124.547 0.930 25153 10144 1 11 . 1 1 144 144 LEU HA H 144 4.780 4.780 5.093 -0.313 25153 10145 1 11 . 1 1 144 144 LEU C C 144 174.473 174.473 175.555 -1.082 25153 10146 1 11 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.224 0.016 25153 10147 1 11 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.724 -0.423 25153 10148 1 11 . 1 1 144 144 LEU H H 144 8.758 8.758 8.313 0.445 25153 10149 1 11 . 1 1 145 145 ASP N N 145 118.915 118.915 118.928 -0.013 25153 10150 1 11 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.168 0.364 25153 10151 1 11 . 1 1 145 145 ASP C C 145 176.470 176.470 176.071 0.399 25153 10152 1 11 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.170 -0.541 25153 10153 1 11 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.036 -1.036 25153 10154 1 11 . 1 1 146 146 GLU N N 146 124.813 124.813 123.858 0.955 25153 10155 1 11 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.534 -0.158 25153 10156 1 11 . 1 1 146 146 GLU C C 146 177.290 177.290 176.350 0.940 25153 10157 1 11 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.868 0.252 25153 10158 1 11 . 1 1 146 146 GLU CB C 146 30.150 30.150 28.812 1.338 25153 10159 1 11 . 1 1 147 147 THR N N 147 118.328 118.328 113.225 5.103 25153 10160 1 11 . 1 1 147 147 THR HA H 147 4.200 4.200 4.677 -0.477 25153 10161 1 11 . 1 1 147 147 THR C C 147 175.683 175.683 174.610 1.073 25153 10162 1 11 . 1 1 147 147 THR CA C 147 66.250 66.250 63.111 3.139 25153 10163 1 11 . 1 1 147 147 THR CB C 147 69.600 69.600 70.133 -0.533 25153 10164 1 11 . 1 1 147 147 THR H H 147 8.562 8.562 8.778 -0.216 25153 10165 1 11 . 1 1 148 148 ASN N N 148 115.550 115.550 118.622 -3.072 25153 10166 1 11 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.845 0.142 25153 10167 1 11 . 1 1 148 148 ASN C C 148 175.870 175.870 174.955 0.915 25153 10168 1 11 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.804 -1.104 25153 10169 1 11 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.680 2.200 25153 10170 1 11 . 1 1 148 148 ASN H H 148 9.118 9.118 8.822 0.296 25153 10171 1 11 . 1 1 149 149 GLN N N 149 117.400 117.400 119.821 -2.421 25153 10172 1 11 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.235 0.608 25153 10173 1 11 . 1 1 149 149 GLN C C 149 177.780 177.780 176.336 1.444 25153 10174 1 11 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.130 -2.230 25153 10175 1 11 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.649 0.651 25153 10176 1 11 . 1 1 149 149 GLN H H 149 7.555 7.555 8.544 -0.989 25153 10177 1 11 . 1 1 150 150 TYR N N 150 120.674 120.674 118.201 2.473 25153 10178 1 11 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.143 0.385 25153 10179 1 11 . 1 1 150 150 TYR C C 150 177.830 177.830 176.421 1.409 25153 10180 1 11 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.062 0.425 25153 10181 1 11 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.863 -0.263 25153 10182 1 11 . 1 1 150 150 TYR H H 150 6.983 6.983 7.783 -0.800 25153 10183 1 11 . 1 1 151 151 ASP N N 151 120.810 120.810 119.505 1.305 25153 10184 1 11 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.630 -0.115 25153 10185 1 11 . 1 1 151 151 ASP C C 151 176.400 176.400 177.251 -0.851 25153 10186 1 11 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.974 -0.574 25153 10187 1 11 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.338 -2.258 25153 10188 1 11 . 1 1 152 152 LEU N N 152 118.083 118.083 112.956 5.127 25153 10189 1 11 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.688 -0.012 25153 10190 1 11 . 1 1 152 152 LEU C C 152 178.470 178.470 178.299 0.171 25153 10191 1 11 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.647 -1.047 25153 10192 1 11 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.101 -0.501 25153 10193 1 11 . 1 1 152 152 LEU H H 152 7.453 7.453 7.575 -0.122 25153 10194 1 11 . 1 1 153 153 SER N N 153 116.407 116.407 118.848 -2.441 25153 10195 1 11 . 1 1 153 153 SER HA H 153 3.960 3.960 4.011 -0.051 25153 10196 1 11 . 1 1 153 153 SER C C 153 174.590 174.590 175.802 -1.212 25153 10197 1 11 . 1 1 153 153 SER CA C 153 63.400 63.400 62.586 0.814 25153 10198 1 11 . 1 1 153 153 SER CB C 153 63.100 63.100 62.731 0.369 25153 10199 1 11 . 1 1 153 153 SER H H 153 7.360 7.360 8.488 -1.128 25153 10200 1 11 . 1 1 154 154 ASP N N 154 121.960 121.960 120.524 1.436 25153 10201 1 11 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.336 -0.026 25153 10202 1 11 . 1 1 154 154 ASP C C 154 178.640 178.640 177.723 0.917 25153 10203 1 11 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.436 1.564 25153 10204 1 11 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.936 -1.366 25153 10205 1 11 . 1 1 155 155 GLU N N 155 121.310 121.310 119.117 2.193 25153 10206 1 11 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.078 0.107 25153 10207 1 11 . 1 1 155 155 GLU C C 155 179.600 179.600 179.235 0.365 25153 10208 1 11 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.164 0.286 25153 10209 1 11 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.438 -0.038 25153 10210 1 11 . 1 1 156 156 ARG N N 156 121.394 121.394 118.608 2.786 25153 10211 1 11 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.428 -0.128 25153 10212 1 11 . 1 1 156 156 ARG C C 156 177.330 177.330 179.013 -1.683 25153 10213 1 11 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.214 2.246 25153 10214 1 11 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.113 0.647 25153 10215 1 11 . 1 1 157 157 ILE N N 157 118.390 118.390 121.935 -3.545 25153 10216 1 11 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.782 -0.348 25153 10217 1 11 . 1 1 157 157 ILE C C 157 178.814 178.814 177.721 1.093 25153 10218 1 11 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.041 0.653 25153 10219 1 11 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.735 1.118 25153 10220 1 11 . 1 1 157 157 ILE H H 157 8.966 8.966 7.733 1.233 25153 10221 1 11 . 1 1 158 158 GLN N N 158 120.060 120.060 118.932 1.128 25153 10222 1 11 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.999 -0.043 25153 10223 1 11 . 1 1 158 158 GLN C C 158 178.843 178.843 178.954 -0.111 25153 10224 1 11 . 1 1 158 158 GLN CA C 158 60.600 60.600 58.958 1.643 25153 10225 1 11 . 1 1 158 158 GLN CB C 158 28.390 28.390 27.957 0.433 25153 10226 1 11 . 1 1 158 158 GLN H H 158 8.394 8.394 8.067 0.327 25153 10227 1 11 . 1 1 159 159 SER N N 159 115.613 115.613 116.202 -0.589 25153 10228 1 11 . 1 1 159 159 SER HA H 159 4.455 4.455 4.399 0.056 25153 10229 1 11 . 1 1 159 159 SER C C 159 177.330 177.330 176.578 0.752 25153 10230 1 11 . 1 1 159 159 SER CA C 159 62.400 62.400 62.087 0.313 25153 10231 1 11 . 1 1 159 159 SER CB C 159 63.760 63.760 63.110 0.650 25153 10232 1 11 . 1 1 159 159 SER H H 159 8.460 8.460 8.456 0.004 25153 10233 1 11 . 1 1 160 160 TRP N N 160 126.820 126.820 125.038 1.782 25153 10234 1 11 . 1 1 160 160 TRP HA H 160 4.465 4.465 3.821 0.644 25153 10235 1 11 . 1 1 160 160 TRP C C 160 178.050 178.050 177.353 0.697 25153 10236 1 11 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.539 1.161 25153 10237 1 11 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.096 0.264 25153 10238 1 11 . 1 1 160 160 TRP H H 160 9.318 9.318 8.293 1.025 25153 10239 1 11 . 1 1 161 161 CYS N N 161 116.750 116.750 117.772 -1.022 25153 10240 1 11 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.752 0.131 25153 10241 1 11 . 1 1 161 161 CYS C C 161 176.270 176.270 176.834 -0.564 25153 10242 1 11 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.137 1.223 25153 10243 1 11 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.883 0.997 25153 10244 1 11 . 1 1 161 161 CYS H H 161 8.950 8.950 9.013 -0.063 25153 10245 1 11 . 1 1 162 162 GLU N N 162 118.096 118.096 120.239 -2.143 25153 10246 1 11 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.112 -0.182 25153 10247 1 11 . 1 1 162 162 GLU C C 162 178.680 178.680 177.579 1.101 25153 10248 1 11 . 1 1 162 162 GLU CA C 162 59.730 59.730 58.965 0.765 25153 10249 1 11 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.165 0.265 25153 10250 1 11 . 1 1 163 163 GLN N N 163 120.790 120.790 117.852 2.938 25153 10251 1 11 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.117 0.060 25153 10252 1 11 . 1 1 163 163 GLN C C 163 179.690 179.690 178.151 1.539 25153 10253 1 11 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.841 1.699 25153 10254 1 11 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.791 0.209 25153 10255 1 11 . 1 1 163 163 GLN H H 163 8.205 8.205 7.537 0.668 25153 10256 1 11 . 1 1 164 164 ILE N N 164 114.860 114.860 118.739 -3.879 25153 10257 1 11 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.880 0.163 25153 10258 1 11 . 1 1 164 164 ILE C C 164 178.680 178.680 177.294 1.386 25153 10259 1 11 . 1 1 164 164 ILE CA C 164 66.210 66.210 63.969 2.241 25153 10260 1 11 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.602 0.098 25153 10261 1 11 . 1 1 164 164 ILE H H 164 9.005 9.005 8.007 0.998 25153 10262 1 11 . 1 1 165 165 LEU N N 165 123.900 123.900 117.028 6.872 25153 10263 1 11 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.211 -0.061 25153 10264 1 11 . 1 1 165 165 LEU C C 165 180.520 180.520 177.693 2.827 25153 10265 1 11 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.141 1.159 25153 10266 1 11 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.060 -0.010 25153 10267 1 11 . 1 1 165 165 LEU H H 165 7.825 7.825 8.083 -0.258 25153 10268 1 11 . 1 1 166 166 ASN N N 166 120.112 120.112 118.326 1.786 25153 10269 1 11 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.651 -0.068 25153 10270 1 11 . 1 1 166 166 ASN C C 166 178.440 178.440 177.201 1.239 25153 10271 1 11 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.470 0.950 25153 10272 1 11 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.520 -1.100 25153 10273 1 11 . 1 1 166 166 ASN H H 166 7.760 7.760 8.052 -0.292 25153 10274 1 11 . 1 1 167 167 GLU N N 167 121.370 121.370 120.149 1.221 25153 10275 1 11 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.089 0.014 25153 10276 1 11 . 1 1 167 167 GLU C C 167 180.332 180.332 178.594 1.738 25153 10277 1 11 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.136 1.014 25153 10278 1 11 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.630 1.390 25153 10279 1 11 . 1 1 168 168 MET N N 168 118.532 118.532 116.766 1.766 25153 10280 1 11 . 1 1 168 168 MET HA H 168 4.015 4.015 4.476 -0.461 25153 10281 1 11 . 1 1 168 168 MET C C 168 176.600 176.600 177.648 -1.048 25153 10282 1 11 . 1 1 168 168 MET CA C 168 59.300 59.300 58.506 0.794 25153 10283 1 11 . 1 1 168 168 MET CB C 168 33.400 33.400 33.336 0.064 25153 10284 1 11 . 1 1 168 168 MET H H 168 8.718 8.718 8.393 0.325 25153 10285 1 11 . 1 1 169 169 ALA N N 169 121.922 121.922 122.881 -0.959 25153 10286 1 11 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.253 -0.079 25153 10287 1 11 . 1 1 169 169 ALA C C 169 179.410 179.410 179.766 -0.356 25153 10288 1 11 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.886 -0.486 25153 10289 1 11 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.507 -0.097 25153 10290 1 11 . 1 1 169 169 ALA H H 169 7.448 7.448 7.942 -0.494 25153 10291 1 11 . 1 1 170 170 GLU N N 170 117.300 117.300 117.436 -0.136 25153 10292 1 11 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.087 0.008 25153 10293 1 11 . 1 1 170 170 GLU C C 170 177.470 177.470 178.376 -0.906 25153 10294 1 11 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.662 -0.712 25153 10295 1 11 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.371 0.404 25153 10296 1 11 . 1 1 171 171 HIS N N 171 117.944 117.944 117.842 0.102 25153 10297 1 11 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.401 0.099 25153 10298 1 11 . 1 1 171 171 HIS C C 171 175.120 175.120 176.769 -1.649 25153 10299 1 11 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.321 -1.121 25153 10300 1 11 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.089 0.511 25153 10301 1 11 . 1 1 171 171 HIS H H 171 7.788 7.788 7.820 -0.032 25153 10302 1 11 . 1 1 172 172 TYR N N 172 120.040 120.040 118.579 1.461 25153 10303 1 11 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.462 0.131 25153 10304 1 11 . 1 1 172 172 TYR C C 172 174.612 174.612 175.968 -1.356 25153 10305 1 11 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.895 -0.915 25153 10306 1 11 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.859 0.121 25153 10307 1 11 . 1 1 172 172 TYR H H 172 7.820 7.820 8.027 -0.207 25153 10308 1 12 . 1 1 2 2 ASN N N 2 123.320 123.320 119.620 3.700 25153 10309 1 12 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.122 0.086 25153 10310 1 12 . 1 1 2 2 ASN C C 2 174.590 174.590 174.481 0.109 25153 10311 1 12 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.811 0.189 25153 10312 1 12 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.312 -0.342 25153 10313 1 12 . 1 1 2 2 ASN H H 2 9.428 9.428 8.701 0.727 25153 10314 1 12 . 1 1 3 3 MET N N 3 120.920 120.920 118.847 2.073 25153 10315 1 12 . 1 1 3 3 MET HA H 3 5.530 5.530 5.309 0.221 25153 10316 1 12 . 1 1 3 3 MET C C 3 174.400 174.400 174.897 -0.497 25153 10317 1 12 . 1 1 3 3 MET CA C 3 54.643 54.643 54.278 0.365 25153 10318 1 12 . 1 1 3 3 MET CB C 3 34.637 34.637 37.687 -3.050 25153 10319 1 12 . 1 1 3 3 MET H H 3 8.751 8.751 9.144 -0.393 25153 10320 1 12 . 1 1 4 4 GLY N N 4 115.542 115.542 109.057 6.485 25153 10321 1 12 . 1 1 4 4 GLY C C 4 170.413 170.413 172.162 -1.749 25153 10322 1 12 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.751 -0.649 25153 10323 1 12 . 1 1 4 4 GLY H H 4 8.927 8.927 8.848 0.079 25153 10324 1 12 . 1 1 5 5 LEU N N 5 131.030 131.030 128.321 2.709 25153 10325 1 12 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.085 1.317 25153 10326 1 12 . 1 1 5 5 LEU C C 5 175.952 175.952 174.630 1.322 25153 10327 1 12 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.370 1.081 25153 10328 1 12 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.087 3.505 25153 10329 1 12 . 1 1 5 5 LEU H H 5 8.928 8.928 8.616 0.312 25153 10330 1 12 . 1 1 6 6 PHE N N 6 125.790 125.790 126.370 -0.580 25153 10331 1 12 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.684 0.056 25153 10332 1 12 . 1 1 6 6 PHE C C 6 174.300 174.300 176.099 -1.799 25153 10333 1 12 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.920 -1.600 25153 10334 1 12 . 1 1 6 6 PHE CB C 6 41.230 41.230 40.981 0.249 25153 10335 1 12 . 1 1 6 6 PHE H H 6 9.237 9.237 9.247 -0.010 25153 10336 1 12 . 1 1 7 7 TYR N N 7 117.289 117.289 116.664 0.625 25153 10337 1 12 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.845 0.120 25153 10338 1 12 . 1 1 7 7 TYR C C 7 171.262 171.262 173.477 -2.215 25153 10339 1 12 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.467 -1.067 25153 10340 1 12 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.785 0.455 25153 10341 1 12 . 1 1 7 7 TYR H H 7 8.125 8.125 8.404 -0.279 25153 10342 1 12 . 1 1 8 8 GLY N N 8 107.420 107.420 106.456 0.964 25153 10343 1 12 . 1 1 8 8 GLY C C 8 172.000 172.000 172.511 -0.511 25153 10344 1 12 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.345 -0.401 25153 10345 1 12 . 1 1 8 8 GLY H H 8 7.031 7.031 8.413 -1.382 25153 10346 1 12 . 1 1 9 9 SER N N 9 118.150 118.150 117.461 0.689 25153 10347 1 12 . 1 1 9 9 SER HA H 9 5.200 5.200 5.087 0.113 25153 10348 1 12 . 1 1 9 9 SER C C 9 175.000 175.000 173.344 1.656 25153 10349 1 12 . 1 1 9 9 SER CA C 9 57.570 57.570 57.940 -0.370 25153 10350 1 12 . 1 1 9 9 SER CB C 9 66.700 66.700 65.891 0.809 25153 10351 1 12 . 1 1 9 9 SER H H 9 9.604 9.604 8.063 1.541 25153 10352 1 12 . 1 1 10 10 SER N N 10 131.193 131.193 118.849 12.344 25153 10353 1 12 . 1 1 10 10 SER HA H 10 4.775 4.775 4.843 -0.068 25153 10354 1 12 . 1 1 10 10 SER C C 10 175.730 175.730 176.066 -0.336 25153 10355 1 12 . 1 1 10 10 SER CA C 10 61.750 61.750 58.829 2.921 25153 10356 1 12 . 1 1 10 10 SER CB C 10 64.400 64.400 63.788 0.612 25153 10357 1 12 . 1 1 10 10 SER H H 10 11.636 11.636 9.018 2.618 25153 10358 1 12 . 1 1 11 11 THR N N 11 115.848 115.848 115.863 -0.015 25153 10359 1 12 . 1 1 11 11 THR HA H 11 4.770 4.770 4.396 0.374 25153 10360 1 12 . 1 1 11 11 THR C C 11 173.700 173.700 174.942 -1.242 25153 10361 1 12 . 1 1 11 11 THR CA C 11 60.700 60.700 64.226 -3.526 25153 10362 1 12 . 1 1 11 11 THR CB C 11 67.430 67.430 69.635 -2.205 25153 10363 1 12 . 1 1 11 11 THR H H 11 9.550 9.550 8.739 0.811 25153 10364 1 12 . 1 1 12 12 CYS N N 12 109.780 109.780 113.680 -3.900 25153 10365 1 12 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.611 -0.541 25153 10366 1 12 . 1 1 12 12 CYS C C 12 176.220 176.220 174.914 1.306 25153 10367 1 12 . 1 1 12 12 CYS CA C 12 63.600 63.600 59.026 4.574 25153 10368 1 12 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.861 -1.461 25153 10369 1 12 . 1 1 12 12 CYS H H 12 7.437 7.437 8.017 -0.580 25153 10370 1 12 . 1 1 13 13 TYR N N 13 127.830 127.830 123.942 3.888 25153 10371 1 12 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.267 -0.164 25153 10372 1 12 . 1 1 13 13 TYR C C 13 180.880 180.880 177.511 3.369 25153 10373 1 12 . 1 1 13 13 TYR CA C 13 65.100 65.100 62.673 2.427 25153 10374 1 12 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.466 -0.631 25153 10375 1 12 . 1 1 13 13 TYR H H 13 10.886 10.886 7.215 3.671 25153 10376 1 12 . 1 1 14 14 THR N N 14 124.428 124.428 113.813 10.615 25153 10377 1 12 . 1 1 14 14 THR HA H 14 4.160 4.160 4.173 -0.013 25153 10378 1 12 . 1 1 14 14 THR C C 14 177.760 177.760 176.115 1.645 25153 10379 1 12 . 1 1 14 14 THR CA C 14 67.823 67.823 66.688 1.135 25153 10380 1 12 . 1 1 14 14 THR CB C 14 68.040 68.040 68.175 -0.135 25153 10381 1 12 . 1 1 14 14 THR H H 14 11.405 11.405 8.610 2.795 25153 10382 1 12 . 1 1 15 15 GLU N N 15 123.050 123.050 123.038 0.012 25153 10383 1 12 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.372 -0.481 25153 10384 1 12 . 1 1 15 15 GLU C C 15 176.392 176.392 178.252 -1.860 25153 10385 1 12 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.472 -0.272 25153 10386 1 12 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.336 1.114 25153 10387 1 12 . 1 1 16 16 MET N N 16 120.173 120.173 118.452 1.721 25153 10388 1 12 . 1 1 16 16 MET HA H 16 4.050 4.050 4.126 -0.076 25153 10389 1 12 . 1 1 16 16 MET C C 16 179.940 179.940 178.644 1.296 25153 10390 1 12 . 1 1 16 16 MET CA C 16 59.240 59.240 59.247 -0.007 25153 10391 1 12 . 1 1 16 16 MET CB C 16 32.970 32.970 32.849 0.121 25153 10392 1 12 . 1 1 16 16 MET H H 16 8.469 8.469 8.514 -0.045 25153 10393 1 12 . 1 1 17 17 ALA N N 17 121.930 121.930 121.778 0.152 25153 10394 1 12 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.845 -0.009 25153 10395 1 12 . 1 1 17 17 ALA C C 17 177.900 177.900 178.749 -0.849 25153 10396 1 12 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.170 0.030 25153 10397 1 12 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.087 -0.087 25153 10398 1 12 . 1 1 17 17 ALA H H 17 7.880 7.880 8.125 -0.245 25153 10399 1 12 . 1 1 18 18 ALA N N 18 121.477 121.477 121.258 0.219 25153 10400 1 12 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.761 -0.024 25153 10401 1 12 . 1 1 18 18 ALA C C 18 179.380 179.380 179.373 0.007 25153 10402 1 12 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.155 -0.155 25153 10403 1 12 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.773 1.057 25153 10404 1 12 . 1 1 18 18 ALA H H 18 7.374 7.374 8.167 -0.793 25153 10405 1 12 . 1 1 19 19 GLU N N 19 116.650 116.650 118.135 -1.485 25153 10406 1 12 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.831 -0.215 25153 10407 1 12 . 1 1 19 19 GLU C C 19 178.479 178.479 179.295 -0.816 25153 10408 1 12 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.486 0.243 25153 10409 1 12 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.378 -0.078 25153 10410 1 12 . 1 1 20 20 LYS N N 20 119.470 119.470 119.859 -0.389 25153 10411 1 12 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.012 0.038 25153 10412 1 12 . 1 1 20 20 LYS C C 20 179.116 179.116 179.048 0.068 25153 10413 1 12 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.460 0.370 25153 10414 1 12 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.440 0.410 25153 10415 1 12 . 1 1 21 21 ILE N N 21 121.030 121.030 120.684 0.346 25153 10416 1 12 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.673 -0.283 25153 10417 1 12 . 1 1 21 21 ILE C C 21 177.580 177.580 178.188 -0.608 25153 10418 1 12 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.750 0.070 25153 10419 1 12 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.878 0.470 25153 10420 1 12 . 1 1 21 21 ILE H H 21 8.100 8.100 8.602 -0.502 25153 10421 1 12 . 1 1 22 22 ARG N N 22 119.720 119.720 119.485 0.235 25153 10422 1 12 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.837 -0.282 25153 10423 1 12 . 1 1 22 22 ARG C C 22 177.320 177.320 178.146 -0.826 25153 10424 1 12 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.724 -0.003 25153 10425 1 12 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.692 -0.760 25153 10426 1 12 . 1 1 23 23 ASP N N 23 118.730 118.730 119.236 -0.506 25153 10427 1 12 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.411 -0.048 25153 10428 1 12 . 1 1 23 23 ASP C C 23 178.330 178.330 178.782 -0.452 25153 10429 1 12 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.336 -0.386 25153 10430 1 12 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.855 -0.615 25153 10431 1 12 . 1 1 24 24 ILE N N 24 121.090 121.090 119.540 1.550 25153 10432 1 12 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.780 0.016 25153 10433 1 12 . 1 1 24 24 ILE C C 24 178.250 178.250 177.942 0.308 25153 10434 1 12 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.835 -0.685 25153 10435 1 12 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.256 0.224 25153 10436 1 12 . 1 1 24 24 ILE H H 24 7.910 7.910 8.282 -0.372 25153 10437 1 12 . 1 1 25 25 ILE N N 25 121.406 121.406 117.323 4.083 25153 10438 1 12 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.868 -0.222 25153 10439 1 12 . 1 1 25 25 ILE C C 25 176.800 176.800 176.771 0.029 25153 10440 1 12 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.041 2.659 25153 10441 1 12 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.930 -0.740 25153 10442 1 12 . 1 1 25 25 ILE H H 25 8.476 8.476 8.135 0.341 25153 10443 1 12 . 1 1 26 26 GLY N N 26 108.900 108.900 105.097 3.803 25153 10444 1 12 . 1 1 26 26 GLY C C 26 173.710 173.710 172.257 1.453 25153 10445 1 12 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.708 -0.378 25153 10446 1 12 . 1 1 26 26 GLY H H 26 8.016 8.016 7.787 0.229 25153 10447 1 12 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.704 -0.366 25153 10448 1 12 . 1 1 27 27 PRO C C 27 177.200 177.200 177.163 0.037 25153 10449 1 12 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.539 1.147 25153 10450 1 12 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.039 0.161 25153 10451 1 12 . 1 1 28 28 GLU N N 28 116.295 116.295 118.211 -1.916 25153 10452 1 12 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.196 0.074 25153 10453 1 12 . 1 1 28 28 GLU C C 28 176.980 176.980 177.175 -0.195 25153 10454 1 12 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.472 -0.732 25153 10455 1 12 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.539 -0.869 25153 10456 1 12 . 1 1 29 29 LEU N N 29 120.250 120.250 112.521 7.729 25153 10457 1 12 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.660 -0.024 25153 10458 1 12 . 1 1 29 29 LEU C C 29 175.770 175.770 175.791 -0.021 25153 10459 1 12 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.548 0.252 25153 10460 1 12 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.060 1.040 25153 10461 1 12 . 1 1 29 29 LEU H H 29 7.940 7.940 7.577 0.363 25153 10462 1 12 . 1 1 30 30 VAL N N 30 118.693 118.693 120.891 -2.198 25153 10463 1 12 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.775 -0.127 25153 10464 1 12 . 1 1 30 30 VAL C C 30 174.347 174.347 175.765 -1.418 25153 10465 1 12 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.457 -0.589 25153 10466 1 12 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.934 1.646 25153 10467 1 12 . 1 1 30 30 VAL H H 30 7.434 7.434 8.017 -0.583 25153 10468 1 12 . 1 1 31 31 THR N N 31 123.800 123.800 122.126 1.674 25153 10469 1 12 . 1 1 31 31 THR HA H 31 4.362 4.362 4.577 -0.215 25153 10470 1 12 . 1 1 31 31 THR C C 31 172.964 172.964 173.327 -0.363 25153 10471 1 12 . 1 1 31 31 THR CA C 31 61.720 61.720 60.858 0.862 25153 10472 1 12 . 1 1 31 31 THR CB C 31 70.485 70.485 70.814 -0.329 25153 10473 1 12 . 1 1 31 31 THR H H 31 7.844 7.844 8.202 -0.358 25153 10474 1 12 . 1 1 32 32 LEU N N 32 127.800 127.800 127.308 0.492 25153 10475 1 12 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.543 0.141 25153 10476 1 12 . 1 1 32 32 LEU C C 32 176.600 176.600 176.518 0.082 25153 10477 1 12 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.131 0.024 25153 10478 1 12 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.717 1.133 25153 10479 1 12 . 1 1 32 32 LEU H H 32 8.660 8.660 8.596 0.064 25153 10480 1 12 . 1 1 33 33 HIS N N 33 119.670 119.670 120.049 -0.379 25153 10481 1 12 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.817 -0.417 25153 10482 1 12 . 1 1 33 33 HIS C C 33 171.667 171.667 173.161 -1.494 25153 10483 1 12 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.203 -0.003 25153 10484 1 12 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.883 0.317 25153 10485 1 12 . 1 1 33 33 HIS H H 33 9.060 9.060 8.799 0.261 25153 10486 1 12 . 1 1 34 34 ASN N N 34 124.068 124.068 122.822 1.246 25153 10487 1 12 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.013 -0.579 25153 10488 1 12 . 1 1 34 34 ASN C C 34 178.000 178.000 176.035 1.965 25153 10489 1 12 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.580 -0.151 25153 10490 1 12 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.072 -0.512 25153 10491 1 12 . 1 1 34 34 ASN H H 34 8.780 8.780 8.535 0.245 25153 10492 1 12 . 1 1 35 35 LEU N N 35 129.040 129.040 126.419 2.621 25153 10493 1 12 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.199 0.116 25153 10494 1 12 . 1 1 35 35 LEU C C 35 177.700 177.700 177.913 -0.213 25153 10495 1 12 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.404 0.076 25153 10496 1 12 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.880 1.420 25153 10497 1 12 . 1 1 35 35 LEU H H 35 8.821 8.821 8.586 0.235 25153 10498 1 12 . 1 1 36 36 LYS N N 36 121.043 121.043 116.717 4.326 25153 10499 1 12 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.990 -0.110 25153 10500 1 12 . 1 1 36 36 LYS C C 36 176.230 176.230 177.366 -1.136 25153 10501 1 12 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.531 0.889 25153 10502 1 12 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.477 0.793 25153 10503 1 12 . 1 1 37 37 ASP N N 37 114.965 114.965 117.603 -2.638 25153 10504 1 12 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.798 -0.021 25153 10505 1 12 . 1 1 37 37 ASP C C 37 175.440 175.440 175.866 -0.426 25153 10506 1 12 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.389 0.322 25153 10507 1 12 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.539 1.161 25153 10508 1 12 . 1 1 38 38 ASP N N 38 121.650 121.650 121.630 0.020 25153 10509 1 12 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.916 -0.046 25153 10510 1 12 . 1 1 38 38 ASP C C 38 174.852 174.852 176.018 -1.166 25153 10511 1 12 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.313 -1.233 25153 10512 1 12 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.545 -0.435 25153 10513 1 12 . 1 1 39 39 SER N N 39 115.207 115.207 117.283 -2.076 25153 10514 1 12 . 1 1 39 39 SER HA H 39 4.585 4.585 4.667 -0.082 25153 10515 1 12 . 1 1 39 39 SER C C 39 175.040 175.040 174.284 0.756 25153 10516 1 12 . 1 1 39 39 SER CA C 39 54.960 54.960 56.473 -1.513 25153 10517 1 12 . 1 1 39 39 SER CB C 39 64.720 64.720 63.461 1.260 25153 10518 1 12 . 1 1 39 39 SER H H 39 8.351 8.351 8.602 -0.251 25153 10519 1 12 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.220 -0.215 25153 10520 1 12 . 1 1 40 40 PRO C C 40 176.730 176.730 177.826 -1.096 25153 10521 1 12 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.121 -0.221 25153 10522 1 12 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.895 -0.495 25153 10523 1 12 . 1 1 41 41 LYS N N 41 121.150 121.150 119.647 1.503 25153 10524 1 12 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.032 -0.120 25153 10525 1 12 . 1 1 41 41 LYS C C 41 179.600 179.600 178.575 1.025 25153 10526 1 12 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.430 -1.230 25153 10527 1 12 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.549 0.451 25153 10528 1 12 . 1 1 42 42 LEU N N 42 118.103 118.103 116.261 1.842 25153 10529 1 12 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.171 -0.134 25153 10530 1 12 . 1 1 42 42 LEU C C 42 178.760 178.760 178.813 -0.053 25153 10531 1 12 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.221 -0.041 25153 10532 1 12 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.804 1.169 25153 10533 1 12 . 1 1 42 42 LEU H H 42 7.600 7.600 7.680 -0.080 25153 10534 1 12 . 1 1 43 43 MET N N 43 118.917 118.917 116.866 2.051 25153 10535 1 12 . 1 1 43 43 MET HA H 43 3.750 3.750 4.440 -0.690 25153 10536 1 12 . 1 1 43 43 MET C C 43 177.680 177.680 176.864 0.816 25153 10537 1 12 . 1 1 43 43 MET CA C 43 59.730 59.730 58.059 1.671 25153 10538 1 12 . 1 1 43 43 MET CB C 43 32.700 32.700 31.835 0.865 25153 10539 1 12 . 1 1 43 43 MET H H 43 8.202 8.202 8.049 0.153 25153 10540 1 12 . 1 1 44 44 GLU N N 44 110.924 110.924 117.521 -6.597 25153 10541 1 12 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.293 -0.553 25153 10542 1 12 . 1 1 44 44 GLU C C 44 178.130 178.130 178.986 -0.856 25153 10543 1 12 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.073 1.327 25153 10544 1 12 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.997 -0.447 25153 10545 1 12 . 1 1 45 45 GLN N N 45 115.756 115.756 118.701 -2.945 25153 10546 1 12 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.049 0.134 25153 10547 1 12 . 1 1 45 45 GLN C C 45 175.414 175.414 177.260 -1.846 25153 10548 1 12 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.637 -1.457 25153 10549 1 12 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.133 -0.533 25153 10550 1 12 . 1 1 45 45 GLN H H 45 7.516 7.516 7.516 -0.000 25153 10551 1 12 . 1 1 46 46 TYR N N 46 117.860 117.860 118.744 -0.884 25153 10552 1 12 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.333 0.330 25153 10553 1 12 . 1 1 46 46 TYR C C 46 175.500 175.500 177.177 -1.677 25153 10554 1 12 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.678 -1.192 25153 10555 1 12 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.253 3.217 25153 10556 1 12 . 1 1 46 46 TYR H H 46 6.996 6.996 7.269 -0.273 25153 10557 1 12 . 1 1 47 47 ASP N N 47 121.683 121.683 121.320 0.363 25153 10558 1 12 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.652 0.048 25153 10559 1 12 . 1 1 47 47 ASP C C 47 175.610 175.610 175.385 0.225 25153 10560 1 12 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.439 -0.739 25153 10561 1 12 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.997 1.003 25153 10562 1 12 . 1 1 48 48 VAL N N 48 118.628 118.628 116.431 2.197 25153 10563 1 12 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.816 0.218 25153 10564 1 12 . 1 1 48 48 VAL C C 48 174.190 174.190 173.870 0.320 25153 10565 1 12 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.107 -0.917 25153 10566 1 12 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.801 0.299 25153 10567 1 12 . 1 1 48 48 VAL H H 48 7.628 7.628 7.404 0.224 25153 10568 1 12 . 1 1 49 49 LEU N N 49 128.190 128.190 124.586 3.604 25153 10569 1 12 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.435 0.168 25153 10570 1 12 . 1 1 49 49 LEU C C 49 174.880 174.880 175.718 -0.838 25153 10571 1 12 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.577 -0.337 25153 10572 1 12 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.624 -0.284 25153 10573 1 12 . 1 1 49 49 LEU H H 49 9.407 9.407 9.153 0.254 25153 10574 1 12 . 1 1 50 50 ILE N N 50 124.550 124.550 120.534 4.016 25153 10575 1 12 . 1 1 50 50 ILE HA H 50 5.700 5.700 4.941 0.759 25153 10576 1 12 . 1 1 50 50 ILE C C 50 175.300 175.300 174.613 0.687 25153 10577 1 12 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.068 -1.204 25153 10578 1 12 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.895 -0.645 25153 10579 1 12 . 1 1 50 50 ILE H H 50 9.238 9.238 9.165 0.073 25153 10580 1 12 . 1 1 51 51 LEU N N 51 127.460 127.460 128.317 -0.857 25153 10581 1 12 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.811 0.374 25153 10582 1 12 . 1 1 51 51 LEU C C 51 174.544 174.544 175.851 -1.307 25153 10583 1 12 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.621 -0.801 25153 10584 1 12 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.123 -2.486 25153 10585 1 12 . 1 1 51 51 LEU H H 51 9.228 9.228 9.306 -0.078 25153 10586 1 12 . 1 1 52 52 GLY N N 52 107.760 107.760 111.449 -3.689 25153 10587 1 12 . 1 1 52 52 GLY C C 52 174.710 174.710 172.482 2.228 25153 10588 1 12 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.917 -0.047 25153 10589 1 12 . 1 1 52 52 GLY H H 52 8.860 8.860 8.778 0.082 25153 10590 1 12 . 1 1 53 53 ILE N N 53 123.890 123.890 120.070 3.820 25153 10591 1 12 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.827 0.443 25153 10592 1 12 . 1 1 53 53 ILE C C 53 172.630 172.630 173.135 -0.505 25153 10593 1 12 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.661 0.019 25153 10594 1 12 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.259 3.901 25153 10595 1 12 . 1 1 53 53 ILE H H 53 8.458 8.458 8.078 0.380 25153 10596 1 12 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.660 0.728 25153 10597 1 12 . 1 1 54 54 PRO C C 54 175.000 175.000 176.241 -1.241 25153 10598 1 12 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.845 -0.245 25153 10599 1 12 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.733 -0.433 25153 10600 1 12 . 1 1 55 55 THR N N 55 112.754 112.754 119.816 -7.062 25153 10601 1 12 . 1 1 55 55 THR HA H 55 4.452 4.452 4.676 -0.224 25153 10602 1 12 . 1 1 55 55 THR C C 55 172.480 172.480 174.202 -1.722 25153 10603 1 12 . 1 1 55 55 THR CA C 55 62.350 62.350 63.904 -1.554 25153 10604 1 12 . 1 1 55 55 THR CB C 55 70.230 70.230 69.726 0.504 25153 10605 1 12 . 1 1 55 55 THR H H 55 6.523 6.523 7.944 -1.421 25153 10606 1 12 . 1 1 56 56 TRP N N 56 130.044 130.044 127.334 2.710 25153 10607 1 12 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.670 -1.955 25153 10608 1 12 . 1 1 56 56 TRP C C 56 172.890 172.890 175.310 -2.420 25153 10609 1 12 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.569 0.081 25153 10610 1 12 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.916 1.085 25153 10611 1 12 . 1 1 56 56 TRP H H 56 8.450 8.450 8.932 -0.482 25153 10612 1 12 . 1 1 57 57 ASP N N 57 115.275 115.275 120.401 -5.126 25153 10613 1 12 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.046 0.306 25153 10614 1 12 . 1 1 57 57 ASP C C 57 173.660 173.660 174.925 -1.265 25153 10615 1 12 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.019 1.211 25153 10616 1 12 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.814 0.356 25153 10617 1 12 . 1 1 58 58 PHE N N 58 112.840 112.840 116.273 -3.433 25153 10618 1 12 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.704 -0.380 25153 10619 1 12 . 1 1 58 58 PHE C C 58 175.730 175.730 176.128 -0.398 25153 10620 1 12 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.918 0.905 25153 10621 1 12 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.091 -2.337 25153 10622 1 12 . 1 1 58 58 PHE H H 58 7.640 7.640 7.537 0.103 25153 10623 1 12 . 1 1 59 59 GLY N N 59 104.940 104.940 104.931 0.009 25153 10624 1 12 . 1 1 59 59 GLY C C 59 173.750 173.750 174.966 -1.216 25153 10625 1 12 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.422 0.868 25153 10626 1 12 . 1 1 59 59 GLY H H 59 8.024 8.024 8.639 -0.615 25153 10627 1 12 . 1 1 60 60 GLU N N 60 120.045 120.045 119.742 0.303 25153 10628 1 12 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.411 0.002 25153 10629 1 12 . 1 1 60 60 GLU C C 60 176.050 176.050 176.094 -0.044 25153 10630 1 12 . 1 1 60 60 GLU CA C 60 54.620 54.620 56.042 -1.422 25153 10631 1 12 . 1 1 60 60 GLU CB C 60 30.610 30.610 30.933 -0.323 25153 10632 1 12 . 1 1 61 61 ILE N N 61 120.790 120.790 121.502 -0.712 25153 10633 1 12 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.119 -0.652 25153 10634 1 12 . 1 1 61 61 ILE C C 61 175.130 175.130 176.190 -1.060 25153 10635 1 12 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.366 0.181 25153 10636 1 12 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.845 0.005 25153 10637 1 12 . 1 1 61 61 ILE H H 61 8.200 8.200 8.427 -0.227 25153 10638 1 12 . 1 1 62 62 GLN N N 62 124.520 124.520 124.840 -0.320 25153 10639 1 12 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.110 -0.154 25153 10640 1 12 . 1 1 62 62 GLN C C 62 177.160 177.160 177.065 0.095 25153 10641 1 12 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.752 1.858 25153 10642 1 12 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.282 -2.632 25153 10643 1 12 . 1 1 62 62 GLN H H 62 5.667 5.667 8.805 -3.138 25153 10644 1 12 . 1 1 63 63 GLU N N 63 124.570 124.570 126.689 -2.119 25153 10645 1 12 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.062 -0.076 25153 10646 1 12 . 1 1 63 63 GLU C C 63 177.300 177.300 176.953 0.347 25153 10647 1 12 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.412 1.308 25153 10648 1 12 . 1 1 63 63 GLU CB C 63 30.120 30.120 28.893 1.227 25153 10649 1 12 . 1 1 64 64 ASP N N 64 119.060 119.060 117.523 1.537 25153 10650 1 12 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.412 0.208 25153 10651 1 12 . 1 1 64 64 ASP C C 64 179.180 179.180 177.087 2.093 25153 10652 1 12 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.007 1.944 25153 10653 1 12 . 1 1 64 64 ASP CB C 64 40.950 40.950 39.718 1.232 25153 10654 1 12 . 1 1 65 65 TRP N N 65 121.070 121.070 120.742 0.328 25153 10655 1 12 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.611 -0.271 25153 10656 1 12 . 1 1 65 65 TRP C C 65 178.970 178.970 178.289 0.681 25153 10657 1 12 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.496 0.324 25153 10658 1 12 . 1 1 65 65 TRP CB C 65 30.400 30.400 31.091 -0.691 25153 10659 1 12 . 1 1 65 65 TRP H H 65 7.350 7.350 7.775 -0.425 25153 10660 1 12 . 1 1 66 66 GLU N N 66 120.900 120.900 119.308 1.592 25153 10661 1 12 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.888 -0.048 25153 10662 1 12 . 1 1 66 66 GLU C C 66 178.750 178.750 179.112 -0.362 25153 10663 1 12 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.574 0.426 25153 10664 1 12 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.295 -0.435 25153 10665 1 12 . 1 1 67 67 ALA N N 67 119.130 119.130 119.887 -0.757 25153 10666 1 12 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.236 0.017 25153 10667 1 12 . 1 1 67 67 ALA C C 67 179.410 179.410 179.174 0.236 25153 10668 1 12 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.802 -0.222 25153 10669 1 12 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.930 -0.120 25153 10670 1 12 . 1 1 67 67 ALA H H 67 7.640 7.640 8.098 -0.458 25153 10671 1 12 . 1 1 68 68 VAL N N 68 106.845 106.845 111.780 -4.935 25153 10672 1 12 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.481 0.329 25153 10673 1 12 . 1 1 68 68 VAL C C 68 176.750 176.750 176.906 -0.156 25153 10674 1 12 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.663 -3.053 25153 10675 1 12 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.462 0.158 25153 10676 1 12 . 1 1 68 68 VAL H H 68 7.219 7.219 7.538 -0.319 25153 10677 1 12 . 1 1 69 69 TRP N N 69 127.630 127.630 123.852 3.778 25153 10678 1 12 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.321 -0.083 25153 10679 1 12 . 1 1 69 69 TRP C C 69 178.670 178.670 177.283 1.387 25153 10680 1 12 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.151 -0.931 25153 10681 1 12 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.491 2.139 25153 10682 1 12 . 1 1 69 69 TRP H H 69 7.832 7.832 8.608 -0.776 25153 10683 1 12 . 1 1 70 70 ASP N N 70 114.544 114.544 118.363 -3.819 25153 10684 1 12 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.467 0.055 25153 10685 1 12 . 1 1 70 70 ASP C C 70 178.670 178.670 178.988 -0.318 25153 10686 1 12 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.302 -1.302 25153 10687 1 12 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.987 -1.137 25153 10688 1 12 . 1 1 71 71 GLN N N 71 120.040 120.040 119.529 0.511 25153 10689 1 12 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.123 0.061 25153 10690 1 12 . 1 1 71 71 GLN C C 71 178.910 178.910 178.800 0.110 25153 10691 1 12 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.335 -0.725 25153 10692 1 12 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.841 0.259 25153 10693 1 12 . 1 1 71 71 GLN H H 71 7.995 7.995 7.670 0.325 25153 10694 1 12 . 1 1 72 72 LEU N N 72 117.400 117.400 119.725 -2.325 25153 10695 1 12 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.928 -0.115 25153 10696 1 12 . 1 1 72 72 LEU C C 72 178.650 178.650 178.111 0.539 25153 10697 1 12 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.371 -0.171 25153 10698 1 12 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.224 0.186 25153 10699 1 12 . 1 1 72 72 LEU H H 72 7.450 7.450 8.024 -0.574 25153 10700 1 12 . 1 1 73 73 ASP N N 73 115.750 115.750 118.434 -2.684 25153 10701 1 12 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.374 -0.206 25153 10702 1 12 . 1 1 73 73 ASP C C 73 177.560 177.560 177.483 0.077 25153 10703 1 12 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.738 0.662 25153 10704 1 12 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.170 -1.070 25153 10705 1 12 . 1 1 74 74 ASP N N 74 117.223 117.223 119.660 -2.437 25153 10706 1 12 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.547 0.156 25153 10707 1 12 . 1 1 74 74 ASP C C 74 176.388 176.388 177.126 -0.738 25153 10708 1 12 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.284 -0.784 25153 10709 1 12 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.514 0.186 25153 10710 1 12 . 1 1 75 75 LEU N N 75 118.316 118.316 119.447 -1.131 25153 10711 1 12 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.352 -0.067 25153 10712 1 12 . 1 1 75 75 LEU C C 75 176.820 176.820 175.757 1.063 25153 10713 1 12 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.526 -0.126 25153 10714 1 12 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.329 0.951 25153 10715 1 12 . 1 1 75 75 LEU H H 75 6.960 6.960 7.363 -0.403 25153 10716 1 12 . 1 1 76 76 ASN N N 76 123.045 123.045 118.604 4.441 25153 10717 1 12 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.993 -0.103 25153 10718 1 12 . 1 1 76 76 ASN C C 76 174.950 174.950 174.879 0.071 25153 10719 1 12 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.680 -0.630 25153 10720 1 12 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.877 -1.377 25153 10721 1 12 . 1 1 76 76 ASN H H 76 9.890 9.890 8.798 1.092 25153 10722 1 12 . 1 1 77 77 LEU N N 77 123.494 123.494 123.335 0.159 25153 10723 1 12 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.566 -0.196 25153 10724 1 12 . 1 1 77 77 LEU C C 77 175.040 175.040 176.081 -1.041 25153 10725 1 12 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.509 -1.259 25153 10726 1 12 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.655 0.245 25153 10727 1 12 . 1 1 77 77 LEU H H 77 8.730 8.730 8.038 0.692 25153 10728 1 12 . 1 1 78 78 GLU N N 78 120.870 120.870 121.527 -0.657 25153 10729 1 12 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.447 -0.547 25153 10730 1 12 . 1 1 78 78 GLU C C 78 178.660 178.660 177.802 0.858 25153 10731 1 12 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.217 1.543 25153 10732 1 12 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.267 1.133 25153 10733 1 12 . 1 1 79 79 GLY N N 79 113.240 113.240 113.830 -0.590 25153 10734 1 12 . 1 1 79 79 GLY C C 79 174.460 174.460 174.270 0.190 25153 10735 1 12 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.168 0.262 25153 10736 1 12 . 1 1 79 79 GLY H H 79 8.474 8.474 8.702 -0.228 25153 10737 1 12 . 1 1 80 80 LYS N N 80 120.295 120.295 119.885 0.410 25153 10738 1 12 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.473 -0.115 25153 10739 1 12 . 1 1 80 80 LYS C C 80 175.360 175.360 176.018 -0.658 25153 10740 1 12 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.004 0.966 25153 10741 1 12 . 1 1 80 80 LYS CB C 80 33.200 33.200 34.009 -0.809 25153 10742 1 12 . 1 1 81 81 ILE N N 81 122.400 122.400 121.421 0.979 25153 10743 1 12 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.671 0.122 25153 10744 1 12 . 1 1 81 81 ILE C C 81 174.760 174.760 175.459 -0.699 25153 10745 1 12 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.462 -1.632 25153 10746 1 12 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.985 -0.285 25153 10747 1 12 . 1 1 81 81 ILE H H 81 7.400 7.400 7.769 -0.369 25153 10748 1 12 . 1 1 82 82 VAL N N 82 127.840 127.840 126.022 1.818 25153 10749 1 12 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.982 0.280 25153 10750 1 12 . 1 1 82 82 VAL C C 82 172.724 172.724 174.344 -1.620 25153 10751 1 12 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.653 -0.243 25153 10752 1 12 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.413 -0.013 25153 10753 1 12 . 1 1 82 82 VAL H H 82 8.790 8.790 8.723 0.067 25153 10754 1 12 . 1 1 83 83 ALA N N 83 131.347 131.347 129.965 1.382 25153 10755 1 12 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.344 0.038 25153 10756 1 12 . 1 1 83 83 ALA C C 83 175.750 175.750 176.379 -0.629 25153 10757 1 12 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.090 -0.221 25153 10758 1 12 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.770 2.680 25153 10759 1 12 . 1 1 83 83 ALA H H 83 9.300 9.300 8.829 0.471 25153 10760 1 12 . 1 1 84 84 LEU N N 84 124.200 124.200 126.610 -2.410 25153 10761 1 12 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.715 -0.195 25153 10762 1 12 . 1 1 84 84 LEU C C 84 175.760 175.760 176.837 -1.077 25153 10763 1 12 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.868 -0.368 25153 10764 1 12 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.440 1.460 25153 10765 1 12 . 1 1 84 84 LEU H H 84 10.287 10.287 8.987 1.300 25153 10766 1 12 . 1 1 85 85 TYR N N 85 115.912 115.912 118.902 -2.990 25153 10767 1 12 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.360 -0.400 25153 10768 1 12 . 1 1 85 85 TYR C C 85 172.372 172.372 173.766 -1.394 25153 10769 1 12 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.262 0.838 25153 10770 1 12 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.489 1.541 25153 10771 1 12 . 1 1 85 85 TYR H H 85 9.257 9.257 8.830 0.427 25153 10772 1 12 . 1 1 86 86 GLY N N 86 107.800 107.800 105.660 2.140 25153 10773 1 12 . 1 1 86 86 GLY C C 86 170.330 170.330 171.467 -1.137 25153 10774 1 12 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.942 -0.572 25153 10775 1 12 . 1 1 86 86 GLY H H 86 9.027 9.027 8.619 0.408 25153 10776 1 12 . 1 1 87 87 LEU N N 87 123.458 123.458 118.360 5.098 25153 10777 1 12 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.313 0.152 25153 10778 1 12 . 1 1 87 87 LEU C C 87 178.100 178.100 176.043 2.057 25153 10779 1 12 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.760 0.830 25153 10780 1 12 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.459 -0.119 25153 10781 1 12 . 1 1 87 87 LEU H H 87 6.580 6.580 7.767 -1.187 25153 10782 1 12 . 1 1 88 88 GLY N N 88 108.966 108.966 107.145 1.821 25153 10783 1 12 . 1 1 88 88 GLY C C 88 172.820 172.820 171.340 1.480 25153 10784 1 12 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.905 0.755 25153 10785 1 12 . 1 1 88 88 GLY H H 88 8.070 8.070 8.201 -0.131 25153 10786 1 12 . 1 1 89 89 ASP N N 89 121.150 121.150 117.556 3.594 25153 10787 1 12 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.067 0.179 25153 10788 1 12 . 1 1 89 89 ASP C C 89 176.220 176.220 176.065 0.155 25153 10789 1 12 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.535 -0.065 25153 10790 1 12 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.417 -0.937 25153 10791 1 12 . 1 1 90 90 GLN N N 90 123.970 123.970 121.975 1.995 25153 10792 1 12 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.045 -0.557 25153 10793 1 12 . 1 1 90 90 GLN C C 90 173.646 173.646 176.033 -2.387 25153 10794 1 12 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.311 0.999 25153 10795 1 12 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.561 -0.351 25153 10796 1 12 . 1 1 90 90 GLN H H 90 8.623 8.623 8.529 0.094 25153 10797 1 12 . 1 1 91 91 LEU N N 91 118.017 118.017 119.778 -1.761 25153 10798 1 12 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.095 0.280 25153 10799 1 12 . 1 1 91 91 LEU C C 91 180.160 180.160 178.823 1.337 25153 10800 1 12 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.327 -0.266 25153 10801 1 12 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.031 -0.481 25153 10802 1 12 . 1 1 91 91 LEU H H 91 7.046 7.046 8.682 -1.636 25153 10803 1 12 . 1 1 92 92 GLY N N 92 110.028 110.028 104.416 5.612 25153 10804 1 12 . 1 1 92 92 GLY C C 92 174.912 174.912 174.107 0.805 25153 10805 1 12 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.858 0.322 25153 10806 1 12 . 1 1 92 92 GLY H H 92 9.238 9.238 8.710 0.528 25153 10807 1 12 . 1 1 93 93 TYR N N 93 115.910 115.910 120.032 -4.122 25153 10808 1 12 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.034 -0.025 25153 10809 1 12 . 1 1 93 93 TYR C C 93 176.850 176.850 178.144 -1.294 25153 10810 1 12 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.960 -2.230 25153 10811 1 12 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.168 -2.038 25153 10812 1 12 . 1 1 93 93 TYR H H 93 6.962 6.962 7.419 -0.457 25153 10813 1 12 . 1 1 94 94 GLY N N 94 111.630 111.630 107.183 4.447 25153 10814 1 12 . 1 1 94 94 GLY C C 94 177.777 177.777 175.871 1.906 25153 10815 1 12 . 1 1 94 94 GLY CA C 94 50.030 50.030 46.962 3.068 25153 10816 1 12 . 1 1 94 94 GLY H H 94 7.835 7.835 8.494 -0.659 25153 10817 1 12 . 1 1 95 95 GLU N N 95 122.450 122.450 121.510 0.940 25153 10818 1 12 . 1 1 95 95 GLU HA H 95 3.918 3.918 4.013 -0.095 25153 10819 1 12 . 1 1 95 95 GLU C C 95 175.300 175.300 177.554 -2.254 25153 10820 1 12 . 1 1 95 95 GLU CA C 95 58.100 58.100 59.486 -1.386 25153 10821 1 12 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.232 -1.721 25153 10822 1 12 . 1 1 96 96 TRP N N 96 118.790 118.790 115.982 2.808 25153 10823 1 12 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.921 0.523 25153 10824 1 12 . 1 1 96 96 TRP C C 96 179.280 179.280 176.309 2.971 25153 10825 1 12 . 1 1 96 96 TRP CA C 96 57.015 57.015 57.043 -0.028 25153 10826 1 12 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.925 0.095 25153 10827 1 12 . 1 1 96 96 TRP H H 96 8.070 8.070 8.435 -0.365 25153 10828 1 12 . 1 1 97 97 PHE N N 97 128.067 128.067 121.993 6.074 25153 10829 1 12 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.198 1.107 25153 10830 1 12 . 1 1 97 97 PHE C C 97 173.227 173.227 175.969 -2.742 25153 10831 1 12 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.586 -2.866 25153 10832 1 12 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.097 0.843 25153 10833 1 12 . 1 1 97 97 PHE H H 97 7.165 7.165 8.201 -1.036 25153 10834 1 12 . 1 1 98 98 LEU N N 98 114.306 114.306 122.319 -8.013 25153 10835 1 12 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.724 -0.234 25153 10836 1 12 . 1 1 98 98 LEU C C 98 179.365 179.365 177.281 2.084 25153 10837 1 12 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.482 -0.022 25153 10838 1 12 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.636 -0.407 25153 10839 1 12 . 1 1 98 98 LEU H H 98 7.453 7.453 8.341 -0.888 25153 10840 1 12 . 1 1 99 99 ASP N N 99 122.354 122.354 120.474 1.880 25153 10841 1 12 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.309 -0.376 25153 10842 1 12 . 1 1 99 99 ASP C C 99 178.800 178.800 177.145 1.655 25153 10843 1 12 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.768 1.412 25153 10844 1 12 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.452 -1.022 25153 10845 1 12 . 1 1 100 100 ALA N N 100 118.568 118.568 122.096 -3.528 25153 10846 1 12 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.062 -0.222 25153 10847 1 12 . 1 1 100 100 ALA C C 100 178.500 178.500 179.256 -0.756 25153 10848 1 12 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.005 -0.089 25153 10849 1 12 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.356 1.304 25153 10850 1 12 . 1 1 100 100 ALA H H 100 8.682 8.682 7.789 0.893 25153 10851 1 12 . 1 1 101 101 LEU N N 101 118.815 118.815 120.551 -1.736 25153 10852 1 12 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.999 -0.319 25153 10853 1 12 . 1 1 101 101 LEU C C 101 178.930 178.930 178.910 0.020 25153 10854 1 12 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.728 -0.028 25153 10855 1 12 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.569 0.831 25153 10856 1 12 . 1 1 101 101 LEU H H 101 6.637 6.637 7.348 -0.711 25153 10857 1 12 . 1 1 102 102 GLY N N 102 103.700 103.700 106.401 -2.701 25153 10858 1 12 . 1 1 102 102 GLY C C 102 175.530 175.530 176.126 -0.596 25153 10859 1 12 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.316 0.684 25153 10860 1 12 . 1 1 102 102 GLY H H 102 7.330 7.330 7.983 -0.653 25153 10861 1 12 . 1 1 103 103 MET N N 103 120.330 120.330 121.522 -1.192 25153 10862 1 12 . 1 1 103 103 MET HA H 103 4.254 4.254 4.283 -0.029 25153 10863 1 12 . 1 1 103 103 MET C C 103 179.688 179.688 178.627 1.061 25153 10864 1 12 . 1 1 103 103 MET CA C 103 59.615 59.615 59.528 0.087 25153 10865 1 12 . 1 1 103 103 MET CB C 103 33.290 33.290 32.635 0.655 25153 10866 1 12 . 1 1 103 103 MET H H 103 8.407 8.407 7.833 0.574 25153 10867 1 12 . 1 1 104 104 LEU N N 104 123.450 123.450 119.913 3.537 25153 10868 1 12 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.698 0.498 25153 10869 1 12 . 1 1 104 104 LEU C C 104 177.620 177.620 178.752 -1.132 25153 10870 1 12 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.943 0.028 25153 10871 1 12 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.244 0.056 25153 10872 1 12 . 1 1 104 104 LEU H H 104 8.330 8.330 8.604 -0.274 25153 10873 1 12 . 1 1 105 105 HIS N N 105 119.040 119.040 119.300 -0.260 25153 10874 1 12 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.088 -0.211 25153 10875 1 12 . 1 1 105 105 HIS C C 105 177.100 177.100 177.023 0.077 25153 10876 1 12 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.815 0.155 25153 10877 1 12 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.858 -1.265 25153 10878 1 12 . 1 1 105 105 HIS H H 105 8.050 8.050 8.254 -0.204 25153 10879 1 12 . 1 1 106 106 ASP N N 106 119.950 119.950 119.174 0.776 25153 10880 1 12 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.384 -0.054 25153 10881 1 12 . 1 1 106 106 ASP C C 106 179.300 179.300 178.402 0.898 25153 10882 1 12 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.291 0.519 25153 10883 1 12 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.154 -0.754 25153 10884 1 12 . 1 1 107 107 LYS N N 107 122.060 122.060 120.005 2.055 25153 10885 1 12 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.059 0.074 25153 10886 1 12 . 1 1 107 107 LYS C C 107 178.100 178.100 179.438 -1.338 25153 10887 1 12 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.699 -0.499 25153 10888 1 12 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.155 0.205 25153 10889 1 12 . 1 1 108 108 LEU N N 108 115.610 115.610 117.964 -2.354 25153 10890 1 12 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.119 -0.051 25153 10891 1 12 . 1 1 108 108 LEU C C 108 178.866 178.866 178.192 0.674 25153 10892 1 12 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.847 -0.893 25153 10893 1 12 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.537 0.623 25153 10894 1 12 . 1 1 108 108 LEU H H 108 7.828 7.828 8.442 -0.614 25153 10895 1 12 . 1 1 109 109 SER N N 109 116.362 116.362 115.165 1.197 25153 10896 1 12 . 1 1 109 109 SER HA H 109 4.299 4.299 4.312 -0.013 25153 10897 1 12 . 1 1 109 109 SER C C 109 175.660 175.660 176.857 -1.197 25153 10898 1 12 . 1 1 109 109 SER CA C 109 62.350 62.350 61.345 1.005 25153 10899 1 12 . 1 1 109 109 SER CB C 109 62.815 62.815 63.083 -0.268 25153 10900 1 12 . 1 1 109 109 SER H H 109 8.278 8.278 8.602 -0.324 25153 10901 1 12 . 1 1 110 110 THR N N 110 110.230 110.230 115.965 -5.735 25153 10902 1 12 . 1 1 110 110 THR HA H 110 4.615 4.615 4.208 0.407 25153 10903 1 12 . 1 1 110 110 THR C C 110 175.990 175.990 175.276 0.714 25153 10904 1 12 . 1 1 110 110 THR CA C 110 62.090 62.090 64.169 -2.079 25153 10905 1 12 . 1 1 110 110 THR CB C 110 68.800 68.800 69.044 -0.244 25153 10906 1 12 . 1 1 110 110 THR H H 110 7.211 7.211 7.836 -0.625 25153 10907 1 12 . 1 1 111 111 LYS N N 111 119.900 119.900 118.427 1.473 25153 10908 1 12 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.384 0.128 25153 10909 1 12 . 1 1 111 111 LYS C C 111 176.916 176.916 176.808 0.108 25153 10910 1 12 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.481 0.173 25153 10911 1 12 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.687 -0.844 25153 10912 1 12 . 1 1 112 112 GLY N N 112 107.910 107.910 107.927 -0.017 25153 10913 1 12 . 1 1 112 112 GLY C C 112 176.250 176.250 174.225 2.025 25153 10914 1 12 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.711 1.329 25153 10915 1 12 . 1 1 112 112 GLY H H 112 8.366 8.366 7.645 0.721 25153 10916 1 12 . 1 1 113 113 VAL N N 113 113.530 113.530 116.204 -2.674 25153 10917 1 12 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.468 0.006 25153 10918 1 12 . 1 1 113 113 VAL C C 113 174.630 174.630 174.742 -0.112 25153 10919 1 12 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.852 -1.402 25153 10920 1 12 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.071 -0.521 25153 10921 1 12 . 1 1 113 113 VAL H H 113 6.903 6.903 6.970 -0.067 25153 10922 1 12 . 1 1 114 114 LYS N N 114 123.020 123.020 119.146 3.874 25153 10923 1 12 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.509 -0.004 25153 10924 1 12 . 1 1 114 114 LYS C C 114 175.000 175.000 174.776 0.224 25153 10925 1 12 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.419 -0.219 25153 10926 1 12 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.653 -1.313 25153 10927 1 12 . 1 1 115 115 PHE N N 115 123.290 123.290 120.563 2.727 25153 10928 1 12 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.705 0.008 25153 10929 1 12 . 1 1 115 115 PHE C C 115 177.605 177.605 176.166 1.439 25153 10930 1 12 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.748 1.862 25153 10931 1 12 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.728 -0.728 25153 10932 1 12 . 1 1 115 115 PHE H H 115 8.494 8.494 8.453 0.041 25153 10933 1 12 . 1 1 116 116 VAL N N 116 115.790 115.790 114.609 1.181 25153 10934 1 12 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.388 0.104 25153 10935 1 12 . 1 1 116 116 VAL C C 116 175.414 175.414 176.059 -0.645 25153 10936 1 12 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.210 -0.224 25153 10937 1 12 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.607 -0.507 25153 10938 1 12 . 1 1 116 116 VAL H H 116 8.889 8.889 8.345 0.544 25153 10939 1 12 . 1 1 117 117 GLY N N 117 108.300 108.300 107.968 0.332 25153 10940 1 12 . 1 1 117 117 GLY C C 117 176.180 176.180 174.696 1.484 25153 10941 1 12 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.505 2.296 25153 10942 1 12 . 1 1 117 117 GLY H H 117 9.810 9.810 8.614 1.196 25153 10943 1 12 . 1 1 118 118 TYR N N 118 120.050 120.050 119.453 0.597 25153 10944 1 12 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.728 0.226 25153 10945 1 12 . 1 1 118 118 TYR C C 118 177.450 177.450 175.881 1.569 25153 10946 1 12 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.828 -1.588 25153 10947 1 12 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.242 -3.132 25153 10948 1 12 . 1 1 118 118 TYR H H 118 8.592 8.592 7.423 1.169 25153 10949 1 12 . 1 1 119 119 TRP N N 119 125.500 125.500 120.706 4.794 25153 10950 1 12 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.100 0.928 25153 10951 1 12 . 1 1 119 119 TRP C C 119 173.090 173.090 174.065 -0.975 25153 10952 1 12 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.369 -0.469 25153 10953 1 12 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.167 3.083 25153 10954 1 12 . 1 1 119 119 TRP H H 119 7.926 7.926 8.178 -0.252 25153 10955 1 12 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.719 0.091 25153 10956 1 12 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.607 1.073 25153 10957 1 12 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.724 -0.474 25153 10958 1 12 . 1 1 121 121 THR N N 121 109.114 109.114 110.697 -1.583 25153 10959 1 12 . 1 1 121 121 THR HA H 121 4.142 4.142 3.389 0.753 25153 10960 1 12 . 1 1 121 121 THR C C 121 176.300 176.300 175.449 0.851 25153 10961 1 12 . 1 1 121 121 THR CA C 121 61.230 61.230 63.319 -2.089 25153 10962 1 12 . 1 1 121 121 THR CB C 121 69.890 69.890 68.542 1.348 25153 10963 1 12 . 1 1 121 121 THR H H 121 7.356 7.356 8.340 -0.984 25153 10964 1 12 . 1 1 122 122 GLU N N 122 123.980 123.980 122.440 1.540 25153 10965 1 12 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.031 0.207 25153 10966 1 12 . 1 1 122 122 GLU C C 122 177.830 177.830 177.723 0.107 25153 10967 1 12 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.631 0.599 25153 10968 1 12 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.802 -0.032 25153 10969 1 12 . 1 1 123 123 GLY N N 123 114.570 114.570 112.944 1.626 25153 10970 1 12 . 1 1 123 123 GLY C C 123 173.700 173.700 174.401 -0.701 25153 10971 1 12 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.786 -0.386 25153 10972 1 12 . 1 1 123 123 GLY H H 123 9.181 9.181 8.910 0.271 25153 10973 1 12 . 1 1 124 124 TYR N N 124 118.923 118.923 120.460 -1.537 25153 10974 1 12 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.799 0.511 25153 10975 1 12 . 1 1 124 124 TYR C C 124 175.680 175.680 175.088 0.592 25153 10976 1 12 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.073 -0.603 25153 10977 1 12 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.715 0.285 25153 10978 1 12 . 1 1 124 124 TYR H H 124 7.877 7.877 7.632 0.245 25153 10979 1 12 . 1 1 125 125 GLU N N 125 124.890 124.890 121.683 3.207 25153 10980 1 12 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.642 0.058 25153 10981 1 12 . 1 1 125 125 GLU C C 125 172.880 172.880 175.497 -2.617 25153 10982 1 12 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.772 -0.342 25153 10983 1 12 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.814 -0.394 25153 10984 1 12 . 1 1 126 126 PHE N N 126 119.166 119.166 120.852 -1.686 25153 10985 1 12 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.658 0.151 25153 10986 1 12 . 1 1 126 126 PHE C C 126 173.750 173.750 174.242 -0.492 25153 10987 1 12 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.397 -1.607 25153 10988 1 12 . 1 1 126 126 PHE CB C 126 40.050 40.050 38.945 1.105 25153 10989 1 12 . 1 1 126 126 PHE H H 126 7.716 7.716 7.973 -0.257 25153 10990 1 12 . 1 1 127 127 THR N N 127 106.800 106.800 114.628 -7.828 25153 10991 1 12 . 1 1 127 127 THR HA H 127 4.400 4.400 3.367 1.033 25153 10992 1 12 . 1 1 127 127 THR C C 127 175.300 175.300 174.179 1.121 25153 10993 1 12 . 1 1 127 127 THR CA C 127 61.100 61.100 62.735 -1.635 25153 10994 1 12 . 1 1 127 127 THR CB C 127 70.600 70.600 67.867 2.733 25153 10995 1 12 . 1 1 127 127 THR H H 127 7.220 7.220 6.413 0.807 25153 10996 1 12 . 1 1 128 128 SER N N 128 118.360 118.360 115.778 2.582 25153 10997 1 12 . 1 1 128 128 SER HA H 128 4.680 4.680 4.512 0.168 25153 10998 1 12 . 1 1 128 128 SER C C 128 175.720 175.720 174.206 1.514 25153 10999 1 12 . 1 1 128 128 SER CA C 128 56.250 56.250 56.657 -0.407 25153 11000 1 12 . 1 1 128 128 SER CB C 128 65.635 65.635 64.422 1.213 25153 11001 1 12 . 1 1 128 128 SER H H 128 7.411 7.411 7.964 -0.553 25153 11002 1 12 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.662 0.113 25153 11003 1 12 . 1 1 129 129 PRO CA C 129 62.500 62.500 63.804 -1.304 25153 11004 1 12 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.453 -0.053 25153 11005 1 12 . 1 1 130 130 LYS N N 130 122.014 122.014 120.392 1.622 25153 11006 1 12 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.333 -0.100 25153 11007 1 12 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.494 3.206 25153 11008 1 12 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.057 -0.487 25153 11009 1 12 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.564 -0.046 25153 11010 1 12 . 1 1 131 131 PRO C C 131 174.000 174.000 175.182 -1.182 25153 11011 1 12 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.310 2.390 25153 11012 1 12 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.241 0.959 25153 11013 1 12 . 1 1 132 132 VAL N N 132 113.260 113.260 117.196 -3.936 25153 11014 1 12 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.851 0.349 25153 11015 1 12 . 1 1 132 132 VAL C C 132 175.210 175.210 174.896 0.314 25153 11016 1 12 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.973 -0.353 25153 11017 1 12 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.922 -0.943 25153 11018 1 12 . 1 1 132 132 VAL H H 132 6.697 6.697 7.620 -0.923 25153 11019 1 12 . 1 1 133 133 ILE N N 133 119.940 119.940 117.297 2.643 25153 11020 1 12 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.478 -0.098 25153 11021 1 12 . 1 1 133 133 ILE C C 133 175.440 175.440 175.180 0.260 25153 11022 1 12 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.940 1.510 25153 11023 1 12 . 1 1 133 133 ILE CB C 133 42.100 42.100 39.973 2.127 25153 11024 1 12 . 1 1 133 133 ILE H H 133 8.756 8.756 8.672 0.084 25153 11025 1 12 . 1 1 134 134 ALA N N 134 122.632 122.632 123.874 -1.242 25153 11026 1 12 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.890 0.070 25153 11027 1 12 . 1 1 134 134 ALA C C 134 178.312 178.312 177.201 1.111 25153 11028 1 12 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.563 -1.483 25153 11029 1 12 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.212 -0.376 25153 11030 1 12 . 1 1 134 134 ALA H H 134 8.523 8.523 8.460 0.063 25153 11031 1 12 . 1 1 135 135 ASP N N 135 117.366 117.366 122.758 -5.392 25153 11032 1 12 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.660 -0.408 25153 11033 1 12 . 1 1 135 135 ASP C C 135 176.387 176.387 176.630 -0.243 25153 11034 1 12 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.336 1.874 25153 11035 1 12 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.231 -1.531 25153 11036 1 12 . 1 1 136 136 GLY N N 136 104.310 104.310 108.082 -3.772 25153 11037 1 12 . 1 1 136 136 GLY C C 136 174.922 174.922 174.913 0.009 25153 11038 1 12 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.381 -0.281 25153 11039 1 12 . 1 1 136 136 GLY H H 136 7.610 7.610 8.298 -0.688 25153 11040 1 12 . 1 1 137 137 GLN N N 137 118.784 118.784 117.657 1.127 25153 11041 1 12 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.404 -0.349 25153 11042 1 12 . 1 1 137 137 GLN C C 137 176.390 176.390 175.427 0.963 25153 11043 1 12 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.866 1.774 25153 11044 1 12 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.217 0.013 25153 11045 1 12 . 1 1 137 137 GLN H H 137 7.870 7.870 7.843 0.027 25153 11046 1 12 . 1 1 138 138 LEU N N 138 118.040 118.040 115.854 2.186 25153 11047 1 12 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.960 0.027 25153 11048 1 12 . 1 1 138 138 LEU C C 138 175.913 175.913 175.120 0.793 25153 11049 1 12 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.141 0.459 25153 11050 1 12 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.841 1.559 25153 11051 1 12 . 1 1 138 138 LEU H H 138 7.356 7.356 7.170 0.186 25153 11052 1 12 . 1 1 139 139 PHE N N 139 119.060 119.060 119.619 -0.559 25153 11053 1 12 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.926 0.384 25153 11054 1 12 . 1 1 139 139 PHE C C 139 178.780 178.780 177.626 1.154 25153 11055 1 12 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.088 -0.238 25153 11056 1 12 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.878 3.582 25153 11057 1 12 . 1 1 139 139 PHE H H 139 10.094 10.094 8.943 1.151 25153 11058 1 12 . 1 1 140 140 VAL N N 140 109.690 109.690 116.190 -6.500 25153 11059 1 12 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.593 -0.112 25153 11060 1 12 . 1 1 140 140 VAL C C 140 172.790 172.790 175.735 -2.945 25153 11061 1 12 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.795 -1.795 25153 11062 1 12 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.218 -0.668 25153 11063 1 12 . 1 1 140 140 VAL H H 140 7.470 7.470 8.112 -0.642 25153 11064 1 12 . 1 1 141 141 GLY N N 141 107.060 107.060 105.395 1.665 25153 11065 1 12 . 1 1 141 141 GLY C C 141 171.513 171.513 172.603 -1.090 25153 11066 1 12 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.549 0.881 25153 11067 1 12 . 1 1 141 141 GLY H H 141 7.137 7.137 7.389 -0.252 25153 11068 1 12 . 1 1 142 142 LEU N N 142 117.863 117.863 120.593 -2.730 25153 11069 1 12 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.142 -1.167 25153 11070 1 12 . 1 1 142 142 LEU C C 142 173.640 173.640 175.164 -1.524 25153 11071 1 12 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.704 1.216 25153 11072 1 12 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.337 -4.787 25153 11073 1 12 . 1 1 142 142 LEU H H 142 7.517 7.517 7.793 -0.276 25153 11074 1 12 . 1 1 143 143 ALA N N 143 126.990 126.990 129.322 -2.332 25153 11075 1 12 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.508 -0.231 25153 11076 1 12 . 1 1 143 143 ALA C C 143 175.730 175.730 175.937 -0.207 25153 11077 1 12 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.313 -0.873 25153 11078 1 12 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.407 3.902 25153 11079 1 12 . 1 1 143 143 ALA H H 143 5.186 5.186 8.235 -3.049 25153 11080 1 12 . 1 1 144 144 LEU N N 144 125.477 125.477 125.146 0.331 25153 11081 1 12 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.717 0.063 25153 11082 1 12 . 1 1 144 144 LEU C C 144 174.473 174.473 175.287 -0.814 25153 11083 1 12 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.615 -0.375 25153 11084 1 12 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.883 0.417 25153 11085 1 12 . 1 1 144 144 LEU H H 144 8.758 8.758 8.399 0.359 25153 11086 1 12 . 1 1 145 145 ASP N N 145 118.915 118.915 118.752 0.163 25153 11087 1 12 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.199 0.333 25153 11088 1 12 . 1 1 145 145 ASP C C 145 176.470 176.470 175.886 0.584 25153 11089 1 12 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.139 -0.509 25153 11090 1 12 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.476 -1.476 25153 11091 1 12 . 1 1 146 146 GLU N N 146 124.813 124.813 122.285 2.528 25153 11092 1 12 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.528 -0.152 25153 11093 1 12 . 1 1 146 146 GLU C C 146 177.290 177.290 176.542 0.748 25153 11094 1 12 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.779 0.341 25153 11095 1 12 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.366 0.784 25153 11096 1 12 . 1 1 147 147 THR N N 147 118.328 118.328 112.572 5.756 25153 11097 1 12 . 1 1 147 147 THR HA H 147 4.200 4.200 4.667 -0.467 25153 11098 1 12 . 1 1 147 147 THR C C 147 175.683 175.683 174.613 1.070 25153 11099 1 12 . 1 1 147 147 THR CA C 147 66.250 66.250 62.736 3.514 25153 11100 1 12 . 1 1 147 147 THR CB C 147 69.600 69.600 70.665 -1.065 25153 11101 1 12 . 1 1 147 147 THR H H 147 8.562 8.562 8.460 0.102 25153 11102 1 12 . 1 1 148 148 ASN N N 148 115.550 115.550 118.272 -2.722 25153 11103 1 12 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.895 0.092 25153 11104 1 12 . 1 1 148 148 ASN C C 148 175.870 175.870 174.960 0.910 25153 11105 1 12 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.840 -1.140 25153 11106 1 12 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.665 2.215 25153 11107 1 12 . 1 1 148 148 ASN H H 148 9.118 9.118 8.993 0.125 25153 11108 1 12 . 1 1 149 149 GLN N N 149 117.400 117.400 119.452 -2.052 25153 11109 1 12 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.370 0.473 25153 11110 1 12 . 1 1 149 149 GLN C C 149 177.780 177.780 176.252 1.528 25153 11111 1 12 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.118 -1.218 25153 11112 1 12 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.984 0.316 25153 11113 1 12 . 1 1 149 149 GLN H H 149 7.555 7.555 7.898 -0.343 25153 11114 1 12 . 1 1 150 150 TYR N N 150 120.674 120.674 118.037 2.637 25153 11115 1 12 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.250 0.278 25153 11116 1 12 . 1 1 150 150 TYR C C 150 177.830 177.830 176.697 1.133 25153 11117 1 12 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.587 -0.100 25153 11118 1 12 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.959 -0.359 25153 11119 1 12 . 1 1 150 150 TYR H H 150 6.983 6.983 7.854 -0.871 25153 11120 1 12 . 1 1 151 151 ASP N N 151 120.810 120.810 119.292 1.518 25153 11121 1 12 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.664 -0.149 25153 11122 1 12 . 1 1 151 151 ASP C C 151 176.400 176.400 177.134 -0.734 25153 11123 1 12 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.916 -0.516 25153 11124 1 12 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.274 -2.194 25153 11125 1 12 . 1 1 152 152 LEU N N 152 118.083 118.083 112.541 5.542 25153 11126 1 12 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.739 -0.063 25153 11127 1 12 . 1 1 152 152 LEU C C 152 178.470 178.470 177.977 0.493 25153 11128 1 12 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.854 -1.254 25153 11129 1 12 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.219 -0.619 25153 11130 1 12 . 1 1 152 152 LEU H H 152 7.453 7.453 7.428 0.025 25153 11131 1 12 . 1 1 153 153 SER N N 153 116.407 116.407 118.592 -2.185 25153 11132 1 12 . 1 1 153 153 SER HA H 153 3.960 3.960 4.058 -0.098 25153 11133 1 12 . 1 1 153 153 SER C C 153 174.590 174.590 175.883 -1.293 25153 11134 1 12 . 1 1 153 153 SER CA C 153 63.400 63.400 64.188 -0.788 25153 11135 1 12 . 1 1 153 153 SER CB C 153 63.100 63.100 62.797 0.303 25153 11136 1 12 . 1 1 153 153 SER H H 153 7.360 7.360 8.689 -1.329 25153 11137 1 12 . 1 1 154 154 ASP N N 154 121.960 121.960 120.179 1.781 25153 11138 1 12 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.377 -0.067 25153 11139 1 12 . 1 1 154 154 ASP C C 154 178.640 178.640 177.845 0.795 25153 11140 1 12 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.324 1.677 25153 11141 1 12 . 1 1 154 154 ASP CB C 154 39.570 39.570 41.000 -1.430 25153 11142 1 12 . 1 1 155 155 GLU N N 155 121.310 121.310 119.102 2.208 25153 11143 1 12 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.171 0.014 25153 11144 1 12 . 1 1 155 155 GLU C C 155 179.600 179.600 178.718 0.882 25153 11145 1 12 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.745 0.705 25153 11146 1 12 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.760 -0.360 25153 11147 1 12 . 1 1 156 156 ARG N N 156 121.394 121.394 120.451 0.943 25153 11148 1 12 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.205 0.095 25153 11149 1 12 . 1 1 156 156 ARG C C 156 177.330 177.330 179.052 -1.722 25153 11150 1 12 . 1 1 156 156 ARG CA C 156 60.460 60.460 59.259 1.201 25153 11151 1 12 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.291 0.469 25153 11152 1 12 . 1 1 157 157 ILE N N 157 118.390 118.390 120.427 -2.037 25153 11153 1 12 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.716 -0.282 25153 11154 1 12 . 1 1 157 157 ILE C C 157 178.814 178.814 177.708 1.106 25153 11155 1 12 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.997 0.697 25153 11156 1 12 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.939 0.914 25153 11157 1 12 . 1 1 157 157 ILE H H 157 8.966 8.966 8.176 0.790 25153 11158 1 12 . 1 1 158 158 GLN N N 158 120.060 120.060 118.930 1.130 25153 11159 1 12 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.913 0.043 25153 11160 1 12 . 1 1 158 158 GLN C C 158 178.843 178.843 178.920 -0.077 25153 11161 1 12 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.467 1.133 25153 11162 1 12 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.576 -0.186 25153 11163 1 12 . 1 1 158 158 GLN H H 158 8.394 8.394 7.888 0.506 25153 11164 1 12 . 1 1 159 159 SER N N 159 115.613 115.613 115.899 -0.286 25153 11165 1 12 . 1 1 159 159 SER HA H 159 4.455 4.455 4.298 0.157 25153 11166 1 12 . 1 1 159 159 SER C C 159 177.330 177.330 176.797 0.533 25153 11167 1 12 . 1 1 159 159 SER CA C 159 62.400 62.400 61.297 1.103 25153 11168 1 12 . 1 1 159 159 SER CB C 159 63.760 63.760 63.299 0.461 25153 11169 1 12 . 1 1 159 159 SER H H 159 8.460 8.460 8.432 0.028 25153 11170 1 12 . 1 1 160 160 TRP N N 160 126.820 126.820 124.913 1.907 25153 11171 1 12 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.145 0.320 25153 11172 1 12 . 1 1 160 160 TRP C C 160 178.050 178.050 177.560 0.490 25153 11173 1 12 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.782 0.918 25153 11174 1 12 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.344 0.016 25153 11175 1 12 . 1 1 160 160 TRP H H 160 9.318 9.318 8.426 0.892 25153 11176 1 12 . 1 1 161 161 CYS N N 161 116.750 116.750 117.947 -1.197 25153 11177 1 12 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.760 0.123 25153 11178 1 12 . 1 1 161 161 CYS C C 161 176.270 176.270 176.814 -0.544 25153 11179 1 12 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.127 1.233 25153 11180 1 12 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.874 1.006 25153 11181 1 12 . 1 1 161 161 CYS H H 161 8.950 8.950 8.994 -0.044 25153 11182 1 12 . 1 1 162 162 GLU N N 162 118.096 118.096 120.159 -2.063 25153 11183 1 12 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.115 -0.185 25153 11184 1 12 . 1 1 162 162 GLU C C 162 178.680 178.680 177.389 1.291 25153 11185 1 12 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.104 0.626 25153 11186 1 12 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.359 0.071 25153 11187 1 12 . 1 1 163 163 GLN N N 163 120.790 120.790 117.794 2.996 25153 11188 1 12 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.090 0.087 25153 11189 1 12 . 1 1 163 163 GLN C C 163 179.690 179.690 178.093 1.597 25153 11190 1 12 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.816 1.724 25153 11191 1 12 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.790 0.210 25153 11192 1 12 . 1 1 163 163 GLN H H 163 8.205 8.205 7.510 0.695 25153 11193 1 12 . 1 1 164 164 ILE N N 164 114.860 114.860 118.931 -4.071 25153 11194 1 12 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.859 0.184 25153 11195 1 12 . 1 1 164 164 ILE C C 164 178.680 178.680 177.369 1.311 25153 11196 1 12 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.025 2.186 25153 11197 1 12 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.607 0.093 25153 11198 1 12 . 1 1 164 164 ILE H H 164 9.005 9.005 8.029 0.976 25153 11199 1 12 . 1 1 165 165 LEU N N 165 123.900 123.900 116.084 7.816 25153 11200 1 12 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.207 -0.057 25153 11201 1 12 . 1 1 165 165 LEU C C 165 180.520 180.520 177.345 3.175 25153 11202 1 12 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.211 1.089 25153 11203 1 12 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.273 -0.223 25153 11204 1 12 . 1 1 165 165 LEU H H 165 7.825 7.825 8.010 -0.185 25153 11205 1 12 . 1 1 166 166 ASN N N 166 120.112 120.112 117.847 2.265 25153 11206 1 12 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.690 -0.107 25153 11207 1 12 . 1 1 166 166 ASN C C 166 178.440 178.440 176.897 1.543 25153 11208 1 12 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.704 0.716 25153 11209 1 12 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.794 -1.374 25153 11210 1 12 . 1 1 166 166 ASN H H 166 7.760 7.760 7.852 -0.092 25153 11211 1 12 . 1 1 167 167 GLU N N 167 121.370 121.370 121.976 -0.606 25153 11212 1 12 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.978 0.125 25153 11213 1 12 . 1 1 167 167 GLU C C 167 180.332 180.332 179.353 0.979 25153 11214 1 12 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.836 0.314 25153 11215 1 12 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.680 1.340 25153 11216 1 12 . 1 1 168 168 MET N N 168 118.532 118.532 117.301 1.231 25153 11217 1 12 . 1 1 168 168 MET HA H 168 4.015 4.015 4.237 -0.222 25153 11218 1 12 . 1 1 168 168 MET C C 168 176.600 176.600 178.089 -1.489 25153 11219 1 12 . 1 1 168 168 MET CA C 168 59.300 59.300 59.477 -0.177 25153 11220 1 12 . 1 1 168 168 MET CB C 168 33.400 33.400 32.764 0.636 25153 11221 1 12 . 1 1 168 168 MET H H 168 8.718 8.718 8.456 0.262 25153 11222 1 12 . 1 1 169 169 ALA N N 169 121.922 121.922 122.144 -0.222 25153 11223 1 12 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.165 0.009 25153 11224 1 12 . 1 1 169 169 ALA C C 169 179.410 179.410 179.709 -0.299 25153 11225 1 12 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.795 -0.395 25153 11226 1 12 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.484 -0.074 25153 11227 1 12 . 1 1 169 169 ALA H H 169 7.448 7.448 7.897 -0.449 25153 11228 1 12 . 1 1 170 170 GLU N N 170 117.300 117.300 116.662 0.638 25153 11229 1 12 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.067 0.028 25153 11230 1 12 . 1 1 170 170 GLU C C 170 177.470 177.470 179.145 -1.675 25153 11231 1 12 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.881 -0.931 25153 11232 1 12 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.323 0.452 25153 11233 1 12 . 1 1 171 171 HIS N N 171 117.944 117.944 119.066 -1.122 25153 11234 1 12 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.358 0.142 25153 11235 1 12 . 1 1 171 171 HIS C C 171 175.120 175.120 176.756 -1.636 25153 11236 1 12 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.975 -1.775 25153 11237 1 12 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.236 0.364 25153 11238 1 12 . 1 1 171 171 HIS H H 171 7.788 7.788 7.607 0.180 25153 11239 1 12 . 1 1 172 172 TYR N N 172 120.040 120.040 117.788 2.252 25153 11240 1 12 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.512 0.081 25153 11241 1 12 . 1 1 172 172 TYR C C 172 174.612 174.612 175.620 -1.008 25153 11242 1 12 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.373 -0.393 25153 11243 1 12 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.667 0.313 25153 11244 1 12 . 1 1 172 172 TYR H H 172 7.820 7.820 7.927 -0.107 25153 11245 1 13 . 1 1 2 2 ASN N N 2 123.320 123.320 120.417 2.903 25153 11246 1 13 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.215 -0.007 25153 11247 1 13 . 1 1 2 2 ASN C C 2 174.590 174.590 173.549 1.041 25153 11248 1 13 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.226 0.774 25153 11249 1 13 . 1 1 2 2 ASN CB C 2 39.970 39.970 41.628 -1.658 25153 11250 1 13 . 1 1 2 2 ASN H H 2 9.428 9.428 8.313 1.115 25153 11251 1 13 . 1 1 3 3 MET N N 3 120.920 120.920 118.342 2.578 25153 11252 1 13 . 1 1 3 3 MET HA H 3 5.530 5.530 5.357 0.173 25153 11253 1 13 . 1 1 3 3 MET C C 3 174.400 174.400 174.915 -0.515 25153 11254 1 13 . 1 1 3 3 MET CA C 3 54.643 54.643 54.197 0.446 25153 11255 1 13 . 1 1 3 3 MET CB C 3 34.637 34.637 37.284 -2.647 25153 11256 1 13 . 1 1 3 3 MET H H 3 8.751 8.751 9.264 -0.513 25153 11257 1 13 . 1 1 4 4 GLY N N 4 115.542 115.542 109.339 6.203 25153 11258 1 13 . 1 1 4 4 GLY C C 4 170.413 170.413 172.201 -1.788 25153 11259 1 13 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.839 -0.737 25153 11260 1 13 . 1 1 4 4 GLY H H 4 8.927 8.927 9.027 -0.100 25153 11261 1 13 . 1 1 5 5 LEU N N 5 131.030 131.030 128.679 2.351 25153 11262 1 13 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.147 1.255 25153 11263 1 13 . 1 1 5 5 LEU C C 5 175.952 175.952 174.532 1.420 25153 11264 1 13 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.231 1.219 25153 11265 1 13 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.348 3.244 25153 11266 1 13 . 1 1 5 5 LEU H H 5 8.928 8.928 8.643 0.285 25153 11267 1 13 . 1 1 6 6 PHE N N 6 125.790 125.790 126.676 -0.886 25153 11268 1 13 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.666 0.074 25153 11269 1 13 . 1 1 6 6 PHE C C 6 174.300 174.300 175.895 -1.595 25153 11270 1 13 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.717 -1.397 25153 11271 1 13 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.246 -0.016 25153 11272 1 13 . 1 1 6 6 PHE H H 6 9.237 9.237 9.376 -0.139 25153 11273 1 13 . 1 1 7 7 TYR N N 7 117.289 117.289 116.651 0.638 25153 11274 1 13 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.905 0.060 25153 11275 1 13 . 1 1 7 7 TYR C C 7 171.262 171.262 173.404 -2.142 25153 11276 1 13 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.381 -0.981 25153 11277 1 13 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.971 0.269 25153 11278 1 13 . 1 1 7 7 TYR H H 7 8.125 8.125 8.399 -0.274 25153 11279 1 13 . 1 1 8 8 GLY N N 8 107.420 107.420 106.586 0.834 25153 11280 1 13 . 1 1 8 8 GLY C C 8 172.000 172.000 172.258 -0.258 25153 11281 1 13 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.457 -0.513 25153 11282 1 13 . 1 1 8 8 GLY H H 8 7.031 7.031 8.469 -1.438 25153 11283 1 13 . 1 1 9 9 SER N N 9 118.150 118.150 117.685 0.465 25153 11284 1 13 . 1 1 9 9 SER HA H 9 5.200 5.200 5.172 0.028 25153 11285 1 13 . 1 1 9 9 SER C C 9 175.000 175.000 174.464 0.536 25153 11286 1 13 . 1 1 9 9 SER CA C 9 57.570 57.570 57.232 0.338 25153 11287 1 13 . 1 1 9 9 SER CB C 9 66.700 66.700 66.319 0.381 25153 11288 1 13 . 1 1 9 9 SER H H 9 9.604 9.604 8.241 1.363 25153 11289 1 13 . 1 1 10 10 SER N N 10 131.193 131.193 120.679 10.514 25153 11290 1 13 . 1 1 10 10 SER HA H 10 4.775 4.775 4.419 0.356 25153 11291 1 13 . 1 1 10 10 SER C C 10 175.730 175.730 175.376 0.354 25153 11292 1 13 . 1 1 10 10 SER CA C 10 61.750 61.750 60.255 1.495 25153 11293 1 13 . 1 1 10 10 SER CB C 10 64.400 64.400 63.718 0.682 25153 11294 1 13 . 1 1 10 10 SER H H 10 11.636 11.636 9.047 2.589 25153 11295 1 13 . 1 1 11 11 THR N N 11 115.848 115.848 115.752 0.096 25153 11296 1 13 . 1 1 11 11 THR HA H 11 4.770 4.770 4.194 0.576 25153 11297 1 13 . 1 1 11 11 THR C C 11 173.700 173.700 174.694 -0.994 25153 11298 1 13 . 1 1 11 11 THR CA C 11 60.700 60.700 62.418 -1.718 25153 11299 1 13 . 1 1 11 11 THR CB C 11 67.430 67.430 69.362 -1.932 25153 11300 1 13 . 1 1 11 11 THR H H 11 9.550 9.550 8.471 1.079 25153 11301 1 13 . 1 1 12 12 CYS N N 12 109.780 109.780 114.532 -4.752 25153 11302 1 13 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.763 -0.693 25153 11303 1 13 . 1 1 12 12 CYS C C 12 176.220 176.220 175.363 0.857 25153 11304 1 13 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.529 5.071 25153 11305 1 13 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.983 -1.583 25153 11306 1 13 . 1 1 12 12 CYS H H 12 7.437 7.437 7.398 0.039 25153 11307 1 13 . 1 1 13 13 TYR N N 13 127.830 127.830 122.749 5.081 25153 11308 1 13 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.294 -0.191 25153 11309 1 13 . 1 1 13 13 TYR C C 13 180.880 180.880 177.994 2.886 25153 11310 1 13 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.538 3.562 25153 11311 1 13 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.526 -0.691 25153 11312 1 13 . 1 1 13 13 TYR H H 13 10.886 10.886 7.076 3.810 25153 11313 1 13 . 1 1 14 14 THR N N 14 124.428 124.428 114.259 10.169 25153 11314 1 13 . 1 1 14 14 THR HA H 14 4.160 4.160 4.135 0.025 25153 11315 1 13 . 1 1 14 14 THR C C 14 177.760 177.760 176.244 1.516 25153 11316 1 13 . 1 1 14 14 THR CA C 14 67.823 67.823 67.265 0.558 25153 11317 1 13 . 1 1 14 14 THR CB C 14 68.040 68.040 68.233 -0.193 25153 11318 1 13 . 1 1 14 14 THR H H 14 11.405 11.405 8.641 2.764 25153 11319 1 13 . 1 1 15 15 GLU N N 15 123.050 123.050 122.847 0.203 25153 11320 1 13 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.216 -0.326 25153 11321 1 13 . 1 1 15 15 GLU C C 15 176.392 176.392 178.070 -1.678 25153 11322 1 13 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.706 -0.506 25153 11323 1 13 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.386 1.064 25153 11324 1 13 . 1 1 16 16 MET N N 16 120.173 120.173 118.336 1.837 25153 11325 1 13 . 1 1 16 16 MET HA H 16 4.050 4.050 4.086 -0.036 25153 11326 1 13 . 1 1 16 16 MET C C 16 179.940 179.940 178.552 1.388 25153 11327 1 13 . 1 1 16 16 MET CA C 16 59.240 59.240 59.053 0.188 25153 11328 1 13 . 1 1 16 16 MET CB C 16 32.970 32.970 32.667 0.303 25153 11329 1 13 . 1 1 16 16 MET H H 16 8.469 8.469 8.464 0.005 25153 11330 1 13 . 1 1 17 17 ALA N N 17 121.930 121.930 122.169 -0.239 25153 11331 1 13 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.868 -0.032 25153 11332 1 13 . 1 1 17 17 ALA C C 17 177.900 177.900 178.712 -0.812 25153 11333 1 13 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.202 -0.002 25153 11334 1 13 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.100 -0.100 25153 11335 1 13 . 1 1 17 17 ALA H H 17 7.880 7.880 8.490 -0.610 25153 11336 1 13 . 1 1 18 18 ALA N N 18 121.477 121.477 121.156 0.321 25153 11337 1 13 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.776 -0.039 25153 11338 1 13 . 1 1 18 18 ALA C C 18 179.380 179.380 179.466 -0.086 25153 11339 1 13 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.108 -0.108 25153 11340 1 13 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.724 1.106 25153 11341 1 13 . 1 1 18 18 ALA H H 18 7.374 7.374 8.156 -0.782 25153 11342 1 13 . 1 1 19 19 GLU N N 19 116.650 116.650 118.055 -1.405 25153 11343 1 13 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.897 -0.281 25153 11344 1 13 . 1 1 19 19 GLU C C 19 178.479 178.479 179.236 -0.757 25153 11345 1 13 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.577 0.153 25153 11346 1 13 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.319 -0.019 25153 11347 1 13 . 1 1 20 20 LYS N N 20 119.470 119.470 120.096 -0.626 25153 11348 1 13 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.003 0.047 25153 11349 1 13 . 1 1 20 20 LYS C C 20 179.116 179.116 179.081 0.035 25153 11350 1 13 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.490 0.340 25153 11351 1 13 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.440 0.410 25153 11352 1 13 . 1 1 21 21 ILE N N 21 121.030 121.030 120.605 0.425 25153 11353 1 13 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.669 -0.279 25153 11354 1 13 . 1 1 21 21 ILE C C 21 177.580 177.580 178.175 -0.595 25153 11355 1 13 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.639 0.181 25153 11356 1 13 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.848 0.500 25153 11357 1 13 . 1 1 21 21 ILE H H 21 8.100 8.100 8.651 -0.551 25153 11358 1 13 . 1 1 22 22 ARG N N 22 119.720 119.720 119.673 0.047 25153 11359 1 13 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.870 -0.315 25153 11360 1 13 . 1 1 22 22 ARG C C 22 177.320 177.320 178.272 -0.952 25153 11361 1 13 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.227 0.493 25153 11362 1 13 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.290 -0.358 25153 11363 1 13 . 1 1 23 23 ASP N N 23 118.730 118.730 118.727 0.003 25153 11364 1 13 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.438 -0.075 25153 11365 1 13 . 1 1 23 23 ASP C C 23 178.330 178.330 178.801 -0.471 25153 11366 1 13 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.247 -0.297 25153 11367 1 13 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.893 -0.653 25153 11368 1 13 . 1 1 24 24 ILE N N 24 121.090 121.090 119.768 1.322 25153 11369 1 13 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.760 0.036 25153 11370 1 13 . 1 1 24 24 ILE C C 24 178.250 178.250 177.991 0.259 25153 11371 1 13 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.849 -0.699 25153 11372 1 13 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.247 0.233 25153 11373 1 13 . 1 1 24 24 ILE H H 24 7.910 7.910 8.259 -0.349 25153 11374 1 13 . 1 1 25 25 ILE N N 25 121.406 121.406 117.393 4.013 25153 11375 1 13 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.865 -0.219 25153 11376 1 13 . 1 1 25 25 ILE C C 25 176.800 176.800 176.778 0.022 25153 11377 1 13 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.112 2.588 25153 11378 1 13 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.981 -0.791 25153 11379 1 13 . 1 1 25 25 ILE H H 25 8.476 8.476 8.150 0.326 25153 11380 1 13 . 1 1 26 26 GLY N N 26 108.900 108.900 105.005 3.895 25153 11381 1 13 . 1 1 26 26 GLY C C 26 173.710 173.710 172.300 1.410 25153 11382 1 13 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.808 -0.478 25153 11383 1 13 . 1 1 26 26 GLY H H 26 8.016 8.016 7.866 0.150 25153 11384 1 13 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.495 -0.157 25153 11385 1 13 . 1 1 27 27 PRO C C 27 177.200 177.200 177.026 0.174 25153 11386 1 13 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.755 0.931 25153 11387 1 13 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.091 0.109 25153 11388 1 13 . 1 1 28 28 GLU N N 28 116.295 116.295 117.887 -1.592 25153 11389 1 13 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.218 0.052 25153 11390 1 13 . 1 1 28 28 GLU C C 28 176.980 176.980 177.209 -0.229 25153 11391 1 13 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.332 -0.592 25153 11392 1 13 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.524 -0.854 25153 11393 1 13 . 1 1 29 29 LEU N N 29 120.250 120.250 112.706 7.544 25153 11394 1 13 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.666 -0.030 25153 11395 1 13 . 1 1 29 29 LEU C C 29 175.770 175.770 176.149 -0.379 25153 11396 1 13 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.511 0.289 25153 11397 1 13 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.460 1.640 25153 11398 1 13 . 1 1 29 29 LEU H H 29 7.940 7.940 7.469 0.471 25153 11399 1 13 . 1 1 30 30 VAL N N 30 118.693 118.693 121.370 -2.677 25153 11400 1 13 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.835 -0.186 25153 11401 1 13 . 1 1 30 30 VAL C C 30 174.347 174.347 175.829 -1.482 25153 11402 1 13 . 1 1 30 30 VAL CA C 30 60.868 60.868 62.492 -1.624 25153 11403 1 13 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.803 1.777 25153 11404 1 13 . 1 1 30 30 VAL H H 30 7.434 7.434 7.987 -0.553 25153 11405 1 13 . 1 1 31 31 THR N N 31 123.800 123.800 120.999 2.801 25153 11406 1 13 . 1 1 31 31 THR HA H 31 4.362 4.362 4.592 -0.230 25153 11407 1 13 . 1 1 31 31 THR C C 31 172.964 172.964 172.683 0.281 25153 11408 1 13 . 1 1 31 31 THR CA C 31 61.720 61.720 60.968 0.753 25153 11409 1 13 . 1 1 31 31 THR CB C 31 70.485 70.485 70.694 -0.209 25153 11410 1 13 . 1 1 31 31 THR H H 31 7.844 7.844 8.472 -0.628 25153 11411 1 13 . 1 1 32 32 LEU N N 32 127.800 127.800 125.011 2.789 25153 11412 1 13 . 1 1 32 32 LEU HA H 32 4.684 4.684 5.122 -0.438 25153 11413 1 13 . 1 1 32 32 LEU C C 32 176.600 176.600 174.614 1.986 25153 11414 1 13 . 1 1 32 32 LEU CA C 32 55.155 55.155 52.794 2.361 25153 11415 1 13 . 1 1 32 32 LEU CB C 32 43.850 43.850 44.741 -0.891 25153 11416 1 13 . 1 1 32 32 LEU H H 32 8.660 8.660 8.158 0.502 25153 11417 1 13 . 1 1 33 33 HIS N N 33 119.670 119.670 117.656 2.014 25153 11418 1 13 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.791 -0.391 25153 11419 1 13 . 1 1 33 33 HIS C C 33 171.667 171.667 173.344 -1.677 25153 11420 1 13 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.092 0.108 25153 11421 1 13 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.864 0.336 25153 11422 1 13 . 1 1 33 33 HIS H H 33 9.060 9.060 8.818 0.242 25153 11423 1 13 . 1 1 34 34 ASN N N 34 124.068 124.068 123.019 1.049 25153 11424 1 13 . 1 1 34 34 ASN HA H 34 3.434 3.434 3.909 -0.475 25153 11425 1 13 . 1 1 34 34 ASN C C 34 178.000 178.000 176.112 1.888 25153 11426 1 13 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.980 -0.551 25153 11427 1 13 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.003 -0.443 25153 11428 1 13 . 1 1 34 34 ASN H H 34 8.780 8.780 8.227 0.553 25153 11429 1 13 . 1 1 35 35 LEU N N 35 129.040 129.040 126.429 2.611 25153 11430 1 13 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.146 0.169 25153 11431 1 13 . 1 1 35 35 LEU C C 35 177.700 177.700 177.902 -0.202 25153 11432 1 13 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.504 -0.024 25153 11433 1 13 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.808 1.492 25153 11434 1 13 . 1 1 35 35 LEU H H 35 8.821 8.821 8.561 0.260 25153 11435 1 13 . 1 1 36 36 LYS N N 36 121.043 121.043 116.784 4.259 25153 11436 1 13 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.963 -0.083 25153 11437 1 13 . 1 1 36 36 LYS C C 36 176.230 176.230 177.061 -0.831 25153 11438 1 13 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.462 0.958 25153 11439 1 13 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.466 0.804 25153 11440 1 13 . 1 1 37 37 ASP N N 37 114.965 114.965 118.124 -3.159 25153 11441 1 13 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.813 -0.036 25153 11442 1 13 . 1 1 37 37 ASP C C 37 175.440 175.440 175.618 -0.178 25153 11443 1 13 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.636 0.075 25153 11444 1 13 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.650 1.050 25153 11445 1 13 . 1 1 38 38 ASP N N 38 121.650 121.650 120.912 0.738 25153 11446 1 13 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.847 0.023 25153 11447 1 13 . 1 1 38 38 ASP C C 38 174.852 174.852 175.993 -1.141 25153 11448 1 13 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.740 -1.660 25153 11449 1 13 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.519 -0.409 25153 11450 1 13 . 1 1 39 39 SER N N 39 115.207 115.207 117.701 -2.494 25153 11451 1 13 . 1 1 39 39 SER HA H 39 4.585 4.585 4.637 -0.052 25153 11452 1 13 . 1 1 39 39 SER C C 39 175.040 175.040 174.178 0.862 25153 11453 1 13 . 1 1 39 39 SER CA C 39 54.960 54.960 56.707 -1.747 25153 11454 1 13 . 1 1 39 39 SER CB C 39 64.720 64.720 63.543 1.177 25153 11455 1 13 . 1 1 39 39 SER H H 39 8.351 8.351 8.562 -0.211 25153 11456 1 13 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.090 -0.085 25153 11457 1 13 . 1 1 40 40 PRO C C 40 176.730 176.730 177.739 -1.009 25153 11458 1 13 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.969 -0.069 25153 11459 1 13 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.786 -0.386 25153 11460 1 13 . 1 1 41 41 LYS N N 41 121.150 121.150 119.787 1.363 25153 11461 1 13 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.972 -0.060 25153 11462 1 13 . 1 1 41 41 LYS C C 41 179.600 179.600 178.518 1.082 25153 11463 1 13 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.456 -1.256 25153 11464 1 13 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.661 0.339 25153 11465 1 13 . 1 1 42 42 LEU N N 42 118.103 118.103 116.251 1.852 25153 11466 1 13 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.197 -0.160 25153 11467 1 13 . 1 1 42 42 LEU C C 42 178.760 178.760 178.801 -0.041 25153 11468 1 13 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.393 -0.213 25153 11469 1 13 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.553 1.420 25153 11470 1 13 . 1 1 42 42 LEU H H 42 7.600 7.600 7.499 0.101 25153 11471 1 13 . 1 1 43 43 MET N N 43 118.917 118.917 117.093 1.824 25153 11472 1 13 . 1 1 43 43 MET HA H 43 3.750 3.750 4.430 -0.680 25153 11473 1 13 . 1 1 43 43 MET C C 43 177.680 177.680 176.877 0.803 25153 11474 1 13 . 1 1 43 43 MET CA C 43 59.730 59.730 58.075 1.655 25153 11475 1 13 . 1 1 43 43 MET CB C 43 32.700 32.700 31.849 0.851 25153 11476 1 13 . 1 1 43 43 MET H H 43 8.202 8.202 7.999 0.203 25153 11477 1 13 . 1 1 44 44 GLU N N 44 110.924 110.924 117.742 -6.818 25153 11478 1 13 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.245 -0.505 25153 11479 1 13 . 1 1 44 44 GLU C C 44 178.130 178.130 179.066 -0.936 25153 11480 1 13 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.208 1.192 25153 11481 1 13 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.892 -0.342 25153 11482 1 13 . 1 1 45 45 GLN N N 45 115.756 115.756 118.766 -3.010 25153 11483 1 13 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.051 0.132 25153 11484 1 13 . 1 1 45 45 GLN C C 45 175.414 175.414 177.197 -1.783 25153 11485 1 13 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.598 -1.418 25153 11486 1 13 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.176 -0.576 25153 11487 1 13 . 1 1 45 45 GLN H H 45 7.516 7.516 7.581 -0.065 25153 11488 1 13 . 1 1 46 46 TYR N N 46 117.860 117.860 118.746 -0.886 25153 11489 1 13 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.370 0.293 25153 11490 1 13 . 1 1 46 46 TYR C C 46 175.500 175.500 176.959 -1.459 25153 11491 1 13 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.413 -0.927 25153 11492 1 13 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.371 3.099 25153 11493 1 13 . 1 1 46 46 TYR H H 46 6.996 6.996 7.328 -0.332 25153 11494 1 13 . 1 1 47 47 ASP N N 47 121.683 121.683 122.826 -1.143 25153 11495 1 13 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.648 0.052 25153 11496 1 13 . 1 1 47 47 ASP C C 47 175.610 175.610 175.008 0.602 25153 11497 1 13 . 1 1 47 47 ASP CA C 47 56.700 56.700 56.069 0.631 25153 11498 1 13 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.685 1.315 25153 11499 1 13 . 1 1 48 48 VAL N N 48 118.628 118.628 116.434 2.194 25153 11500 1 13 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.923 0.111 25153 11501 1 13 . 1 1 48 48 VAL C C 48 174.190 174.190 174.073 0.117 25153 11502 1 13 . 1 1 48 48 VAL CA C 48 60.190 60.190 60.552 -0.362 25153 11503 1 13 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.649 0.451 25153 11504 1 13 . 1 1 48 48 VAL H H 48 7.628 7.628 7.360 0.268 25153 11505 1 13 . 1 1 49 49 LEU N N 49 128.190 128.190 124.858 3.332 25153 11506 1 13 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.416 0.187 25153 11507 1 13 . 1 1 49 49 LEU C C 49 174.880 174.880 175.734 -0.854 25153 11508 1 13 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.776 -0.536 25153 11509 1 13 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.536 -0.196 25153 11510 1 13 . 1 1 49 49 LEU H H 49 9.407 9.407 9.124 0.283 25153 11511 1 13 . 1 1 50 50 ILE N N 50 124.550 124.550 120.635 3.915 25153 11512 1 13 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.000 0.700 25153 11513 1 13 . 1 1 50 50 ILE C C 50 175.300 175.300 174.716 0.584 25153 11514 1 13 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.981 -1.117 25153 11515 1 13 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.727 -0.477 25153 11516 1 13 . 1 1 50 50 ILE H H 50 9.238 9.238 9.061 0.177 25153 11517 1 13 . 1 1 51 51 LEU N N 51 127.460 127.460 128.395 -0.935 25153 11518 1 13 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.815 0.370 25153 11519 1 13 . 1 1 51 51 LEU C C 51 174.544 174.544 175.921 -1.377 25153 11520 1 13 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.647 -0.827 25153 11521 1 13 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.867 -2.230 25153 11522 1 13 . 1 1 51 51 LEU H H 51 9.228 9.228 9.041 0.187 25153 11523 1 13 . 1 1 52 52 GLY N N 52 107.760 107.760 111.772 -4.012 25153 11524 1 13 . 1 1 52 52 GLY C C 52 174.710 174.710 172.517 2.193 25153 11525 1 13 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.872 -0.002 25153 11526 1 13 . 1 1 52 52 GLY H H 52 8.860 8.860 9.029 -0.169 25153 11527 1 13 . 1 1 53 53 ILE N N 53 123.890 123.890 120.376 3.514 25153 11528 1 13 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.817 0.453 25153 11529 1 13 . 1 1 53 53 ILE C C 53 172.630 172.630 173.236 -0.606 25153 11530 1 13 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.643 0.037 25153 11531 1 13 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.297 3.863 25153 11532 1 13 . 1 1 53 53 ILE H H 53 8.458 8.458 7.991 0.467 25153 11533 1 13 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.889 0.499 25153 11534 1 13 . 1 1 54 54 PRO C C 54 175.000 175.000 176.602 -1.602 25153 11535 1 13 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.870 -0.270 25153 11536 1 13 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.040 -0.740 25153 11537 1 13 . 1 1 55 55 THR N N 55 112.754 112.754 117.872 -5.118 25153 11538 1 13 . 1 1 55 55 THR HA H 55 4.452 4.452 4.843 -0.391 25153 11539 1 13 . 1 1 55 55 THR C C 55 172.480 172.480 174.081 -1.601 25153 11540 1 13 . 1 1 55 55 THR CA C 55 62.350 62.350 62.624 -0.274 25153 11541 1 13 . 1 1 55 55 THR CB C 55 70.230 70.230 70.262 -0.032 25153 11542 1 13 . 1 1 55 55 THR H H 55 6.523 6.523 8.047 -1.524 25153 11543 1 13 . 1 1 56 56 TRP N N 56 130.044 130.044 126.520 3.524 25153 11544 1 13 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.554 -1.839 25153 11545 1 13 . 1 1 56 56 TRP C C 56 172.890 172.890 175.088 -2.198 25153 11546 1 13 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.627 0.023 25153 11547 1 13 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.132 0.868 25153 11548 1 13 . 1 1 56 56 TRP H H 56 8.450 8.450 8.723 -0.273 25153 11549 1 13 . 1 1 57 57 ASP N N 57 115.275 115.275 120.613 -5.338 25153 11550 1 13 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.866 0.486 25153 11551 1 13 . 1 1 57 57 ASP C C 57 173.660 173.660 174.616 -0.956 25153 11552 1 13 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.421 0.809 25153 11553 1 13 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.983 0.187 25153 11554 1 13 . 1 1 58 58 PHE N N 58 112.840 112.840 116.009 -3.169 25153 11555 1 13 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.620 -0.296 25153 11556 1 13 . 1 1 58 58 PHE C C 58 175.730 175.730 176.235 -0.505 25153 11557 1 13 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.624 1.199 25153 11558 1 13 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.926 -2.172 25153 11559 1 13 . 1 1 58 58 PHE H H 58 7.640 7.640 7.323 0.317 25153 11560 1 13 . 1 1 59 59 GLY N N 59 104.940 104.940 107.079 -2.139 25153 11561 1 13 . 1 1 59 59 GLY C C 59 173.750 173.750 174.402 -0.652 25153 11562 1 13 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.293 0.997 25153 11563 1 13 . 1 1 59 59 GLY H H 59 8.024 8.024 8.817 -0.793 25153 11564 1 13 . 1 1 60 60 GLU N N 60 120.045 120.045 119.111 0.934 25153 11565 1 13 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.642 -0.229 25153 11566 1 13 . 1 1 60 60 GLU C C 60 176.050 176.050 175.795 0.255 25153 11567 1 13 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.470 0.150 25153 11568 1 13 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.925 -1.315 25153 11569 1 13 . 1 1 61 61 ILE N N 61 120.790 120.790 119.655 1.135 25153 11570 1 13 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.305 -0.838 25153 11571 1 13 . 1 1 61 61 ILE C C 61 175.130 175.130 176.156 -1.026 25153 11572 1 13 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.508 1.039 25153 11573 1 13 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.734 -0.884 25153 11574 1 13 . 1 1 61 61 ILE H H 61 8.200 8.200 8.263 -0.063 25153 11575 1 13 . 1 1 62 62 GLN N N 62 124.520 124.520 124.394 0.126 25153 11576 1 13 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.135 -0.179 25153 11577 1 13 . 1 1 62 62 GLN C C 62 177.160 177.160 176.951 0.209 25153 11578 1 13 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.640 1.970 25153 11579 1 13 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.191 -2.541 25153 11580 1 13 . 1 1 62 62 GLN H H 62 5.667 5.667 8.823 -3.156 25153 11581 1 13 . 1 1 63 63 GLU N N 63 124.570 124.570 125.731 -1.161 25153 11582 1 13 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.182 -0.196 25153 11583 1 13 . 1 1 63 63 GLU C C 63 177.300 177.300 177.132 0.168 25153 11584 1 13 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.956 1.764 25153 11585 1 13 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.209 0.911 25153 11586 1 13 . 1 1 64 64 ASP N N 64 119.060 119.060 119.618 -0.558 25153 11587 1 13 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.401 0.219 25153 11588 1 13 . 1 1 64 64 ASP C C 64 179.180 179.180 177.263 1.917 25153 11589 1 13 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.919 1.032 25153 11590 1 13 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.135 0.815 25153 11591 1 13 . 1 1 65 65 TRP N N 65 121.070 121.070 120.914 0.156 25153 11592 1 13 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.519 -0.179 25153 11593 1 13 . 1 1 65 65 TRP C C 65 178.970 178.970 178.082 0.888 25153 11594 1 13 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.657 0.163 25153 11595 1 13 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.556 -0.156 25153 11596 1 13 . 1 1 65 65 TRP H H 65 7.350 7.350 8.047 -0.697 25153 11597 1 13 . 1 1 66 66 GLU N N 66 120.900 120.900 119.081 1.819 25153 11598 1 13 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.859 -0.019 25153 11599 1 13 . 1 1 66 66 GLU C C 66 178.750 178.750 179.121 -0.371 25153 11600 1 13 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.519 0.481 25153 11601 1 13 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.283 -0.423 25153 11602 1 13 . 1 1 67 67 ALA N N 67 119.130 119.130 119.892 -0.762 25153 11603 1 13 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.234 0.019 25153 11604 1 13 . 1 1 67 67 ALA C C 67 179.410 179.410 179.143 0.267 25153 11605 1 13 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.764 -0.184 25153 11606 1 13 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.949 -0.139 25153 11607 1 13 . 1 1 67 67 ALA H H 67 7.640 7.640 8.152 -0.512 25153 11608 1 13 . 1 1 68 68 VAL N N 68 106.845 106.845 111.868 -5.023 25153 11609 1 13 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.490 0.320 25153 11610 1 13 . 1 1 68 68 VAL C C 68 176.750 176.750 176.865 -0.115 25153 11611 1 13 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.582 -2.972 25153 11612 1 13 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.658 -0.039 25153 11613 1 13 . 1 1 68 68 VAL H H 68 7.219 7.219 7.543 -0.324 25153 11614 1 13 . 1 1 69 69 TRP N N 69 127.630 127.630 123.685 3.945 25153 11615 1 13 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.306 -0.068 25153 11616 1 13 . 1 1 69 69 TRP C C 69 178.670 178.670 177.276 1.394 25153 11617 1 13 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.038 -0.818 25153 11618 1 13 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.477 2.153 25153 11619 1 13 . 1 1 69 69 TRP H H 69 7.832 7.832 8.524 -0.692 25153 11620 1 13 . 1 1 70 70 ASP N N 70 114.544 114.544 118.193 -3.649 25153 11621 1 13 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.456 0.066 25153 11622 1 13 . 1 1 70 70 ASP C C 70 178.670 178.670 178.996 -0.326 25153 11623 1 13 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.209 -1.209 25153 11624 1 13 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.997 -1.147 25153 11625 1 13 . 1 1 71 71 GLN N N 71 120.040 120.040 119.452 0.588 25153 11626 1 13 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.117 0.067 25153 11627 1 13 . 1 1 71 71 GLN C C 71 178.910 178.910 178.807 0.103 25153 11628 1 13 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.353 -0.743 25153 11629 1 13 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.842 0.258 25153 11630 1 13 . 1 1 71 71 GLN H H 71 7.995 7.995 7.713 0.282 25153 11631 1 13 . 1 1 72 72 LEU N N 72 117.400 117.400 119.623 -2.223 25153 11632 1 13 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.936 -0.123 25153 11633 1 13 . 1 1 72 72 LEU C C 72 178.650 178.650 178.150 0.500 25153 11634 1 13 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.268 -0.068 25153 11635 1 13 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.247 0.163 25153 11636 1 13 . 1 1 72 72 LEU H H 72 7.450 7.450 7.766 -0.316 25153 11637 1 13 . 1 1 73 73 ASP N N 73 115.750 115.750 118.494 -2.744 25153 11638 1 13 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.423 -0.255 25153 11639 1 13 . 1 1 73 73 ASP C C 73 177.560 177.560 177.450 0.110 25153 11640 1 13 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.762 0.638 25153 11641 1 13 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.213 -1.113 25153 11642 1 13 . 1 1 74 74 ASP N N 74 117.223 117.223 119.930 -2.707 25153 11643 1 13 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.581 0.122 25153 11644 1 13 . 1 1 74 74 ASP C C 74 176.388 176.388 177.027 -0.639 25153 11645 1 13 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.063 -0.563 25153 11646 1 13 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.579 0.121 25153 11647 1 13 . 1 1 75 75 LEU N N 75 118.316 118.316 119.379 -1.063 25153 11648 1 13 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.376 -0.091 25153 11649 1 13 . 1 1 75 75 LEU C C 75 176.820 176.820 175.765 1.055 25153 11650 1 13 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.413 -0.013 25153 11651 1 13 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.507 0.773 25153 11652 1 13 . 1 1 75 75 LEU H H 75 6.960 6.960 7.298 -0.338 25153 11653 1 13 . 1 1 76 76 ASN N N 76 123.045 123.045 118.076 4.969 25153 11654 1 13 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.786 0.104 25153 11655 1 13 . 1 1 76 76 ASN C C 76 174.950 174.950 174.750 0.200 25153 11656 1 13 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.657 -0.607 25153 11657 1 13 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.565 -1.065 25153 11658 1 13 . 1 1 76 76 ASN H H 76 9.890 9.890 8.752 1.138 25153 11659 1 13 . 1 1 77 77 LEU N N 77 123.494 123.494 123.543 -0.049 25153 11660 1 13 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.547 -0.177 25153 11661 1 13 . 1 1 77 77 LEU C C 77 175.040 175.040 176.119 -1.079 25153 11662 1 13 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.260 -1.010 25153 11663 1 13 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.247 0.653 25153 11664 1 13 . 1 1 77 77 LEU H H 77 8.730 8.730 8.098 0.632 25153 11665 1 13 . 1 1 78 78 GLU N N 78 120.870 120.870 121.335 -0.465 25153 11666 1 13 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.294 -0.394 25153 11667 1 13 . 1 1 78 78 GLU C C 78 178.660 178.660 177.772 0.888 25153 11668 1 13 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.435 1.325 25153 11669 1 13 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.160 0.240 25153 11670 1 13 . 1 1 79 79 GLY N N 79 113.240 113.240 113.928 -0.688 25153 11671 1 13 . 1 1 79 79 GLY C C 79 174.460 174.460 174.251 0.209 25153 11672 1 13 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.399 0.031 25153 11673 1 13 . 1 1 79 79 GLY H H 79 8.474 8.474 8.873 -0.399 25153 11674 1 13 . 1 1 80 80 LYS N N 80 120.295 120.295 119.920 0.375 25153 11675 1 13 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.616 -0.258 25153 11676 1 13 . 1 1 80 80 LYS C C 80 175.360 175.360 176.193 -0.833 25153 11677 1 13 . 1 1 80 80 LYS CA C 80 56.970 56.970 55.837 1.133 25153 11678 1 13 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.922 -0.722 25153 11679 1 13 . 1 1 81 81 ILE N N 81 122.400 122.400 122.423 -0.023 25153 11680 1 13 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.574 0.219 25153 11681 1 13 . 1 1 81 81 ILE C C 81 174.760 174.760 175.638 -0.878 25153 11682 1 13 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.692 -1.862 25153 11683 1 13 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.707 -0.007 25153 11684 1 13 . 1 1 81 81 ILE H H 81 7.400 7.400 7.825 -0.425 25153 11685 1 13 . 1 1 82 82 VAL N N 82 127.840 127.840 126.055 1.785 25153 11686 1 13 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.997 0.265 25153 11687 1 13 . 1 1 82 82 VAL C C 82 172.724 172.724 174.338 -1.614 25153 11688 1 13 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.354 0.056 25153 11689 1 13 . 1 1 82 82 VAL CB C 82 35.400 35.400 34.956 0.444 25153 11690 1 13 . 1 1 82 82 VAL H H 82 8.790 8.790 8.724 0.066 25153 11691 1 13 . 1 1 83 83 ALA N N 83 131.347 131.347 130.522 0.825 25153 11692 1 13 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.319 0.063 25153 11693 1 13 . 1 1 83 83 ALA C C 83 175.750 175.750 176.517 -0.767 25153 11694 1 13 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.048 -0.178 25153 11695 1 13 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.788 2.663 25153 11696 1 13 . 1 1 83 83 ALA H H 83 9.300 9.300 8.967 0.333 25153 11697 1 13 . 1 1 84 84 LEU N N 84 124.200 124.200 126.702 -2.502 25153 11698 1 13 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.636 -0.116 25153 11699 1 13 . 1 1 84 84 LEU C C 84 175.760 175.760 176.804 -1.044 25153 11700 1 13 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.901 -0.401 25153 11701 1 13 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.332 1.568 25153 11702 1 13 . 1 1 84 84 LEU H H 84 10.287 10.287 8.891 1.396 25153 11703 1 13 . 1 1 85 85 TYR N N 85 115.912 115.912 119.174 -3.262 25153 11704 1 13 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.363 -0.403 25153 11705 1 13 . 1 1 85 85 TYR C C 85 172.372 172.372 173.737 -1.365 25153 11706 1 13 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.234 0.866 25153 11707 1 13 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.509 1.521 25153 11708 1 13 . 1 1 85 85 TYR H H 85 9.257 9.257 8.760 0.497 25153 11709 1 13 . 1 1 86 86 GLY N N 86 107.800 107.800 105.479 2.321 25153 11710 1 13 . 1 1 86 86 GLY C C 86 170.330 170.330 171.493 -1.163 25153 11711 1 13 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.792 -0.422 25153 11712 1 13 . 1 1 86 86 GLY H H 86 9.027 9.027 8.581 0.446 25153 11713 1 13 . 1 1 87 87 LEU N N 87 123.458 123.458 118.526 4.932 25153 11714 1 13 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.274 0.191 25153 11715 1 13 . 1 1 87 87 LEU C C 87 178.100 178.100 175.888 2.212 25153 11716 1 13 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.914 0.676 25153 11717 1 13 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.525 -0.185 25153 11718 1 13 . 1 1 87 87 LEU H H 87 6.580 6.580 7.839 -1.259 25153 11719 1 13 . 1 1 88 88 GLY N N 88 108.966 108.966 107.459 1.507 25153 11720 1 13 . 1 1 88 88 GLY C C 88 172.820 172.820 171.544 1.276 25153 11721 1 13 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.048 1.612 25153 11722 1 13 . 1 1 88 88 GLY H H 88 8.070 8.070 8.424 -0.354 25153 11723 1 13 . 1 1 89 89 ASP N N 89 121.150 121.150 119.120 2.030 25153 11724 1 13 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.567 -0.321 25153 11725 1 13 . 1 1 89 89 ASP C C 89 176.220 176.220 176.918 -0.698 25153 11726 1 13 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.986 -0.516 25153 11727 1 13 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.017 -0.537 25153 11728 1 13 . 1 1 90 90 GLN N N 90 123.970 123.970 125.906 -1.936 25153 11729 1 13 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.083 -0.595 25153 11730 1 13 . 1 1 90 90 GLN C C 90 173.646 173.646 176.794 -3.148 25153 11731 1 13 . 1 1 90 90 GLN CA C 90 58.310 58.310 58.056 0.254 25153 11732 1 13 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.964 -0.754 25153 11733 1 13 . 1 1 90 90 GLN H H 90 8.623 8.623 9.424 -0.801 25153 11734 1 13 . 1 1 91 91 LEU N N 91 118.017 118.017 119.723 -1.706 25153 11735 1 13 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.178 0.197 25153 11736 1 13 . 1 1 91 91 LEU C C 91 180.160 180.160 178.885 1.275 25153 11737 1 13 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.606 -0.546 25153 11738 1 13 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.896 -0.346 25153 11739 1 13 . 1 1 91 91 LEU H H 91 7.046 7.046 8.047 -1.001 25153 11740 1 13 . 1 1 92 92 GLY N N 92 110.028 110.028 106.200 3.828 25153 11741 1 13 . 1 1 92 92 GLY C C 92 174.912 174.912 174.827 0.085 25153 11742 1 13 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.767 0.413 25153 11743 1 13 . 1 1 92 92 GLY H H 92 9.238 9.238 8.699 0.539 25153 11744 1 13 . 1 1 93 93 TYR N N 93 115.910 115.910 119.225 -3.315 25153 11745 1 13 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.309 -0.300 25153 11746 1 13 . 1 1 93 93 TYR C C 93 176.850 176.850 176.819 0.031 25153 11747 1 13 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.526 0.204 25153 11748 1 13 . 1 1 93 93 TYR CB C 93 38.130 38.130 39.029 -0.899 25153 11749 1 13 . 1 1 93 93 TYR H H 93 6.962 6.962 8.031 -1.069 25153 11750 1 13 . 1 1 94 94 GLY N N 94 111.630 111.630 110.734 0.896 25153 11751 1 13 . 1 1 94 94 GLY C C 94 177.777 177.777 175.908 1.869 25153 11752 1 13 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.276 2.754 25153 11753 1 13 . 1 1 94 94 GLY H H 94 7.835 7.835 8.030 -0.195 25153 11754 1 13 . 1 1 95 95 GLU N N 95 122.450 122.450 120.228 2.222 25153 11755 1 13 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.914 0.004 25153 11756 1 13 . 1 1 95 95 GLU C C 95 175.300 175.300 176.899 -1.599 25153 11757 1 13 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.367 -0.267 25153 11758 1 13 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.113 -0.602 25153 11759 1 13 . 1 1 96 96 TRP N N 96 118.790 118.790 117.526 1.264 25153 11760 1 13 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.936 0.508 25153 11761 1 13 . 1 1 96 96 TRP C C 96 179.280 179.280 175.839 3.441 25153 11762 1 13 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.915 1.100 25153 11763 1 13 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.975 0.045 25153 11764 1 13 . 1 1 96 96 TRP H H 96 8.070 8.070 8.197 -0.127 25153 11765 1 13 . 1 1 97 97 PHE N N 97 128.067 128.067 123.549 4.518 25153 11766 1 13 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.310 0.995 25153 11767 1 13 . 1 1 97 97 PHE C C 97 173.227 173.227 175.975 -2.748 25153 11768 1 13 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.399 -2.679 25153 11769 1 13 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.545 0.395 25153 11770 1 13 . 1 1 97 97 PHE H H 97 7.165 7.165 8.287 -1.122 25153 11771 1 13 . 1 1 98 98 LEU N N 98 114.306 114.306 124.237 -9.931 25153 11772 1 13 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.625 -0.135 25153 11773 1 13 . 1 1 98 98 LEU C C 98 179.365 179.365 177.457 1.908 25153 11774 1 13 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.701 -0.241 25153 11775 1 13 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.895 -0.665 25153 11776 1 13 . 1 1 98 98 LEU H H 98 7.453 7.453 8.613 -1.160 25153 11777 1 13 . 1 1 99 99 ASP N N 99 122.354 122.354 120.410 1.944 25153 11778 1 13 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.303 -0.370 25153 11779 1 13 . 1 1 99 99 ASP C C 99 178.800 178.800 177.164 1.636 25153 11780 1 13 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.733 1.446 25153 11781 1 13 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.413 -0.983 25153 11782 1 13 . 1 1 100 100 ALA N N 100 118.568 118.568 121.961 -3.393 25153 11783 1 13 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.065 -0.225 25153 11784 1 13 . 1 1 100 100 ALA C C 100 178.500 178.500 179.273 -0.773 25153 11785 1 13 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.976 -0.060 25153 11786 1 13 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.380 1.280 25153 11787 1 13 . 1 1 100 100 ALA H H 100 8.682 8.682 7.865 0.817 25153 11788 1 13 . 1 1 101 101 LEU N N 101 118.815 118.815 120.570 -1.755 25153 11789 1 13 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.984 -0.304 25153 11790 1 13 . 1 1 101 101 LEU C C 101 178.930 178.930 178.819 0.111 25153 11791 1 13 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.781 -0.081 25153 11792 1 13 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.559 0.842 25153 11793 1 13 . 1 1 101 101 LEU H H 101 6.637 6.637 7.676 -1.039 25153 11794 1 13 . 1 1 102 102 GLY N N 102 103.700 103.700 106.405 -2.705 25153 11795 1 13 . 1 1 102 102 GLY C C 102 175.530 175.530 176.160 -0.630 25153 11796 1 13 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.223 0.777 25153 11797 1 13 . 1 1 102 102 GLY H H 102 7.330 7.330 7.821 -0.491 25153 11798 1 13 . 1 1 103 103 MET N N 103 120.330 120.330 121.619 -1.289 25153 11799 1 13 . 1 1 103 103 MET HA H 103 4.254 4.254 4.203 0.051 25153 11800 1 13 . 1 1 103 103 MET C C 103 179.688 179.688 178.620 1.068 25153 11801 1 13 . 1 1 103 103 MET CA C 103 59.615 59.615 59.600 0.015 25153 11802 1 13 . 1 1 103 103 MET CB C 103 33.290 33.290 32.607 0.683 25153 11803 1 13 . 1 1 103 103 MET H H 103 8.407 8.407 7.958 0.449 25153 11804 1 13 . 1 1 104 104 LEU N N 104 123.450 123.450 119.611 3.839 25153 11805 1 13 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.709 0.487 25153 11806 1 13 . 1 1 104 104 LEU C C 104 177.620 177.620 178.764 -1.144 25153 11807 1 13 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.822 0.148 25153 11808 1 13 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.270 0.030 25153 11809 1 13 . 1 1 104 104 LEU H H 104 8.330 8.330 8.623 -0.293 25153 11810 1 13 . 1 1 105 105 HIS N N 105 119.040 119.040 119.216 -0.176 25153 11811 1 13 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.062 -0.185 25153 11812 1 13 . 1 1 105 105 HIS C C 105 177.100 177.100 177.037 0.063 25153 11813 1 13 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.833 0.137 25153 11814 1 13 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.854 -1.261 25153 11815 1 13 . 1 1 105 105 HIS H H 105 8.050 8.050 8.350 -0.300 25153 11816 1 13 . 1 1 106 106 ASP N N 106 119.950 119.950 119.584 0.366 25153 11817 1 13 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.525 -0.195 25153 11818 1 13 . 1 1 106 106 ASP C C 106 179.300 179.300 178.357 0.943 25153 11819 1 13 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.707 1.103 25153 11820 1 13 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.257 -0.857 25153 11821 1 13 . 1 1 107 107 LYS N N 107 122.060 122.060 120.181 1.879 25153 11822 1 13 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.062 0.071 25153 11823 1 13 . 1 1 107 107 LYS C C 107 178.100 178.100 178.379 -0.279 25153 11824 1 13 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.484 -0.284 25153 11825 1 13 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.160 0.200 25153 11826 1 13 . 1 1 108 108 LEU N N 108 115.610 115.610 115.626 -0.016 25153 11827 1 13 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.371 -0.303 25153 11828 1 13 . 1 1 108 108 LEU C C 108 178.866 178.866 178.066 0.800 25153 11829 1 13 . 1 1 108 108 LEU CA C 108 55.954 55.954 55.725 0.229 25153 11830 1 13 . 1 1 108 108 LEU CB C 108 42.160 42.160 42.339 -0.179 25153 11831 1 13 . 1 1 108 108 LEU H H 108 7.828 7.828 8.104 -0.276 25153 11832 1 13 . 1 1 109 109 SER N N 109 116.362 116.362 116.004 0.358 25153 11833 1 13 . 1 1 109 109 SER HA H 109 4.299 4.299 4.339 -0.040 25153 11834 1 13 . 1 1 109 109 SER C C 109 175.660 175.660 176.582 -0.922 25153 11835 1 13 . 1 1 109 109 SER CA C 109 62.350 62.350 61.260 1.090 25153 11836 1 13 . 1 1 109 109 SER CB C 109 62.815 62.815 62.947 -0.132 25153 11837 1 13 . 1 1 109 109 SER H H 109 8.278 8.278 8.487 -0.209 25153 11838 1 13 . 1 1 110 110 THR N N 110 110.230 110.230 115.658 -5.428 25153 11839 1 13 . 1 1 110 110 THR HA H 110 4.615 4.615 4.255 0.360 25153 11840 1 13 . 1 1 110 110 THR C C 110 175.990 175.990 175.646 0.344 25153 11841 1 13 . 1 1 110 110 THR CA C 110 62.090 62.090 63.983 -1.893 25153 11842 1 13 . 1 1 110 110 THR CB C 110 68.800 68.800 68.718 0.082 25153 11843 1 13 . 1 1 110 110 THR H H 110 7.211 7.211 7.701 -0.490 25153 11844 1 13 . 1 1 111 111 LYS N N 111 119.900 119.900 120.062 -0.162 25153 11845 1 13 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.340 0.172 25153 11846 1 13 . 1 1 111 111 LYS C C 111 176.916 176.916 176.553 0.363 25153 11847 1 13 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.488 0.166 25153 11848 1 13 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.067 -1.224 25153 11849 1 13 . 1 1 112 112 GLY N N 112 107.910 107.910 108.013 -0.103 25153 11850 1 13 . 1 1 112 112 GLY C C 112 176.250 176.250 173.929 2.321 25153 11851 1 13 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.570 1.470 25153 11852 1 13 . 1 1 112 112 GLY H H 112 8.366 8.366 7.694 0.672 25153 11853 1 13 . 1 1 113 113 VAL N N 113 113.530 113.530 114.844 -1.314 25153 11854 1 13 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.464 0.010 25153 11855 1 13 . 1 1 113 113 VAL C C 113 174.630 174.630 174.704 -0.074 25153 11856 1 13 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.584 -1.134 25153 11857 1 13 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.876 -0.326 25153 11858 1 13 . 1 1 113 113 VAL H H 113 6.903 6.903 6.939 -0.036 25153 11859 1 13 . 1 1 114 114 LYS N N 114 123.020 123.020 119.586 3.434 25153 11860 1 13 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.582 -0.077 25153 11861 1 13 . 1 1 114 114 LYS C C 114 175.000 175.000 174.705 0.295 25153 11862 1 13 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.446 -0.246 25153 11863 1 13 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.623 -1.283 25153 11864 1 13 . 1 1 115 115 PHE N N 115 123.290 123.290 121.580 1.710 25153 11865 1 13 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.637 0.076 25153 11866 1 13 . 1 1 115 115 PHE C C 115 177.605 177.605 176.340 1.265 25153 11867 1 13 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.955 1.655 25153 11868 1 13 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.235 -0.235 25153 11869 1 13 . 1 1 115 115 PHE H H 115 8.494 8.494 8.607 -0.113 25153 11870 1 13 . 1 1 116 116 VAL N N 116 115.790 115.790 114.781 1.009 25153 11871 1 13 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.485 0.007 25153 11872 1 13 . 1 1 116 116 VAL C C 116 175.414 175.414 176.026 -0.612 25153 11873 1 13 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.161 -0.175 25153 11874 1 13 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.749 -0.650 25153 11875 1 13 . 1 1 116 116 VAL H H 116 8.889 8.889 8.341 0.548 25153 11876 1 13 . 1 1 117 117 GLY N N 117 108.300 108.300 108.072 0.228 25153 11877 1 13 . 1 1 117 117 GLY C C 117 176.180 176.180 174.697 1.483 25153 11878 1 13 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.450 2.350 25153 11879 1 13 . 1 1 117 117 GLY H H 117 9.810 9.810 8.671 1.139 25153 11880 1 13 . 1 1 118 118 TYR N N 118 120.050 120.050 119.927 0.123 25153 11881 1 13 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.684 0.270 25153 11882 1 13 . 1 1 118 118 TYR C C 118 177.450 177.450 175.915 1.535 25153 11883 1 13 . 1 1 118 118 TYR CA C 118 56.240 56.240 59.233 -2.993 25153 11884 1 13 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.222 -3.112 25153 11885 1 13 . 1 1 118 118 TYR H H 118 8.592 8.592 7.370 1.222 25153 11886 1 13 . 1 1 119 119 TRP N N 119 125.500 125.500 121.295 4.205 25153 11887 1 13 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.186 0.842 25153 11888 1 13 . 1 1 119 119 TRP C C 119 173.090 173.090 174.177 -1.087 25153 11889 1 13 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.445 -0.545 25153 11890 1 13 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.722 2.528 25153 11891 1 13 . 1 1 119 119 TRP H H 119 7.926 7.926 8.278 -0.352 25153 11892 1 13 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.883 -0.073 25153 11893 1 13 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.777 0.903 25153 11894 1 13 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.730 -0.480 25153 11895 1 13 . 1 1 121 121 THR N N 121 109.114 109.114 112.624 -3.510 25153 11896 1 13 . 1 1 121 121 THR HA H 121 4.142 4.142 3.542 0.600 25153 11897 1 13 . 1 1 121 121 THR C C 121 176.300 176.300 175.174 1.126 25153 11898 1 13 . 1 1 121 121 THR CA C 121 61.230 61.230 61.683 -0.453 25153 11899 1 13 . 1 1 121 121 THR CB C 121 69.890 69.890 68.088 1.802 25153 11900 1 13 . 1 1 121 121 THR H H 121 7.356 7.356 8.328 -0.972 25153 11901 1 13 . 1 1 122 122 GLU N N 122 123.980 123.980 121.667 2.313 25153 11902 1 13 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.016 0.222 25153 11903 1 13 . 1 1 122 122 GLU C C 122 177.830 177.830 177.599 0.231 25153 11904 1 13 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.372 0.858 25153 11905 1 13 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.945 -0.175 25153 11906 1 13 . 1 1 123 123 GLY N N 123 114.570 114.570 111.805 2.765 25153 11907 1 13 . 1 1 123 123 GLY C C 123 173.700 173.700 173.678 0.022 25153 11908 1 13 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.523 -0.123 25153 11909 1 13 . 1 1 123 123 GLY H H 123 9.181 9.181 8.866 0.315 25153 11910 1 13 . 1 1 124 124 TYR N N 124 118.923 118.923 118.952 -0.029 25153 11911 1 13 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.861 0.449 25153 11912 1 13 . 1 1 124 124 TYR C C 124 175.680 175.680 174.522 1.158 25153 11913 1 13 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.483 -1.013 25153 11914 1 13 . 1 1 124 124 TYR CB C 124 41.000 41.000 42.784 -1.784 25153 11915 1 13 . 1 1 124 124 TYR H H 124 7.877 7.877 7.563 0.314 25153 11916 1 13 . 1 1 125 125 GLU N N 125 124.890 124.890 122.239 2.651 25153 11917 1 13 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.721 -0.021 25153 11918 1 13 . 1 1 125 125 GLU C C 125 172.880 172.880 175.203 -2.323 25153 11919 1 13 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.799 -0.369 25153 11920 1 13 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.045 -0.625 25153 11921 1 13 . 1 1 126 126 PHE N N 126 119.166 119.166 120.776 -1.610 25153 11922 1 13 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.582 0.227 25153 11923 1 13 . 1 1 126 126 PHE C C 126 173.750 173.750 174.390 -0.640 25153 11924 1 13 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.069 -1.279 25153 11925 1 13 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.347 0.703 25153 11926 1 13 . 1 1 126 126 PHE H H 126 7.716 7.716 7.959 -0.243 25153 11927 1 13 . 1 1 127 127 THR N N 127 106.800 106.800 115.001 -8.201 25153 11928 1 13 . 1 1 127 127 THR HA H 127 4.400 4.400 3.359 1.041 25153 11929 1 13 . 1 1 127 127 THR C C 127 175.300 175.300 174.199 1.101 25153 11930 1 13 . 1 1 127 127 THR CA C 127 61.100 61.100 62.916 -1.816 25153 11931 1 13 . 1 1 127 127 THR CB C 127 70.600 70.600 67.602 2.998 25153 11932 1 13 . 1 1 127 127 THR H H 127 7.220 7.220 6.529 0.691 25153 11933 1 13 . 1 1 128 128 SER N N 128 118.360 118.360 116.116 2.244 25153 11934 1 13 . 1 1 128 128 SER HA H 128 4.680 4.680 4.518 0.162 25153 11935 1 13 . 1 1 128 128 SER C C 128 175.720 175.720 174.088 1.632 25153 11936 1 13 . 1 1 128 128 SER CA C 128 56.250 56.250 56.601 -0.351 25153 11937 1 13 . 1 1 128 128 SER CB C 128 65.635 65.635 64.171 1.464 25153 11938 1 13 . 1 1 128 128 SER H H 128 7.411 7.411 8.131 -0.720 25153 11939 1 13 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.625 0.150 25153 11940 1 13 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.327 -1.827 25153 11941 1 13 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.242 0.158 25153 11942 1 13 . 1 1 130 130 LYS N N 130 122.014 122.014 120.030 1.984 25153 11943 1 13 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.373 -0.140 25153 11944 1 13 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.383 3.317 25153 11945 1 13 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.179 -0.609 25153 11946 1 13 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.578 -0.060 25153 11947 1 13 . 1 1 131 131 PRO C C 131 174.000 174.000 175.235 -1.235 25153 11948 1 13 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.455 2.245 25153 11949 1 13 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.314 0.886 25153 11950 1 13 . 1 1 132 132 VAL N N 132 113.260 113.260 116.927 -3.667 25153 11951 1 13 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.960 0.240 25153 11952 1 13 . 1 1 132 132 VAL C C 132 175.210 175.210 174.981 0.229 25153 11953 1 13 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.006 -0.386 25153 11954 1 13 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.867 -0.888 25153 11955 1 13 . 1 1 132 132 VAL H H 132 6.697 6.697 7.658 -0.961 25153 11956 1 13 . 1 1 133 133 ILE N N 133 119.940 119.940 117.410 2.530 25153 11957 1 13 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.528 -0.148 25153 11958 1 13 . 1 1 133 133 ILE C C 133 175.440 175.440 175.255 0.185 25153 11959 1 13 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.004 1.446 25153 11960 1 13 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.036 2.064 25153 11961 1 13 . 1 1 133 133 ILE H H 133 8.756 8.756 8.765 -0.009 25153 11962 1 13 . 1 1 134 134 ALA N N 134 122.632 122.632 123.892 -1.260 25153 11963 1 13 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.881 0.079 25153 11964 1 13 . 1 1 134 134 ALA C C 134 178.312 178.312 177.216 1.096 25153 11965 1 13 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.579 -1.499 25153 11966 1 13 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.209 -0.373 25153 11967 1 13 . 1 1 134 134 ALA H H 134 8.523 8.523 8.466 0.057 25153 11968 1 13 . 1 1 135 135 ASP N N 135 117.366 117.366 122.696 -5.330 25153 11969 1 13 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.662 -0.410 25153 11970 1 13 . 1 1 135 135 ASP C C 135 176.387 176.387 176.642 -0.255 25153 11971 1 13 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.360 1.850 25153 11972 1 13 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.241 -1.541 25153 11973 1 13 . 1 1 136 136 GLY N N 136 104.310 104.310 108.058 -3.748 25153 11974 1 13 . 1 1 136 136 GLY C C 136 174.922 174.922 174.959 -0.037 25153 11975 1 13 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.388 -0.288 25153 11976 1 13 . 1 1 136 136 GLY H H 136 7.610 7.610 8.336 -0.726 25153 11977 1 13 . 1 1 137 137 GLN N N 137 118.784 118.784 117.845 0.939 25153 11978 1 13 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.447 -0.392 25153 11979 1 13 . 1 1 137 137 GLN C C 137 176.390 176.390 175.490 0.900 25153 11980 1 13 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.855 1.785 25153 11981 1 13 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.232 -0.002 25153 11982 1 13 . 1 1 137 137 GLN H H 137 7.870 7.870 7.863 0.007 25153 11983 1 13 . 1 1 138 138 LEU N N 138 118.040 118.040 116.034 2.006 25153 11984 1 13 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.060 -0.073 25153 11985 1 13 . 1 1 138 138 LEU C C 138 175.913 175.913 175.251 0.662 25153 11986 1 13 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.179 0.421 25153 11987 1 13 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.899 1.501 25153 11988 1 13 . 1 1 138 138 LEU H H 138 7.356 7.356 7.228 0.128 25153 11989 1 13 . 1 1 139 139 PHE N N 139 119.060 119.060 119.239 -0.179 25153 11990 1 13 . 1 1 139 139 PHE HA H 139 5.310 5.310 5.056 0.254 25153 11991 1 13 . 1 1 139 139 PHE C C 139 178.780 178.780 177.851 0.929 25153 11992 1 13 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.885 -1.035 25153 11993 1 13 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.785 3.675 25153 11994 1 13 . 1 1 139 139 PHE H H 139 10.094 10.094 9.035 1.059 25153 11995 1 13 . 1 1 140 140 VAL N N 140 109.690 109.690 117.499 -7.809 25153 11996 1 13 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.913 -0.432 25153 11997 1 13 . 1 1 140 140 VAL C C 140 172.790 172.790 175.586 -2.796 25153 11998 1 13 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.380 -1.379 25153 11999 1 13 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.684 -1.134 25153 12000 1 13 . 1 1 140 140 VAL H H 140 7.470 7.470 8.288 -0.818 25153 12001 1 13 . 1 1 141 141 GLY N N 141 107.060 107.060 105.141 1.919 25153 12002 1 13 . 1 1 141 141 GLY C C 141 171.513 171.513 172.632 -1.119 25153 12003 1 13 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.365 1.065 25153 12004 1 13 . 1 1 141 141 GLY H H 141 7.137 7.137 7.390 -0.253 25153 12005 1 13 . 1 1 142 142 LEU N N 142 117.863 117.863 120.696 -2.833 25153 12006 1 13 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.131 -1.156 25153 12007 1 13 . 1 1 142 142 LEU C C 142 173.640 173.640 175.191 -1.551 25153 12008 1 13 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.794 1.126 25153 12009 1 13 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.139 -4.589 25153 12010 1 13 . 1 1 142 142 LEU H H 142 7.517 7.517 7.773 -0.256 25153 12011 1 13 . 1 1 143 143 ALA N N 143 126.990 126.990 129.064 -2.074 25153 12012 1 13 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.306 -0.029 25153 12013 1 13 . 1 1 143 143 ALA C C 143 175.730 175.730 176.145 -0.415 25153 12014 1 13 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.328 -0.888 25153 12015 1 13 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.216 4.094 25153 12016 1 13 . 1 1 143 143 ALA H H 143 5.186 5.186 8.298 -3.112 25153 12017 1 13 . 1 1 144 144 LEU N N 144 125.477 125.477 124.492 0.985 25153 12018 1 13 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.876 -0.096 25153 12019 1 13 . 1 1 144 144 LEU C C 144 174.473 174.473 175.729 -1.256 25153 12020 1 13 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.715 -0.475 25153 12021 1 13 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.172 0.128 25153 12022 1 13 . 1 1 144 144 LEU H H 144 8.758 8.758 8.147 0.611 25153 12023 1 13 . 1 1 145 145 ASP N N 145 118.915 118.915 120.852 -1.937 25153 12024 1 13 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.295 0.236 25153 12025 1 13 . 1 1 145 145 ASP C C 145 176.470 176.470 175.785 0.685 25153 12026 1 13 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.602 0.028 25153 12027 1 13 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.658 -0.658 25153 12028 1 13 . 1 1 146 146 GLU N N 146 124.813 124.813 124.910 -0.097 25153 12029 1 13 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.667 -0.291 25153 12030 1 13 . 1 1 146 146 GLU C C 146 177.290 177.290 175.800 1.490 25153 12031 1 13 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.468 0.652 25153 12032 1 13 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.604 0.546 25153 12033 1 13 . 1 1 147 147 THR N N 147 118.328 118.328 114.077 4.251 25153 12034 1 13 . 1 1 147 147 THR HA H 147 4.200 4.200 4.292 -0.092 25153 12035 1 13 . 1 1 147 147 THR C C 147 175.683 175.683 175.146 0.537 25153 12036 1 13 . 1 1 147 147 THR CA C 147 66.250 66.250 62.944 3.306 25153 12037 1 13 . 1 1 147 147 THR CB C 147 69.600 69.600 70.118 -0.518 25153 12038 1 13 . 1 1 147 147 THR H H 147 8.562 8.562 8.787 -0.225 25153 12039 1 13 . 1 1 148 148 ASN N N 148 115.550 115.550 119.519 -3.969 25153 12040 1 13 . 1 1 148 148 ASN HA H 148 4.987 4.987 5.079 -0.092 25153 12041 1 13 . 1 1 148 148 ASN C C 148 175.870 175.870 176.855 -0.985 25153 12042 1 13 . 1 1 148 148 ASN CA C 148 53.700 53.700 53.856 -0.156 25153 12043 1 13 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.422 2.458 25153 12044 1 13 . 1 1 148 148 ASN H H 148 9.118 9.118 9.160 -0.042 25153 12045 1 13 . 1 1 149 149 GLN N N 149 117.400 117.400 119.202 -1.802 25153 12046 1 13 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.419 0.424 25153 12047 1 13 . 1 1 149 149 GLN C C 149 177.780 177.780 176.820 0.960 25153 12048 1 13 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.018 -2.118 25153 12049 1 13 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.270 1.030 25153 12050 1 13 . 1 1 149 149 GLN H H 149 7.555 7.555 8.969 -1.414 25153 12051 1 13 . 1 1 150 150 TYR N N 150 120.674 120.674 119.061 1.613 25153 12052 1 13 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.326 0.202 25153 12053 1 13 . 1 1 150 150 TYR C C 150 177.830 177.830 175.914 1.916 25153 12054 1 13 . 1 1 150 150 TYR CA C 150 58.487 58.487 59.224 -0.737 25153 12055 1 13 . 1 1 150 150 TYR CB C 150 36.600 36.600 37.127 -0.527 25153 12056 1 13 . 1 1 150 150 TYR H H 150 6.983 6.983 8.169 -1.186 25153 12057 1 13 . 1 1 151 151 ASP N N 151 120.810 120.810 119.195 1.615 25153 12058 1 13 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.042 0.473 25153 12059 1 13 . 1 1 151 151 ASP C C 151 176.400 176.400 176.921 -0.521 25153 12060 1 13 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.497 -0.097 25153 12061 1 13 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.050 -1.970 25153 12062 1 13 . 1 1 152 152 LEU N N 152 118.083 118.083 113.540 4.543 25153 12063 1 13 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.684 -0.008 25153 12064 1 13 . 1 1 152 152 LEU C C 152 178.470 178.470 178.086 0.384 25153 12065 1 13 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.426 -0.826 25153 12066 1 13 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.346 -0.747 25153 12067 1 13 . 1 1 152 152 LEU H H 152 7.453 7.453 7.544 -0.091 25153 12068 1 13 . 1 1 153 153 SER N N 153 116.407 116.407 118.106 -1.699 25153 12069 1 13 . 1 1 153 153 SER HA H 153 3.960 3.960 4.027 -0.067 25153 12070 1 13 . 1 1 153 153 SER C C 153 174.590 174.590 175.827 -1.237 25153 12071 1 13 . 1 1 153 153 SER CA C 153 63.400 63.400 62.108 1.292 25153 12072 1 13 . 1 1 153 153 SER CB C 153 63.100 63.100 62.626 0.474 25153 12073 1 13 . 1 1 153 153 SER H H 153 7.360 7.360 8.437 -1.077 25153 12074 1 13 . 1 1 154 154 ASP N N 154 121.960 121.960 121.733 0.227 25153 12075 1 13 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.299 0.011 25153 12076 1 13 . 1 1 154 154 ASP C C 154 178.640 178.640 177.902 0.738 25153 12077 1 13 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.228 1.772 25153 12078 1 13 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.887 -1.317 25153 12079 1 13 . 1 1 155 155 GLU N N 155 121.310 121.310 119.005 2.305 25153 12080 1 13 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.157 0.028 25153 12081 1 13 . 1 1 155 155 GLU C C 155 179.600 179.600 178.769 0.831 25153 12082 1 13 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.759 0.691 25153 12083 1 13 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.837 -0.437 25153 12084 1 13 . 1 1 156 156 ARG N N 156 121.394 121.394 120.589 0.805 25153 12085 1 13 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.255 0.045 25153 12086 1 13 . 1 1 156 156 ARG C C 156 177.330 177.330 179.027 -1.697 25153 12087 1 13 . 1 1 156 156 ARG CA C 156 60.460 60.460 57.691 2.769 25153 12088 1 13 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.482 1.278 25153 12089 1 13 . 1 1 157 157 ILE N N 157 118.390 118.390 120.717 -2.327 25153 12090 1 13 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.704 -0.270 25153 12091 1 13 . 1 1 157 157 ILE C C 157 178.814 178.814 177.629 1.185 25153 12092 1 13 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.706 0.988 25153 12093 1 13 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.749 1.104 25153 12094 1 13 . 1 1 157 157 ILE H H 157 8.966 8.966 8.321 0.645 25153 12095 1 13 . 1 1 158 158 GLN N N 158 120.060 120.060 119.121 0.939 25153 12096 1 13 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.893 0.063 25153 12097 1 13 . 1 1 158 158 GLN C C 158 178.843 178.843 178.929 -0.086 25153 12098 1 13 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.541 1.058 25153 12099 1 13 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.555 -0.165 25153 12100 1 13 . 1 1 158 158 GLN H H 158 8.394 8.394 7.873 0.521 25153 12101 1 13 . 1 1 159 159 SER N N 159 115.613 115.613 115.292 0.321 25153 12102 1 13 . 1 1 159 159 SER HA H 159 4.455 4.455 4.484 -0.029 25153 12103 1 13 . 1 1 159 159 SER C C 159 177.330 177.330 176.551 0.779 25153 12104 1 13 . 1 1 159 159 SER CA C 159 62.400 62.400 61.463 0.937 25153 12105 1 13 . 1 1 159 159 SER CB C 159 63.760 63.760 63.504 0.256 25153 12106 1 13 . 1 1 159 159 SER H H 159 8.460 8.460 8.439 0.021 25153 12107 1 13 . 1 1 160 160 TRP N N 160 126.820 126.820 124.847 1.973 25153 12108 1 13 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.053 0.412 25153 12109 1 13 . 1 1 160 160 TRP C C 160 178.050 178.050 177.659 0.391 25153 12110 1 13 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.391 1.309 25153 12111 1 13 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.149 0.211 25153 12112 1 13 . 1 1 160 160 TRP H H 160 9.318 9.318 7.675 1.643 25153 12113 1 13 . 1 1 161 161 CYS N N 161 116.750 116.750 118.088 -1.338 25153 12114 1 13 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.733 0.150 25153 12115 1 13 . 1 1 161 161 CYS C C 161 176.270 176.270 176.732 -0.462 25153 12116 1 13 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.149 1.211 25153 12117 1 13 . 1 1 161 161 CYS CB C 161 27.880 27.880 27.014 0.866 25153 12118 1 13 . 1 1 161 161 CYS H H 161 8.950 8.950 8.898 0.052 25153 12119 1 13 . 1 1 162 162 GLU N N 162 118.096 118.096 120.387 -2.291 25153 12120 1 13 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.023 -0.093 25153 12121 1 13 . 1 1 162 162 GLU C C 162 178.680 178.680 177.436 1.244 25153 12122 1 13 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.349 0.381 25153 12123 1 13 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.419 0.011 25153 12124 1 13 . 1 1 163 163 GLN N N 163 120.790 120.790 117.944 2.846 25153 12125 1 13 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.098 0.079 25153 12126 1 13 . 1 1 163 163 GLN C C 163 179.690 179.690 178.191 1.499 25153 12127 1 13 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.806 1.734 25153 12128 1 13 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.040 -0.040 25153 12129 1 13 . 1 1 163 163 GLN H H 163 8.205 8.205 7.493 0.712 25153 12130 1 13 . 1 1 164 164 ILE N N 164 114.860 114.860 118.923 -4.063 25153 12131 1 13 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.843 0.200 25153 12132 1 13 . 1 1 164 164 ILE C C 164 178.680 178.680 177.394 1.286 25153 12133 1 13 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.007 2.203 25153 12134 1 13 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.590 0.110 25153 12135 1 13 . 1 1 164 164 ILE H H 164 9.005 9.005 8.010 0.995 25153 12136 1 13 . 1 1 165 165 LEU N N 165 123.900 123.900 116.851 7.049 25153 12137 1 13 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.091 0.059 25153 12138 1 13 . 1 1 165 165 LEU C C 165 180.520 180.520 178.246 2.274 25153 12139 1 13 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.630 0.670 25153 12140 1 13 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.118 -0.068 25153 12141 1 13 . 1 1 165 165 LEU H H 165 7.825 7.825 7.947 -0.122 25153 12142 1 13 . 1 1 166 166 ASN N N 166 120.112 120.112 118.589 1.523 25153 12143 1 13 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.490 0.093 25153 12144 1 13 . 1 1 166 166 ASN C C 166 178.440 178.440 177.120 1.320 25153 12145 1 13 . 1 1 166 166 ASN CA C 166 56.420 56.420 56.105 0.315 25153 12146 1 13 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.033 -0.613 25153 12147 1 13 . 1 1 166 166 ASN H H 166 7.760 7.760 8.098 -0.338 25153 12148 1 13 . 1 1 167 167 GLU N N 167 121.370 121.370 121.437 -0.067 25153 12149 1 13 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.974 0.129 25153 12150 1 13 . 1 1 167 167 GLU C C 167 180.332 180.332 179.231 1.101 25153 12151 1 13 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.597 0.553 25153 12152 1 13 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.606 1.414 25153 12153 1 13 . 1 1 168 168 MET N N 168 118.532 118.532 117.277 1.255 25153 12154 1 13 . 1 1 168 168 MET HA H 168 4.015 4.015 4.367 -0.352 25153 12155 1 13 . 1 1 168 168 MET C C 168 176.600 176.600 177.718 -1.118 25153 12156 1 13 . 1 1 168 168 MET CA C 168 59.300 59.300 58.892 0.409 25153 12157 1 13 . 1 1 168 168 MET CB C 168 33.400 33.400 33.032 0.368 25153 12158 1 13 . 1 1 168 168 MET H H 168 8.718 8.718 8.193 0.525 25153 12159 1 13 . 1 1 169 169 ALA N N 169 121.922 121.922 122.458 -0.536 25153 12160 1 13 . 1 1 169 169 ALA HA H 169 4.174 4.174 2.042 2.132 25153 12161 1 13 . 1 1 169 169 ALA C C 169 179.410 179.410 179.287 0.123 25153 12162 1 13 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.415 -0.015 25153 12163 1 13 . 1 1 169 169 ALA CB C 169 18.410 18.410 17.690 0.720 25153 12164 1 13 . 1 1 169 169 ALA H H 169 7.448 7.448 7.376 0.072 25153 12165 1 13 . 1 1 170 170 GLU N N 170 117.300 117.300 115.943 1.357 25153 12166 1 13 . 1 1 170 170 GLU HA H 170 4.095 4.095 3.982 0.113 25153 12167 1 13 . 1 1 170 170 GLU C C 170 177.470 177.470 179.148 -1.678 25153 12168 1 13 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.711 -0.761 25153 12169 1 13 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.389 0.386 25153 12170 1 13 . 1 1 171 171 HIS N N 171 117.944 117.944 120.174 -2.230 25153 12171 1 13 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.363 0.137 25153 12172 1 13 . 1 1 171 171 HIS C C 171 175.120 175.120 176.931 -1.811 25153 12173 1 13 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.062 -1.862 25153 12174 1 13 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.888 0.712 25153 12175 1 13 . 1 1 171 171 HIS H H 171 7.788 7.788 7.288 0.500 25153 12176 1 13 . 1 1 172 172 TYR N N 172 120.040 120.040 116.154 3.886 25153 12177 1 13 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.372 0.221 25153 12178 1 13 . 1 1 172 172 TYR C C 172 174.612 174.612 176.486 -1.874 25153 12179 1 13 . 1 1 172 172 TYR CA C 172 57.980 57.980 57.818 0.162 25153 12180 1 13 . 1 1 172 172 TYR CB C 172 38.980 38.980 37.384 1.596 25153 12181 1 13 . 1 1 172 172 TYR H H 172 7.820 7.820 7.760 0.060 25153 12182 1 14 . 1 1 2 2 ASN N N 2 123.320 123.320 119.771 3.549 25153 12183 1 14 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.163 0.045 25153 12184 1 14 . 1 1 2 2 ASN C C 2 174.590 174.590 174.579 0.011 25153 12185 1 14 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.770 0.230 25153 12186 1 14 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.290 -0.320 25153 12187 1 14 . 1 1 2 2 ASN H H 2 9.428 9.428 8.689 0.739 25153 12188 1 14 . 1 1 3 3 MET N N 3 120.920 120.920 119.191 1.729 25153 12189 1 14 . 1 1 3 3 MET HA H 3 5.530 5.530 5.351 0.179 25153 12190 1 14 . 1 1 3 3 MET C C 3 174.400 174.400 175.206 -0.806 25153 12191 1 14 . 1 1 3 3 MET CA C 3 54.643 54.643 54.211 0.432 25153 12192 1 14 . 1 1 3 3 MET CB C 3 34.637 34.637 37.221 -2.584 25153 12193 1 14 . 1 1 3 3 MET H H 3 8.751 8.751 9.184 -0.433 25153 12194 1 14 . 1 1 4 4 GLY N N 4 115.542 115.542 109.334 6.208 25153 12195 1 14 . 1 1 4 4 GLY C C 4 170.413 170.413 172.210 -1.797 25153 12196 1 14 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.892 -0.790 25153 12197 1 14 . 1 1 4 4 GLY H H 4 8.927 8.927 8.991 -0.064 25153 12198 1 14 . 1 1 5 5 LEU N N 5 131.030 131.030 128.456 2.574 25153 12199 1 14 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.167 1.235 25153 12200 1 14 . 1 1 5 5 LEU C C 5 175.952 175.952 174.651 1.301 25153 12201 1 14 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.373 1.077 25153 12202 1 14 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.277 3.315 25153 12203 1 14 . 1 1 5 5 LEU H H 5 8.928 8.928 8.671 0.257 25153 12204 1 14 . 1 1 6 6 PHE N N 6 125.790 125.790 126.440 -0.650 25153 12205 1 14 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.692 0.048 25153 12206 1 14 . 1 1 6 6 PHE C C 6 174.300 174.300 176.057 -1.757 25153 12207 1 14 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.723 -1.403 25153 12208 1 14 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.133 0.097 25153 12209 1 14 . 1 1 6 6 PHE H H 6 9.237 9.237 9.435 -0.198 25153 12210 1 14 . 1 1 7 7 TYR N N 7 117.289 117.289 116.778 0.511 25153 12211 1 14 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.853 0.112 25153 12212 1 14 . 1 1 7 7 TYR C C 7 171.262 171.262 173.337 -2.075 25153 12213 1 14 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.475 -1.075 25153 12214 1 14 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.929 0.311 25153 12215 1 14 . 1 1 7 7 TYR H H 7 8.125 8.125 8.330 -0.205 25153 12216 1 14 . 1 1 8 8 GLY N N 8 107.420 107.420 107.308 0.112 25153 12217 1 14 . 1 1 8 8 GLY C C 8 172.000 172.000 172.735 -0.735 25153 12218 1 14 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.977 -1.033 25153 12219 1 14 . 1 1 8 8 GLY H H 8 7.031 7.031 8.567 -1.536 25153 12220 1 14 . 1 1 9 9 SER N N 9 118.150 118.150 118.931 -0.781 25153 12221 1 14 . 1 1 9 9 SER HA H 9 5.200 5.200 5.038 0.162 25153 12222 1 14 . 1 1 9 9 SER C C 9 175.000 175.000 174.756 0.244 25153 12223 1 14 . 1 1 9 9 SER CA C 9 57.570 57.570 56.855 0.715 25153 12224 1 14 . 1 1 9 9 SER CB C 9 66.700 66.700 66.064 0.636 25153 12225 1 14 . 1 1 9 9 SER H H 9 9.604 9.604 8.066 1.538 25153 12226 1 14 . 1 1 10 10 SER N N 10 131.193 131.193 120.329 10.864 25153 12227 1 14 . 1 1 10 10 SER HA H 10 4.775 4.775 4.411 0.364 25153 12228 1 14 . 1 1 10 10 SER C C 10 175.730 175.730 175.375 0.355 25153 12229 1 14 . 1 1 10 10 SER CA C 10 61.750 61.750 60.338 1.412 25153 12230 1 14 . 1 1 10 10 SER CB C 10 64.400 64.400 63.761 0.639 25153 12231 1 14 . 1 1 10 10 SER H H 10 11.636 11.636 8.944 2.692 25153 12232 1 14 . 1 1 11 11 THR N N 11 115.848 115.848 114.182 1.666 25153 12233 1 14 . 1 1 11 11 THR HA H 11 4.770 4.770 4.249 0.521 25153 12234 1 14 . 1 1 11 11 THR C C 11 173.700 173.700 174.577 -0.877 25153 12235 1 14 . 1 1 11 11 THR CA C 11 60.700 60.700 62.200 -1.500 25153 12236 1 14 . 1 1 11 11 THR CB C 11 67.430 67.430 69.683 -2.253 25153 12237 1 14 . 1 1 11 11 THR H H 11 9.550 9.550 8.369 1.181 25153 12238 1 14 . 1 1 12 12 CYS N N 12 109.780 109.780 114.992 -5.212 25153 12239 1 14 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.807 -0.737 25153 12240 1 14 . 1 1 12 12 CYS C C 12 176.220 176.220 175.416 0.804 25153 12241 1 14 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.551 5.048 25153 12242 1 14 . 1 1 12 12 CYS CB C 12 26.400 26.400 28.201 -1.800 25153 12243 1 14 . 1 1 12 12 CYS H H 12 7.437 7.437 7.387 0.050 25153 12244 1 14 . 1 1 13 13 TYR N N 13 127.830 127.830 122.622 5.208 25153 12245 1 14 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.285 -0.182 25153 12246 1 14 . 1 1 13 13 TYR C C 13 180.880 180.880 177.998 2.882 25153 12247 1 14 . 1 1 13 13 TYR CA C 13 65.100 65.100 60.092 5.008 25153 12248 1 14 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.574 -0.739 25153 12249 1 14 . 1 1 13 13 TYR H H 13 10.886 10.886 7.320 3.566 25153 12250 1 14 . 1 1 14 14 THR N N 14 124.428 124.428 113.763 10.665 25153 12251 1 14 . 1 1 14 14 THR HA H 14 4.160 4.160 4.145 0.015 25153 12252 1 14 . 1 1 14 14 THR C C 14 177.760 177.760 176.343 1.417 25153 12253 1 14 . 1 1 14 14 THR CA C 14 67.823 67.823 66.505 1.318 25153 12254 1 14 . 1 1 14 14 THR CB C 14 68.040 68.040 68.250 -0.210 25153 12255 1 14 . 1 1 14 14 THR H H 14 11.405 11.405 8.613 2.792 25153 12256 1 14 . 1 1 15 15 GLU N N 15 123.050 123.050 123.235 -0.185 25153 12257 1 14 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.360 -0.470 25153 12258 1 14 . 1 1 15 15 GLU C C 15 176.392 176.392 178.302 -1.910 25153 12259 1 14 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.679 -0.479 25153 12260 1 14 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.374 1.076 25153 12261 1 14 . 1 1 16 16 MET N N 16 120.173 120.173 118.515 1.658 25153 12262 1 14 . 1 1 16 16 MET HA H 16 4.050 4.050 4.305 -0.255 25153 12263 1 14 . 1 1 16 16 MET C C 16 179.940 179.940 178.600 1.340 25153 12264 1 14 . 1 1 16 16 MET CA C 16 59.240 59.240 59.217 0.023 25153 12265 1 14 . 1 1 16 16 MET CB C 16 32.970 32.970 32.818 0.152 25153 12266 1 14 . 1 1 16 16 MET H H 16 8.469 8.469 8.595 -0.126 25153 12267 1 14 . 1 1 17 17 ALA N N 17 121.930 121.930 121.754 0.176 25153 12268 1 14 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.832 0.004 25153 12269 1 14 . 1 1 17 17 ALA C C 17 177.900 177.900 178.593 -0.693 25153 12270 1 14 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.136 0.063 25153 12271 1 14 . 1 1 17 17 ALA CB C 17 18.000 18.000 17.993 0.007 25153 12272 1 14 . 1 1 17 17 ALA H H 17 7.880 7.880 7.838 0.042 25153 12273 1 14 . 1 1 18 18 ALA N N 18 121.477 121.477 121.344 0.133 25153 12274 1 14 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.703 0.034 25153 12275 1 14 . 1 1 18 18 ALA C C 18 179.380 179.380 179.395 -0.015 25153 12276 1 14 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.099 -0.099 25153 12277 1 14 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.723 1.107 25153 12278 1 14 . 1 1 18 18 ALA H H 18 7.374 7.374 7.577 -0.203 25153 12279 1 14 . 1 1 19 19 GLU N N 19 116.650 116.650 118.106 -1.456 25153 12280 1 14 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.832 -0.216 25153 12281 1 14 . 1 1 19 19 GLU C C 19 178.479 178.479 179.291 -0.812 25153 12282 1 14 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.531 0.199 25153 12283 1 14 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.391 -0.091 25153 12284 1 14 . 1 1 20 20 LYS N N 20 119.470 119.470 119.529 -0.059 25153 12285 1 14 . 1 1 20 20 LYS HA H 20 4.050 4.050 3.984 0.066 25153 12286 1 14 . 1 1 20 20 LYS C C 20 179.116 179.116 179.076 0.040 25153 12287 1 14 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.773 0.057 25153 12288 1 14 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.444 0.406 25153 12289 1 14 . 1 1 21 21 ILE N N 21 121.030 121.030 120.661 0.369 25153 12290 1 14 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.701 -0.311 25153 12291 1 14 . 1 1 21 21 ILE C C 21 177.580 177.580 178.183 -0.603 25153 12292 1 14 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.744 0.076 25153 12293 1 14 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.922 0.426 25153 12294 1 14 . 1 1 21 21 ILE H H 21 8.100 8.100 8.588 -0.488 25153 12295 1 14 . 1 1 22 22 ARG N N 22 119.720 119.720 119.550 0.170 25153 12296 1 14 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.846 -0.291 25153 12297 1 14 . 1 1 22 22 ARG C C 22 177.320 177.320 178.135 -0.815 25153 12298 1 14 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.734 -0.014 25153 12299 1 14 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.705 -0.773 25153 12300 1 14 . 1 1 23 23 ASP N N 23 118.730 118.730 119.213 -0.483 25153 12301 1 14 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.412 -0.049 25153 12302 1 14 . 1 1 23 23 ASP C C 23 178.330 178.330 178.775 -0.445 25153 12303 1 14 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.370 -0.420 25153 12304 1 14 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.864 -0.624 25153 12305 1 14 . 1 1 24 24 ILE N N 24 121.090 121.090 119.243 1.847 25153 12306 1 14 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.785 0.011 25153 12307 1 14 . 1 1 24 24 ILE C C 24 178.250 178.250 177.905 0.345 25153 12308 1 14 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.956 -0.806 25153 12309 1 14 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.373 0.107 25153 12310 1 14 . 1 1 24 24 ILE H H 24 7.910 7.910 8.111 -0.201 25153 12311 1 14 . 1 1 25 25 ILE N N 25 121.406 121.406 117.350 4.056 25153 12312 1 14 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.869 -0.223 25153 12313 1 14 . 1 1 25 25 ILE C C 25 176.800 176.800 176.795 0.005 25153 12314 1 14 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.068 2.632 25153 12315 1 14 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.910 -0.720 25153 12316 1 14 . 1 1 25 25 ILE H H 25 8.476 8.476 8.104 0.372 25153 12317 1 14 . 1 1 26 26 GLY N N 26 108.900 108.900 105.130 3.770 25153 12318 1 14 . 1 1 26 26 GLY C C 26 173.710 173.710 172.281 1.429 25153 12319 1 14 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.677 -0.347 25153 12320 1 14 . 1 1 26 26 GLY H H 26 8.016 8.016 7.793 0.223 25153 12321 1 14 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.679 -0.341 25153 12322 1 14 . 1 1 27 27 PRO C C 27 177.200 177.200 177.404 -0.204 25153 12323 1 14 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.574 1.113 25153 12324 1 14 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.110 0.090 25153 12325 1 14 . 1 1 28 28 GLU N N 28 116.295 116.295 118.225 -1.930 25153 12326 1 14 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.187 0.083 25153 12327 1 14 . 1 1 28 28 GLU C C 28 176.980 176.980 177.348 -0.368 25153 12328 1 14 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.599 -0.859 25153 12329 1 14 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.453 -0.783 25153 12330 1 14 . 1 1 29 29 LEU N N 29 120.250 120.250 111.891 8.359 25153 12331 1 14 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.677 -0.041 25153 12332 1 14 . 1 1 29 29 LEU C C 29 175.770 175.770 175.690 0.080 25153 12333 1 14 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.306 0.494 25153 12334 1 14 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.906 1.194 25153 12335 1 14 . 1 1 29 29 LEU H H 29 7.940 7.940 7.581 0.359 25153 12336 1 14 . 1 1 30 30 VAL N N 30 118.693 118.693 121.623 -2.930 25153 12337 1 14 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.973 -0.325 25153 12338 1 14 . 1 1 30 30 VAL C C 30 174.347 174.347 176.010 -1.663 25153 12339 1 14 . 1 1 30 30 VAL CA C 30 60.868 60.868 62.425 -1.557 25153 12340 1 14 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.995 1.585 25153 12341 1 14 . 1 1 30 30 VAL H H 30 7.434 7.434 8.048 -0.614 25153 12342 1 14 . 1 1 31 31 THR N N 31 123.800 123.800 121.578 2.222 25153 12343 1 14 . 1 1 31 31 THR HA H 31 4.362 4.362 4.569 -0.207 25153 12344 1 14 . 1 1 31 31 THR C C 31 172.964 172.964 173.276 -0.312 25153 12345 1 14 . 1 1 31 31 THR CA C 31 61.720 61.720 60.939 0.781 25153 12346 1 14 . 1 1 31 31 THR CB C 31 70.485 70.485 70.952 -0.467 25153 12347 1 14 . 1 1 31 31 THR H H 31 7.844 7.844 8.341 -0.497 25153 12348 1 14 . 1 1 32 32 LEU N N 32 127.800 127.800 126.844 0.956 25153 12349 1 14 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.566 0.118 25153 12350 1 14 . 1 1 32 32 LEU C C 32 176.600 176.600 176.512 0.088 25153 12351 1 14 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.114 0.041 25153 12352 1 14 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.715 1.135 25153 12353 1 14 . 1 1 32 32 LEU H H 32 8.660 8.660 8.607 0.053 25153 12354 1 14 . 1 1 33 33 HIS N N 33 119.670 119.670 120.014 -0.344 25153 12355 1 14 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.794 -0.394 25153 12356 1 14 . 1 1 33 33 HIS C C 33 171.667 171.667 173.203 -1.536 25153 12357 1 14 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.958 0.242 25153 12358 1 14 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.456 0.744 25153 12359 1 14 . 1 1 33 33 HIS H H 33 9.060 9.060 8.824 0.236 25153 12360 1 14 . 1 1 34 34 ASN N N 34 124.068 124.068 123.132 0.936 25153 12361 1 14 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.003 -0.569 25153 12362 1 14 . 1 1 34 34 ASN C C 34 178.000 178.000 176.092 1.908 25153 12363 1 14 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.957 -0.528 25153 12364 1 14 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.039 -0.479 25153 12365 1 14 . 1 1 34 34 ASN H H 34 8.780 8.780 8.148 0.632 25153 12366 1 14 . 1 1 35 35 LEU N N 35 129.040 129.040 126.520 2.520 25153 12367 1 14 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.176 0.139 25153 12368 1 14 . 1 1 35 35 LEU C C 35 177.700 177.700 177.781 -0.081 25153 12369 1 14 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.481 -0.001 25153 12370 1 14 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.807 1.493 25153 12371 1 14 . 1 1 35 35 LEU H H 35 8.821 8.821 8.624 0.197 25153 12372 1 14 . 1 1 36 36 LYS N N 36 121.043 121.043 116.250 4.793 25153 12373 1 14 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.093 -0.213 25153 12374 1 14 . 1 1 36 36 LYS C C 36 176.230 176.230 177.037 -0.807 25153 12375 1 14 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.358 1.062 25153 12376 1 14 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.544 0.726 25153 12377 1 14 . 1 1 37 37 ASP N N 37 114.965 114.965 118.114 -3.149 25153 12378 1 14 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.788 -0.011 25153 12379 1 14 . 1 1 37 37 ASP C C 37 175.440 175.440 175.948 -0.508 25153 12380 1 14 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.577 0.134 25153 12381 1 14 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.481 1.218 25153 12382 1 14 . 1 1 38 38 ASP N N 38 121.650 121.650 121.532 0.118 25153 12383 1 14 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.895 -0.025 25153 12384 1 14 . 1 1 38 38 ASP C C 38 174.852 174.852 175.945 -1.093 25153 12385 1 14 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.487 -1.407 25153 12386 1 14 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.453 -0.343 25153 12387 1 14 . 1 1 39 39 SER N N 39 115.207 115.207 117.911 -2.704 25153 12388 1 14 . 1 1 39 39 SER HA H 39 4.585 4.585 4.708 -0.123 25153 12389 1 14 . 1 1 39 39 SER C C 39 175.040 175.040 174.325 0.715 25153 12390 1 14 . 1 1 39 39 SER CA C 39 54.960 54.960 56.307 -1.347 25153 12391 1 14 . 1 1 39 39 SER CB C 39 64.720 64.720 63.610 1.110 25153 12392 1 14 . 1 1 39 39 SER H H 39 8.351 8.351 8.614 -0.263 25153 12393 1 14 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.220 -0.215 25153 12394 1 14 . 1 1 40 40 PRO C C 40 176.730 176.730 177.825 -1.095 25153 12395 1 14 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.074 -0.174 25153 12396 1 14 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.760 -0.360 25153 12397 1 14 . 1 1 41 41 LYS N N 41 121.150 121.150 119.851 1.299 25153 12398 1 14 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.021 -0.109 25153 12399 1 14 . 1 1 41 41 LYS C C 41 179.600 179.600 178.679 0.921 25153 12400 1 14 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.449 -1.249 25153 12401 1 14 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.636 0.364 25153 12402 1 14 . 1 1 42 42 LEU N N 42 118.103 118.103 116.318 1.785 25153 12403 1 14 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.200 -0.163 25153 12404 1 14 . 1 1 42 42 LEU C C 42 178.760 178.760 178.815 -0.055 25153 12405 1 14 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.427 -0.247 25153 12406 1 14 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.538 1.435 25153 12407 1 14 . 1 1 42 42 LEU H H 42 7.600 7.600 7.502 0.098 25153 12408 1 14 . 1 1 43 43 MET N N 43 118.917 118.917 116.991 1.926 25153 12409 1 14 . 1 1 43 43 MET HA H 43 3.750 3.750 4.367 -0.617 25153 12410 1 14 . 1 1 43 43 MET C C 43 177.680 177.680 176.820 0.860 25153 12411 1 14 . 1 1 43 43 MET CA C 43 59.730 59.730 58.030 1.700 25153 12412 1 14 . 1 1 43 43 MET CB C 43 32.700 32.700 31.758 0.942 25153 12413 1 14 . 1 1 43 43 MET H H 43 8.202 8.202 8.018 0.184 25153 12414 1 14 . 1 1 44 44 GLU N N 44 110.924 110.924 117.531 -6.607 25153 12415 1 14 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.257 -0.517 25153 12416 1 14 . 1 1 44 44 GLU C C 44 178.130 178.130 179.090 -0.960 25153 12417 1 14 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.179 1.221 25153 12418 1 14 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.952 -0.402 25153 12419 1 14 . 1 1 45 45 GLN N N 45 115.756 115.756 118.689 -2.933 25153 12420 1 14 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.062 0.121 25153 12421 1 14 . 1 1 45 45 GLN C C 45 175.414 175.414 177.215 -1.801 25153 12422 1 14 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.540 -1.360 25153 12423 1 14 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.191 -0.591 25153 12424 1 14 . 1 1 45 45 GLN H H 45 7.516 7.516 7.580 -0.064 25153 12425 1 14 . 1 1 46 46 TYR N N 46 117.860 117.860 119.041 -1.181 25153 12426 1 14 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.339 0.324 25153 12427 1 14 . 1 1 46 46 TYR C C 46 175.500 175.500 177.229 -1.729 25153 12428 1 14 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.844 -1.358 25153 12429 1 14 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.191 3.280 25153 12430 1 14 . 1 1 46 46 TYR H H 46 6.996 6.996 7.272 -0.276 25153 12431 1 14 . 1 1 47 47 ASP N N 47 121.683 121.683 121.938 -0.255 25153 12432 1 14 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.636 0.064 25153 12433 1 14 . 1 1 47 47 ASP C C 47 175.610 175.610 175.237 0.373 25153 12434 1 14 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.415 -0.715 25153 12435 1 14 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.988 1.012 25153 12436 1 14 . 1 1 48 48 VAL N N 48 118.628 118.628 116.167 2.461 25153 12437 1 14 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.762 0.272 25153 12438 1 14 . 1 1 48 48 VAL C C 48 174.190 174.190 174.034 0.156 25153 12439 1 14 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.452 -1.262 25153 12440 1 14 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.974 0.126 25153 12441 1 14 . 1 1 48 48 VAL H H 48 7.628 7.628 7.386 0.242 25153 12442 1 14 . 1 1 49 49 LEU N N 49 128.190 128.190 123.570 4.620 25153 12443 1 14 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.440 0.163 25153 12444 1 14 . 1 1 49 49 LEU C C 49 174.880 174.880 175.560 -0.680 25153 12445 1 14 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.484 -1.244 25153 12446 1 14 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.157 -0.817 25153 12447 1 14 . 1 1 49 49 LEU H H 49 9.407 9.407 9.039 0.368 25153 12448 1 14 . 1 1 50 50 ILE N N 50 124.550 124.550 120.631 3.919 25153 12449 1 14 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.079 0.621 25153 12450 1 14 . 1 1 50 50 ILE C C 50 175.300 175.300 174.589 0.711 25153 12451 1 14 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.894 -1.030 25153 12452 1 14 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.023 -0.773 25153 12453 1 14 . 1 1 50 50 ILE H H 50 9.238 9.238 9.235 0.003 25153 12454 1 14 . 1 1 51 51 LEU N N 51 127.460 127.460 128.009 -0.549 25153 12455 1 14 . 1 1 51 51 LEU HA H 51 6.185 6.185 6.009 0.176 25153 12456 1 14 . 1 1 51 51 LEU C C 51 174.544 174.544 176.112 -1.568 25153 12457 1 14 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.296 -0.476 25153 12458 1 14 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.412 -2.775 25153 12459 1 14 . 1 1 51 51 LEU H H 51 9.228 9.228 9.089 0.139 25153 12460 1 14 . 1 1 52 52 GLY N N 52 107.760 107.760 109.418 -1.658 25153 12461 1 14 . 1 1 52 52 GLY C C 52 174.710 174.710 172.004 2.706 25153 12462 1 14 . 1 1 52 52 GLY CA C 52 43.870 43.870 44.639 -0.769 25153 12463 1 14 . 1 1 52 52 GLY H H 52 8.860 8.860 8.454 0.406 25153 12464 1 14 . 1 1 53 53 ILE N N 53 123.890 123.890 116.709 7.181 25153 12465 1 14 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.914 0.356 25153 12466 1 14 . 1 1 53 53 ILE C C 53 172.630 172.630 173.110 -0.480 25153 12467 1 14 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.845 -0.165 25153 12468 1 14 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.867 3.293 25153 12469 1 14 . 1 1 53 53 ILE H H 53 8.458 8.458 7.879 0.579 25153 12470 1 14 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.907 0.481 25153 12471 1 14 . 1 1 54 54 PRO C C 54 175.000 175.000 176.468 -1.468 25153 12472 1 14 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.528 0.072 25153 12473 1 14 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.600 -0.300 25153 12474 1 14 . 1 1 55 55 THR N N 55 112.754 112.754 120.454 -7.700 25153 12475 1 14 . 1 1 55 55 THR HA H 55 4.452 4.452 4.536 -0.084 25153 12476 1 14 . 1 1 55 55 THR C C 55 172.480 172.480 174.104 -1.624 25153 12477 1 14 . 1 1 55 55 THR CA C 55 62.350 62.350 63.145 -0.795 25153 12478 1 14 . 1 1 55 55 THR CB C 55 70.230 70.230 69.312 0.918 25153 12479 1 14 . 1 1 55 55 THR H H 55 6.523 6.523 8.244 -1.721 25153 12480 1 14 . 1 1 56 56 TRP N N 56 130.044 130.044 127.648 2.396 25153 12481 1 14 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.523 -1.808 25153 12482 1 14 . 1 1 56 56 TRP C C 56 172.890 172.890 175.791 -2.901 25153 12483 1 14 . 1 1 56 56 TRP CA C 56 56.650 56.650 57.330 -0.680 25153 12484 1 14 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.522 2.478 25153 12485 1 14 . 1 1 56 56 TRP H H 56 8.450 8.450 8.361 0.089 25153 12486 1 14 . 1 1 57 57 ASP N N 57 115.275 115.275 120.601 -5.326 25153 12487 1 14 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.034 0.318 25153 12488 1 14 . 1 1 57 57 ASP C C 57 173.660 173.660 175.058 -1.398 25153 12489 1 14 . 1 1 57 57 ASP CA C 57 56.230 56.230 54.939 1.291 25153 12490 1 14 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.749 0.420 25153 12491 1 14 . 1 1 58 58 PHE N N 58 112.840 112.840 116.695 -3.855 25153 12492 1 14 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.646 -0.322 25153 12493 1 14 . 1 1 58 58 PHE C C 58 175.730 175.730 175.254 0.476 25153 12494 1 14 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.349 0.474 25153 12495 1 14 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.688 -1.934 25153 12496 1 14 . 1 1 58 58 PHE H H 58 7.640 7.640 7.781 -0.141 25153 12497 1 14 . 1 1 59 59 GLY N N 59 104.940 104.940 105.084 -0.144 25153 12498 1 14 . 1 1 59 59 GLY C C 59 173.750 173.750 174.966 -1.216 25153 12499 1 14 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.450 0.840 25153 12500 1 14 . 1 1 59 59 GLY H H 59 8.024 8.024 8.641 -0.617 25153 12501 1 14 . 1 1 60 60 GLU N N 60 120.045 120.045 119.651 0.394 25153 12502 1 14 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.428 -0.015 25153 12503 1 14 . 1 1 60 60 GLU C C 60 176.050 176.050 176.161 -0.111 25153 12504 1 14 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.856 -1.236 25153 12505 1 14 . 1 1 60 60 GLU CB C 60 30.610 30.610 30.995 -0.385 25153 12506 1 14 . 1 1 61 61 ILE N N 61 120.790 120.790 121.811 -1.021 25153 12507 1 14 . 1 1 61 61 ILE HA H 61 3.467 3.467 3.958 -0.491 25153 12508 1 14 . 1 1 61 61 ILE C C 61 175.130 175.130 176.226 -1.096 25153 12509 1 14 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.764 -0.216 25153 12510 1 14 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.553 0.296 25153 12511 1 14 . 1 1 61 61 ILE H H 61 8.200 8.200 8.397 -0.197 25153 12512 1 14 . 1 1 62 62 GLN N N 62 124.520 124.520 122.944 1.576 25153 12513 1 14 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.265 -0.309 25153 12514 1 14 . 1 1 62 62 GLN C C 62 177.160 177.160 177.191 -0.031 25153 12515 1 14 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.751 0.859 25153 12516 1 14 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.054 -2.404 25153 12517 1 14 . 1 1 62 62 GLN H H 62 5.667 5.667 8.628 -2.961 25153 12518 1 14 . 1 1 63 63 GLU N N 63 124.570 124.570 126.038 -1.468 25153 12519 1 14 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.283 -0.297 25153 12520 1 14 . 1 1 63 63 GLU C C 63 177.300 177.300 177.533 -0.233 25153 12521 1 14 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.785 1.935 25153 12522 1 14 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.361 0.759 25153 12523 1 14 . 1 1 64 64 ASP N N 64 119.060 119.060 120.083 -1.023 25153 12524 1 14 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.553 0.067 25153 12525 1 14 . 1 1 64 64 ASP C C 64 179.180 179.180 177.930 1.250 25153 12526 1 14 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.245 1.705 25153 12527 1 14 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.907 0.043 25153 12528 1 14 . 1 1 65 65 TRP N N 65 121.070 121.070 121.799 -0.729 25153 12529 1 14 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.463 -0.123 25153 12530 1 14 . 1 1 65 65 TRP C C 65 178.970 178.970 178.358 0.612 25153 12531 1 14 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.853 -0.033 25153 12532 1 14 . 1 1 65 65 TRP CB C 65 30.400 30.400 29.967 0.433 25153 12533 1 14 . 1 1 65 65 TRP H H 65 7.350 7.350 7.950 -0.600 25153 12534 1 14 . 1 1 66 66 GLU N N 66 120.900 120.900 118.177 2.723 25153 12535 1 14 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.869 -0.029 25153 12536 1 14 . 1 1 66 66 GLU C C 66 178.750 178.750 179.086 -0.336 25153 12537 1 14 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.429 0.571 25153 12538 1 14 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.222 -0.362 25153 12539 1 14 . 1 1 67 67 ALA N N 67 119.130 119.130 119.624 -0.494 25153 12540 1 14 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.254 -0.001 25153 12541 1 14 . 1 1 67 67 ALA C C 67 179.410 179.410 179.082 0.328 25153 12542 1 14 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.653 -0.073 25153 12543 1 14 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.919 -0.109 25153 12544 1 14 . 1 1 67 67 ALA H H 67 7.640 7.640 7.607 0.033 25153 12545 1 14 . 1 1 68 68 VAL N N 68 106.845 106.845 112.125 -5.280 25153 12546 1 14 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.495 0.315 25153 12547 1 14 . 1 1 68 68 VAL C C 68 176.750 176.750 176.900 -0.150 25153 12548 1 14 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.648 -3.038 25153 12549 1 14 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.638 -0.018 25153 12550 1 14 . 1 1 68 68 VAL H H 68 7.219 7.219 7.555 -0.336 25153 12551 1 14 . 1 1 69 69 TRP N N 69 127.630 127.630 124.041 3.589 25153 12552 1 14 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.254 -0.016 25153 12553 1 14 . 1 1 69 69 TRP C C 69 178.670 178.670 177.036 1.634 25153 12554 1 14 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.739 -1.519 25153 12555 1 14 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.857 1.773 25153 12556 1 14 . 1 1 69 69 TRP H H 69 7.832 7.832 8.627 -0.795 25153 12557 1 14 . 1 1 70 70 ASP N N 70 114.544 114.544 118.336 -3.792 25153 12558 1 14 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.457 0.065 25153 12559 1 14 . 1 1 70 70 ASP C C 70 178.670 178.670 178.980 -0.310 25153 12560 1 14 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.277 -1.277 25153 12561 1 14 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.974 -1.124 25153 12562 1 14 . 1 1 71 71 GLN N N 71 120.040 120.040 119.466 0.574 25153 12563 1 14 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.126 0.058 25153 12564 1 14 . 1 1 71 71 GLN C C 71 178.910 178.910 178.821 0.089 25153 12565 1 14 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.368 -0.758 25153 12566 1 14 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.867 0.233 25153 12567 1 14 . 1 1 71 71 GLN H H 71 7.995 7.995 7.731 0.264 25153 12568 1 14 . 1 1 72 72 LEU N N 72 117.400 117.400 118.216 -0.816 25153 12569 1 14 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.983 -0.170 25153 12570 1 14 . 1 1 72 72 LEU C C 72 178.650 178.650 178.086 0.564 25153 12571 1 14 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.003 0.197 25153 12572 1 14 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.373 0.037 25153 12573 1 14 . 1 1 72 72 LEU H H 72 7.450 7.450 7.770 -0.320 25153 12574 1 14 . 1 1 73 73 ASP N N 73 115.750 115.750 117.600 -1.850 25153 12575 1 14 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.424 -0.256 25153 12576 1 14 . 1 1 73 73 ASP C C 73 177.560 177.560 177.486 0.074 25153 12577 1 14 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.311 1.089 25153 12578 1 14 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.495 -1.395 25153 12579 1 14 . 1 1 74 74 ASP N N 74 117.223 117.223 119.892 -2.669 25153 12580 1 14 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.589 0.114 25153 12581 1 14 . 1 1 74 74 ASP C C 74 176.388 176.388 177.070 -0.682 25153 12582 1 14 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.114 -0.614 25153 12583 1 14 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.587 0.113 25153 12584 1 14 . 1 1 75 75 LEU N N 75 118.316 118.316 119.391 -1.075 25153 12585 1 14 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.363 -0.078 25153 12586 1 14 . 1 1 75 75 LEU C C 75 176.820 176.820 175.805 1.015 25153 12587 1 14 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.464 -0.064 25153 12588 1 14 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.496 0.784 25153 12589 1 14 . 1 1 75 75 LEU H H 75 6.960 6.960 7.312 -0.352 25153 12590 1 14 . 1 1 76 76 ASN N N 76 123.045 123.045 117.986 5.059 25153 12591 1 14 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.791 0.099 25153 12592 1 14 . 1 1 76 76 ASN C C 76 174.950 174.950 174.765 0.185 25153 12593 1 14 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.670 -0.620 25153 12594 1 14 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.553 -1.053 25153 12595 1 14 . 1 1 76 76 ASN H H 76 9.890 9.890 8.763 1.127 25153 12596 1 14 . 1 1 77 77 LEU N N 77 123.494 123.494 123.421 0.073 25153 12597 1 14 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.541 -0.171 25153 12598 1 14 . 1 1 77 77 LEU C C 77 175.040 175.040 176.323 -1.283 25153 12599 1 14 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.882 -1.632 25153 12600 1 14 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.396 0.504 25153 12601 1 14 . 1 1 77 77 LEU H H 77 8.730 8.730 8.185 0.545 25153 12602 1 14 . 1 1 78 78 GLU N N 78 120.870 120.870 121.651 -0.781 25153 12603 1 14 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.396 -0.496 25153 12604 1 14 . 1 1 78 78 GLU C C 78 178.660 178.660 177.828 0.832 25153 12605 1 14 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.597 1.163 25153 12606 1 14 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.195 0.205 25153 12607 1 14 . 1 1 79 79 GLY N N 79 113.240 113.240 114.584 -1.344 25153 12608 1 14 . 1 1 79 79 GLY C C 79 174.460 174.460 174.150 0.310 25153 12609 1 14 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.389 0.041 25153 12610 1 14 . 1 1 79 79 GLY H H 79 8.474 8.474 8.776 -0.302 25153 12611 1 14 . 1 1 80 80 LYS N N 80 120.295 120.295 118.978 1.317 25153 12612 1 14 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.583 -0.225 25153 12613 1 14 . 1 1 80 80 LYS C C 80 175.360 175.360 176.204 -0.844 25153 12614 1 14 . 1 1 80 80 LYS CA C 80 56.970 56.970 55.952 1.018 25153 12615 1 14 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.748 -0.548 25153 12616 1 14 . 1 1 81 81 ILE N N 81 122.400 122.400 122.134 0.266 25153 12617 1 14 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.526 0.267 25153 12618 1 14 . 1 1 81 81 ILE C C 81 174.760 174.760 175.633 -0.873 25153 12619 1 14 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.518 -1.688 25153 12620 1 14 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.909 -0.209 25153 12621 1 14 . 1 1 81 81 ILE H H 81 7.400 7.400 7.871 -0.471 25153 12622 1 14 . 1 1 82 82 VAL N N 82 127.840 127.840 125.916 1.924 25153 12623 1 14 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.910 0.351 25153 12624 1 14 . 1 1 82 82 VAL C C 82 172.724 172.724 174.251 -1.527 25153 12625 1 14 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.648 -0.238 25153 12626 1 14 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.016 0.384 25153 12627 1 14 . 1 1 82 82 VAL H H 82 8.790 8.790 8.911 -0.121 25153 12628 1 14 . 1 1 83 83 ALA N N 83 131.347 131.347 131.000 0.347 25153 12629 1 14 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.298 0.084 25153 12630 1 14 . 1 1 83 83 ALA C C 83 175.750 175.750 176.586 -0.836 25153 12631 1 14 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.137 -0.267 25153 12632 1 14 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.371 3.079 25153 12633 1 14 . 1 1 83 83 ALA H H 83 9.300 9.300 8.946 0.354 25153 12634 1 14 . 1 1 84 84 LEU N N 84 124.200 124.200 126.880 -2.680 25153 12635 1 14 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.648 -0.128 25153 12636 1 14 . 1 1 84 84 LEU C C 84 175.760 175.760 176.906 -1.146 25153 12637 1 14 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.984 -0.484 25153 12638 1 14 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.280 1.620 25153 12639 1 14 . 1 1 84 84 LEU H H 84 10.287 10.287 9.050 1.237 25153 12640 1 14 . 1 1 85 85 TYR N N 85 115.912 115.912 119.051 -3.139 25153 12641 1 14 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.299 -0.339 25153 12642 1 14 . 1 1 85 85 TYR C C 85 172.372 172.372 173.797 -1.425 25153 12643 1 14 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.163 0.937 25153 12644 1 14 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.572 1.458 25153 12645 1 14 . 1 1 85 85 TYR H H 85 9.257 9.257 8.693 0.564 25153 12646 1 14 . 1 1 86 86 GLY N N 86 107.800 107.800 106.274 1.526 25153 12647 1 14 . 1 1 86 86 GLY C C 86 170.330 170.330 171.502 -1.172 25153 12648 1 14 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.679 -0.309 25153 12649 1 14 . 1 1 86 86 GLY H H 86 9.027 9.027 8.657 0.370 25153 12650 1 14 . 1 1 87 87 LEU N N 87 123.458 123.458 118.169 5.289 25153 12651 1 14 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.138 0.327 25153 12652 1 14 . 1 1 87 87 LEU C C 87 178.100 178.100 175.951 2.149 25153 12653 1 14 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.870 0.720 25153 12654 1 14 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.457 -0.117 25153 12655 1 14 . 1 1 87 87 LEU H H 87 6.580 6.580 7.880 -1.300 25153 12656 1 14 . 1 1 88 88 GLY N N 88 108.966 108.966 107.537 1.429 25153 12657 1 14 . 1 1 88 88 GLY C C 88 172.820 172.820 171.700 1.120 25153 12658 1 14 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.510 1.150 25153 12659 1 14 . 1 1 88 88 GLY H H 88 8.070 8.070 7.978 0.092 25153 12660 1 14 . 1 1 89 89 ASP N N 89 121.150 121.150 117.315 3.835 25153 12661 1 14 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.257 -0.011 25153 12662 1 14 . 1 1 89 89 ASP C C 89 176.220 176.220 176.139 0.081 25153 12663 1 14 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.784 -0.314 25153 12664 1 14 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.245 -1.765 25153 12665 1 14 . 1 1 90 90 GLN N N 90 123.970 123.970 122.299 1.671 25153 12666 1 14 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.068 -0.580 25153 12667 1 14 . 1 1 90 90 GLN C C 90 173.646 173.646 175.871 -2.225 25153 12668 1 14 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.335 0.975 25153 12669 1 14 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.498 -0.288 25153 12670 1 14 . 1 1 90 90 GLN H H 90 8.623 8.623 8.582 0.041 25153 12671 1 14 . 1 1 91 91 LEU N N 91 118.017 118.017 118.659 -0.642 25153 12672 1 14 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.266 0.109 25153 12673 1 14 . 1 1 91 91 LEU C C 91 180.160 180.160 178.924 1.236 25153 12674 1 14 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.046 0.014 25153 12675 1 14 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.147 -0.597 25153 12676 1 14 . 1 1 91 91 LEU H H 91 7.046 7.046 8.693 -1.647 25153 12677 1 14 . 1 1 92 92 GLY N N 92 110.028 110.028 105.309 4.719 25153 12678 1 14 . 1 1 92 92 GLY C C 92 174.912 174.912 174.179 0.733 25153 12679 1 14 . 1 1 92 92 GLY CA C 92 46.180 46.180 46.084 0.096 25153 12680 1 14 . 1 1 92 92 GLY H H 92 9.238 9.238 8.871 0.367 25153 12681 1 14 . 1 1 93 93 TYR N N 93 115.910 115.910 119.355 -3.445 25153 12682 1 14 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.172 -0.163 25153 12683 1 14 . 1 1 93 93 TYR C C 93 176.850 176.850 178.095 -1.245 25153 12684 1 14 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.718 -1.988 25153 12685 1 14 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.211 -2.081 25153 12686 1 14 . 1 1 93 93 TYR H H 93 6.962 6.962 7.597 -0.635 25153 12687 1 14 . 1 1 94 94 GLY N N 94 111.630 111.630 106.846 4.784 25153 12688 1 14 . 1 1 94 94 GLY C C 94 177.777 177.777 176.542 1.235 25153 12689 1 14 . 1 1 94 94 GLY CA C 94 50.030 50.030 46.915 3.115 25153 12690 1 14 . 1 1 94 94 GLY H H 94 7.835 7.835 8.600 -0.765 25153 12691 1 14 . 1 1 95 95 GLU N N 95 122.450 122.450 121.912 0.538 25153 12692 1 14 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.965 -0.047 25153 12693 1 14 . 1 1 95 95 GLU C C 95 175.300 175.300 176.654 -1.354 25153 12694 1 14 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.615 -0.515 25153 12695 1 14 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.109 -1.598 25153 12696 1 14 . 1 1 96 96 TRP N N 96 118.790 118.790 114.592 4.198 25153 12697 1 14 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.966 0.478 25153 12698 1 14 . 1 1 96 96 TRP C C 96 179.280 179.280 175.702 3.578 25153 12699 1 14 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.935 1.079 25153 12700 1 14 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.634 0.386 25153 12701 1 14 . 1 1 96 96 TRP H H 96 8.070 8.070 8.164 -0.094 25153 12702 1 14 . 1 1 97 97 PHE N N 97 128.067 128.067 123.781 4.286 25153 12703 1 14 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.233 1.072 25153 12704 1 14 . 1 1 97 97 PHE C C 97 173.227 173.227 176.085 -2.858 25153 12705 1 14 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.368 -2.648 25153 12706 1 14 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.172 0.768 25153 12707 1 14 . 1 1 97 97 PHE H H 97 7.165 7.165 8.060 -0.895 25153 12708 1 14 . 1 1 98 98 LEU N N 98 114.306 114.306 123.855 -9.549 25153 12709 1 14 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.654 -0.164 25153 12710 1 14 . 1 1 98 98 LEU C C 98 179.365 179.365 177.176 2.189 25153 12711 1 14 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.360 0.100 25153 12712 1 14 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.442 -0.212 25153 12713 1 14 . 1 1 98 98 LEU H H 98 7.453 7.453 8.548 -1.095 25153 12714 1 14 . 1 1 99 99 ASP N N 99 122.354 122.354 120.733 1.621 25153 12715 1 14 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.316 -0.383 25153 12716 1 14 . 1 1 99 99 ASP C C 99 178.800 178.800 177.214 1.586 25153 12717 1 14 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.690 1.490 25153 12718 1 14 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.325 -0.895 25153 12719 1 14 . 1 1 100 100 ALA N N 100 118.568 118.568 121.746 -3.178 25153 12720 1 14 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.061 -0.221 25153 12721 1 14 . 1 1 100 100 ALA C C 100 178.500 178.500 179.147 -0.647 25153 12722 1 14 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.084 -0.168 25153 12723 1 14 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.496 1.164 25153 12724 1 14 . 1 1 100 100 ALA H H 100 8.682 8.682 7.752 0.930 25153 12725 1 14 . 1 1 101 101 LEU N N 101 118.815 118.815 120.511 -1.696 25153 12726 1 14 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.961 -0.281 25153 12727 1 14 . 1 1 101 101 LEU C C 101 178.930 178.930 178.895 0.035 25153 12728 1 14 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.675 0.025 25153 12729 1 14 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.537 0.863 25153 12730 1 14 . 1 1 101 101 LEU H H 101 6.637 6.637 7.252 -0.615 25153 12731 1 14 . 1 1 102 102 GLY N N 102 103.700 103.700 106.298 -2.598 25153 12732 1 14 . 1 1 102 102 GLY C C 102 175.530 175.530 176.070 -0.540 25153 12733 1 14 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.251 0.749 25153 12734 1 14 . 1 1 102 102 GLY H H 102 7.330 7.330 7.998 -0.668 25153 12735 1 14 . 1 1 103 103 MET N N 103 120.330 120.330 121.633 -1.303 25153 12736 1 14 . 1 1 103 103 MET HA H 103 4.254 4.254 4.248 0.006 25153 12737 1 14 . 1 1 103 103 MET C C 103 179.688 179.688 178.614 1.074 25153 12738 1 14 . 1 1 103 103 MET CA C 103 59.615 59.615 59.545 0.070 25153 12739 1 14 . 1 1 103 103 MET CB C 103 33.290 33.290 32.592 0.698 25153 12740 1 14 . 1 1 103 103 MET H H 103 8.407 8.407 7.842 0.565 25153 12741 1 14 . 1 1 104 104 LEU N N 104 123.450 123.450 119.910 3.540 25153 12742 1 14 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.684 0.512 25153 12743 1 14 . 1 1 104 104 LEU C C 104 177.620 177.620 178.756 -1.136 25153 12744 1 14 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.971 -0.001 25153 12745 1 14 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.262 0.038 25153 12746 1 14 . 1 1 104 104 LEU H H 104 8.330 8.330 8.597 -0.267 25153 12747 1 14 . 1 1 105 105 HIS N N 105 119.040 119.040 119.251 -0.211 25153 12748 1 14 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.073 -0.196 25153 12749 1 14 . 1 1 105 105 HIS C C 105 177.100 177.100 176.997 0.103 25153 12750 1 14 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.681 0.289 25153 12751 1 14 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.764 -1.171 25153 12752 1 14 . 1 1 105 105 HIS H H 105 8.050 8.050 8.306 -0.256 25153 12753 1 14 . 1 1 106 106 ASP N N 106 119.950 119.950 119.156 0.794 25153 12754 1 14 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.344 -0.014 25153 12755 1 14 . 1 1 106 106 ASP C C 106 179.300 179.300 178.409 0.891 25153 12756 1 14 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.304 0.506 25153 12757 1 14 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.145 -0.745 25153 12758 1 14 . 1 1 107 107 LYS N N 107 122.060 122.060 119.980 2.080 25153 12759 1 14 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.049 0.084 25153 12760 1 14 . 1 1 107 107 LYS C C 107 178.100 178.100 179.415 -1.315 25153 12761 1 14 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.696 -0.496 25153 12762 1 14 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.167 0.193 25153 12763 1 14 . 1 1 108 108 LEU N N 108 115.610 115.610 117.900 -2.290 25153 12764 1 14 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.121 -0.053 25153 12765 1 14 . 1 1 108 108 LEU C C 108 178.866 178.866 178.331 0.535 25153 12766 1 14 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.838 -0.884 25153 12767 1 14 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.581 0.579 25153 12768 1 14 . 1 1 108 108 LEU H H 108 7.828 7.828 8.436 -0.608 25153 12769 1 14 . 1 1 109 109 SER N N 109 116.362 116.362 115.207 1.155 25153 12770 1 14 . 1 1 109 109 SER HA H 109 4.299 4.299 4.243 0.056 25153 12771 1 14 . 1 1 109 109 SER C C 109 175.660 175.660 176.764 -1.104 25153 12772 1 14 . 1 1 109 109 SER CA C 109 62.350 62.350 61.277 1.073 25153 12773 1 14 . 1 1 109 109 SER CB C 109 62.815 62.815 62.947 -0.133 25153 12774 1 14 . 1 1 109 109 SER H H 109 8.278 8.278 8.573 -0.295 25153 12775 1 14 . 1 1 110 110 THR N N 110 110.230 110.230 115.345 -5.115 25153 12776 1 14 . 1 1 110 110 THR HA H 110 4.615 4.615 4.224 0.391 25153 12777 1 14 . 1 1 110 110 THR C C 110 175.990 175.990 175.506 0.484 25153 12778 1 14 . 1 1 110 110 THR CA C 110 62.090 62.090 64.230 -2.139 25153 12779 1 14 . 1 1 110 110 THR CB C 110 68.800 68.800 68.477 0.324 25153 12780 1 14 . 1 1 110 110 THR H H 110 7.211 7.211 7.830 -0.619 25153 12781 1 14 . 1 1 111 111 LYS N N 111 119.900 119.900 119.739 0.161 25153 12782 1 14 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.384 0.128 25153 12783 1 14 . 1 1 111 111 LYS C C 111 176.916 176.916 176.433 0.483 25153 12784 1 14 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.156 0.498 25153 12785 1 14 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.097 -1.254 25153 12786 1 14 . 1 1 112 112 GLY N N 112 107.910 107.910 108.484 -0.574 25153 12787 1 14 . 1 1 112 112 GLY C C 112 176.250 176.250 174.073 2.177 25153 12788 1 14 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.721 1.319 25153 12789 1 14 . 1 1 112 112 GLY H H 112 8.366 8.366 7.650 0.716 25153 12790 1 14 . 1 1 113 113 VAL N N 113 113.530 113.530 116.247 -2.717 25153 12791 1 14 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.420 0.054 25153 12792 1 14 . 1 1 113 113 VAL C C 113 174.630 174.630 174.519 0.111 25153 12793 1 14 . 1 1 113 113 VAL CA C 113 59.450 59.450 59.929 -0.479 25153 12794 1 14 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.714 -0.164 25153 12795 1 14 . 1 1 113 113 VAL H H 113 6.903 6.903 6.951 -0.048 25153 12796 1 14 . 1 1 114 114 LYS N N 114 123.020 123.020 121.555 1.465 25153 12797 1 14 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.507 -0.002 25153 12798 1 14 . 1 1 114 114 LYS C C 114 175.000 175.000 174.916 0.084 25153 12799 1 14 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.786 -0.586 25153 12800 1 14 . 1 1 114 114 LYS CB C 114 33.340 33.340 35.028 -1.688 25153 12801 1 14 . 1 1 115 115 PHE N N 115 123.290 123.290 121.418 1.872 25153 12802 1 14 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.699 0.014 25153 12803 1 14 . 1 1 115 115 PHE C C 115 177.605 177.605 176.365 1.240 25153 12804 1 14 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.758 1.852 25153 12805 1 14 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.581 -0.581 25153 12806 1 14 . 1 1 115 115 PHE H H 115 8.494 8.494 8.446 0.048 25153 12807 1 14 . 1 1 116 116 VAL N N 116 115.790 115.790 114.246 1.544 25153 12808 1 14 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.377 0.115 25153 12809 1 14 . 1 1 116 116 VAL C C 116 175.414 175.414 175.991 -0.577 25153 12810 1 14 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.559 -0.573 25153 12811 1 14 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.547 -0.447 25153 12812 1 14 . 1 1 116 116 VAL H H 116 8.889 8.889 8.136 0.753 25153 12813 1 14 . 1 1 117 117 GLY N N 117 108.300 108.300 107.331 0.969 25153 12814 1 14 . 1 1 117 117 GLY C C 117 176.180 176.180 174.772 1.408 25153 12815 1 14 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.389 2.411 25153 12816 1 14 . 1 1 117 117 GLY H H 117 9.810 9.810 8.606 1.204 25153 12817 1 14 . 1 1 118 118 TYR N N 118 120.050 120.050 119.161 0.889 25153 12818 1 14 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.746 0.208 25153 12819 1 14 . 1 1 118 118 TYR C C 118 177.450 177.450 175.907 1.543 25153 12820 1 14 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.288 -1.048 25153 12821 1 14 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.283 -3.173 25153 12822 1 14 . 1 1 118 118 TYR H H 118 8.592 8.592 7.550 1.042 25153 12823 1 14 . 1 1 119 119 TRP N N 119 125.500 125.500 120.392 5.108 25153 12824 1 14 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.149 0.879 25153 12825 1 14 . 1 1 119 119 TRP C C 119 173.090 173.090 174.069 -0.979 25153 12826 1 14 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.473 -0.573 25153 12827 1 14 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.218 3.032 25153 12828 1 14 . 1 1 119 119 TRP H H 119 7.926 7.926 8.157 -0.231 25153 12829 1 14 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.710 0.100 25153 12830 1 14 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.678 1.002 25153 12831 1 14 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.797 -0.547 25153 12832 1 14 . 1 1 121 121 THR N N 121 109.114 109.114 110.589 -1.475 25153 12833 1 14 . 1 1 121 121 THR HA H 121 4.142 4.142 3.453 0.689 25153 12834 1 14 . 1 1 121 121 THR C C 121 176.300 176.300 175.585 0.715 25153 12835 1 14 . 1 1 121 121 THR CA C 121 61.230 61.230 62.898 -1.668 25153 12836 1 14 . 1 1 121 121 THR CB C 121 69.890 69.890 68.598 1.292 25153 12837 1 14 . 1 1 121 121 THR H H 121 7.356 7.356 8.336 -0.980 25153 12838 1 14 . 1 1 122 122 GLU N N 122 123.980 123.980 122.437 1.543 25153 12839 1 14 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.025 0.213 25153 12840 1 14 . 1 1 122 122 GLU C C 122 177.830 177.830 177.678 0.152 25153 12841 1 14 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.782 0.448 25153 12842 1 14 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.830 -0.060 25153 12843 1 14 . 1 1 123 123 GLY N N 123 114.570 114.570 113.397 1.173 25153 12844 1 14 . 1 1 123 123 GLY C C 123 173.700 173.700 174.266 -0.566 25153 12845 1 14 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.383 0.017 25153 12846 1 14 . 1 1 123 123 GLY H H 123 9.181 9.181 8.729 0.452 25153 12847 1 14 . 1 1 124 124 TYR N N 124 118.923 118.923 122.137 -3.214 25153 12848 1 14 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.719 0.591 25153 12849 1 14 . 1 1 124 124 TYR C C 124 175.680 175.680 175.298 0.382 25153 12850 1 14 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.402 -1.932 25153 12851 1 14 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.239 0.761 25153 12852 1 14 . 1 1 124 124 TYR H H 124 7.877 7.877 7.783 0.094 25153 12853 1 14 . 1 1 125 125 GLU N N 125 124.890 124.890 122.875 2.015 25153 12854 1 14 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.629 0.071 25153 12855 1 14 . 1 1 125 125 GLU C C 125 172.880 172.880 175.277 -2.397 25153 12856 1 14 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.552 -0.122 25153 12857 1 14 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.103 0.317 25153 12858 1 14 . 1 1 126 126 PHE N N 126 119.166 119.166 119.597 -0.431 25153 12859 1 14 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.778 0.031 25153 12860 1 14 . 1 1 126 126 PHE C C 126 173.750 173.750 174.948 -1.198 25153 12861 1 14 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.416 -1.626 25153 12862 1 14 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.645 0.405 25153 12863 1 14 . 1 1 126 126 PHE H H 126 7.716 7.716 8.078 -0.362 25153 12864 1 14 . 1 1 127 127 THR N N 127 106.800 106.800 114.014 -7.214 25153 12865 1 14 . 1 1 127 127 THR HA H 127 4.400 4.400 3.337 1.063 25153 12866 1 14 . 1 1 127 127 THR C C 127 175.300 175.300 174.489 0.811 25153 12867 1 14 . 1 1 127 127 THR CA C 127 61.100 61.100 63.128 -2.028 25153 12868 1 14 . 1 1 127 127 THR CB C 127 70.600 70.600 68.045 2.555 25153 12869 1 14 . 1 1 127 127 THR H H 127 7.220 7.220 6.723 0.497 25153 12870 1 14 . 1 1 128 128 SER N N 128 118.360 118.360 116.059 2.301 25153 12871 1 14 . 1 1 128 128 SER HA H 128 4.680 4.680 4.481 0.199 25153 12872 1 14 . 1 1 128 128 SER C C 128 175.720 175.720 173.862 1.858 25153 12873 1 14 . 1 1 128 128 SER CA C 128 56.250 56.250 57.373 -1.123 25153 12874 1 14 . 1 1 128 128 SER CB C 128 65.635 65.635 64.014 1.621 25153 12875 1 14 . 1 1 128 128 SER H H 128 7.411 7.411 7.953 -0.542 25153 12876 1 14 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.523 0.252 25153 12877 1 14 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.358 -1.857 25153 12878 1 14 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.240 0.160 25153 12879 1 14 . 1 1 130 130 LYS N N 130 122.014 122.014 118.875 3.139 25153 12880 1 14 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.452 -0.219 25153 12881 1 14 . 1 1 130 130 LYS CA C 130 61.700 61.700 57.947 3.753 25153 12882 1 14 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.335 0.235 25153 12883 1 14 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.488 0.030 25153 12884 1 14 . 1 1 131 131 PRO C C 131 174.000 174.000 175.011 -1.011 25153 12885 1 14 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.669 2.031 25153 12886 1 14 . 1 1 131 131 PRO CB C 131 31.200 31.200 29.890 1.310 25153 12887 1 14 . 1 1 132 132 VAL N N 132 113.260 113.260 116.190 -2.930 25153 12888 1 14 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.870 0.330 25153 12889 1 14 . 1 1 132 132 VAL C C 132 175.210 175.210 174.830 0.380 25153 12890 1 14 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.126 -0.506 25153 12891 1 14 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.048 -1.068 25153 12892 1 14 . 1 1 132 132 VAL H H 132 6.697 6.697 7.504 -0.807 25153 12893 1 14 . 1 1 133 133 ILE N N 133 119.940 119.940 118.017 1.923 25153 12894 1 14 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.476 -0.096 25153 12895 1 14 . 1 1 133 133 ILE C C 133 175.440 175.440 175.245 0.195 25153 12896 1 14 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.977 1.473 25153 12897 1 14 . 1 1 133 133 ILE CB C 133 42.100 42.100 39.971 2.129 25153 12898 1 14 . 1 1 133 133 ILE H H 133 8.756 8.756 8.625 0.131 25153 12899 1 14 . 1 1 134 134 ALA N N 134 122.632 122.632 123.931 -1.299 25153 12900 1 14 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.912 0.048 25153 12901 1 14 . 1 1 134 134 ALA C C 134 178.312 178.312 177.237 1.075 25153 12902 1 14 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.594 -1.514 25153 12903 1 14 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.222 -0.386 25153 12904 1 14 . 1 1 134 134 ALA H H 134 8.523 8.523 8.482 0.041 25153 12905 1 14 . 1 1 135 135 ASP N N 135 117.366 117.366 122.690 -5.324 25153 12906 1 14 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.664 -0.412 25153 12907 1 14 . 1 1 135 135 ASP C C 135 176.387 176.387 176.654 -0.267 25153 12908 1 14 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.372 1.838 25153 12909 1 14 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.238 -1.538 25153 12910 1 14 . 1 1 136 136 GLY N N 136 104.310 104.310 108.043 -3.733 25153 12911 1 14 . 1 1 136 136 GLY C C 136 174.922 174.922 174.955 -0.033 25153 12912 1 14 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.369 -0.269 25153 12913 1 14 . 1 1 136 136 GLY H H 136 7.610 7.610 8.322 -0.712 25153 12914 1 14 . 1 1 137 137 GLN N N 137 118.784 118.784 117.815 0.969 25153 12915 1 14 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.447 -0.392 25153 12916 1 14 . 1 1 137 137 GLN C C 137 176.390 176.390 175.452 0.938 25153 12917 1 14 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.830 1.810 25153 12918 1 14 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.253 -0.023 25153 12919 1 14 . 1 1 137 137 GLN H H 137 7.870 7.870 7.891 -0.021 25153 12920 1 14 . 1 1 138 138 LEU N N 138 118.040 118.040 115.769 2.271 25153 12921 1 14 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.024 -0.037 25153 12922 1 14 . 1 1 138 138 LEU C C 138 175.913 175.913 175.036 0.877 25153 12923 1 14 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.201 0.399 25153 12924 1 14 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.964 1.436 25153 12925 1 14 . 1 1 138 138 LEU H H 138 7.356 7.356 7.185 0.171 25153 12926 1 14 . 1 1 139 139 PHE N N 139 119.060 119.060 119.471 -0.411 25153 12927 1 14 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.904 0.406 25153 12928 1 14 . 1 1 139 139 PHE C C 139 178.780 178.780 177.500 1.280 25153 12929 1 14 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.939 -0.089 25153 12930 1 14 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.886 3.574 25153 12931 1 14 . 1 1 139 139 PHE H H 139 10.094 10.094 8.956 1.138 25153 12932 1 14 . 1 1 140 140 VAL N N 140 109.690 109.690 116.121 -6.431 25153 12933 1 14 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.346 0.135 25153 12934 1 14 . 1 1 140 140 VAL C C 140 172.790 172.790 175.574 -2.784 25153 12935 1 14 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.630 -1.629 25153 12936 1 14 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.023 -0.473 25153 12937 1 14 . 1 1 140 140 VAL H H 140 7.470 7.470 8.093 -0.623 25153 12938 1 14 . 1 1 141 141 GLY N N 141 107.060 107.060 105.314 1.746 25153 12939 1 14 . 1 1 141 141 GLY C C 141 171.513 171.513 172.564 -1.051 25153 12940 1 14 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.504 0.926 25153 12941 1 14 . 1 1 141 141 GLY H H 141 7.137 7.137 7.303 -0.166 25153 12942 1 14 . 1 1 142 142 LEU N N 142 117.863 117.863 120.908 -3.045 25153 12943 1 14 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.102 -1.127 25153 12944 1 14 . 1 1 142 142 LEU C C 142 173.640 173.640 175.159 -1.519 25153 12945 1 14 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.742 1.178 25153 12946 1 14 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.132 -4.582 25153 12947 1 14 . 1 1 142 142 LEU H H 142 7.517 7.517 7.887 -0.370 25153 12948 1 14 . 1 1 143 143 ALA N N 143 126.990 126.990 129.122 -2.132 25153 12949 1 14 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.315 -0.038 25153 12950 1 14 . 1 1 143 143 ALA C C 143 175.730 175.730 175.523 0.207 25153 12951 1 14 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.314 -0.874 25153 12952 1 14 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.248 4.062 25153 12953 1 14 . 1 1 143 143 ALA H H 143 5.186 5.186 8.105 -2.919 25153 12954 1 14 . 1 1 144 144 LEU N N 144 125.477 125.477 122.555 2.922 25153 12955 1 14 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.642 0.138 25153 12956 1 14 . 1 1 144 144 LEU C C 144 174.473 174.473 174.998 -0.525 25153 12957 1 14 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.492 -0.252 25153 12958 1 14 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.741 -0.441 25153 12959 1 14 . 1 1 144 144 LEU H H 144 8.758 8.758 8.014 0.744 25153 12960 1 14 . 1 1 145 145 ASP N N 145 118.915 118.915 119.158 -0.243 25153 12961 1 14 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.372 0.160 25153 12962 1 14 . 1 1 145 145 ASP C C 145 176.470 176.470 176.296 0.174 25153 12963 1 14 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.022 -0.392 25153 12964 1 14 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.151 -1.151 25153 12965 1 14 . 1 1 146 146 GLU N N 146 124.813 124.813 125.017 -0.204 25153 12966 1 14 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.600 -0.224 25153 12967 1 14 . 1 1 146 146 GLU C C 146 177.290 177.290 176.924 0.366 25153 12968 1 14 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.347 -0.227 25153 12969 1 14 . 1 1 146 146 GLU CB C 146 30.150 30.150 30.087 0.063 25153 12970 1 14 . 1 1 147 147 THR N N 147 118.328 118.328 113.474 4.854 25153 12971 1 14 . 1 1 147 147 THR HA H 147 4.200 4.200 4.491 -0.291 25153 12972 1 14 . 1 1 147 147 THR C C 147 175.683 175.683 174.792 0.891 25153 12973 1 14 . 1 1 147 147 THR CA C 147 66.250 66.250 63.907 2.343 25153 12974 1 14 . 1 1 147 147 THR CB C 147 69.600 69.600 69.938 -0.338 25153 12975 1 14 . 1 1 147 147 THR H H 147 8.562 8.562 9.003 -0.441 25153 12976 1 14 . 1 1 148 148 ASN N N 148 115.550 115.550 118.137 -2.587 25153 12977 1 14 . 1 1 148 148 ASN HA H 148 4.987 4.987 5.015 -0.028 25153 12978 1 14 . 1 1 148 148 ASN C C 148 175.870 175.870 175.163 0.707 25153 12979 1 14 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.506 -0.806 25153 12980 1 14 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.995 1.885 25153 12981 1 14 . 1 1 148 148 ASN H H 148 9.118 9.118 8.411 0.707 25153 12982 1 14 . 1 1 149 149 GLN N N 149 117.400 117.400 120.299 -2.899 25153 12983 1 14 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.336 0.507 25153 12984 1 14 . 1 1 149 149 GLN C C 149 177.780 177.780 176.407 1.373 25153 12985 1 14 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.512 -1.612 25153 12986 1 14 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.967 0.333 25153 12987 1 14 . 1 1 149 149 GLN H H 149 7.555 7.555 8.559 -1.004 25153 12988 1 14 . 1 1 150 150 TYR N N 150 120.674 120.674 117.455 3.219 25153 12989 1 14 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.210 0.318 25153 12990 1 14 . 1 1 150 150 TYR C C 150 177.830 177.830 176.946 0.884 25153 12991 1 14 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.944 -0.457 25153 12992 1 14 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.994 -0.394 25153 12993 1 14 . 1 1 150 150 TYR H H 150 6.983 6.983 7.676 -0.693 25153 12994 1 14 . 1 1 151 151 ASP N N 151 120.810 120.810 118.969 1.841 25153 12995 1 14 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.580 -0.065 25153 12996 1 14 . 1 1 151 151 ASP C C 151 176.400 176.400 177.683 -1.283 25153 12997 1 14 . 1 1 151 151 ASP CA C 151 55.400 55.400 56.200 -0.800 25153 12998 1 14 . 1 1 151 151 ASP CB C 151 39.080 39.080 40.985 -1.905 25153 12999 1 14 . 1 1 152 152 LEU N N 152 118.083 118.083 119.275 -1.192 25153 13000 1 14 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.394 0.282 25153 13001 1 14 . 1 1 152 152 LEU C C 152 178.470 178.470 178.474 -0.004 25153 13002 1 14 . 1 1 152 152 LEU CA C 152 54.600 54.600 56.258 -1.658 25153 13003 1 14 . 1 1 152 152 LEU CB C 152 42.600 42.600 42.191 0.409 25153 13004 1 14 . 1 1 152 152 LEU H H 152 7.453 7.453 7.776 -0.323 25153 13005 1 14 . 1 1 153 153 SER N N 153 116.407 116.407 116.026 0.381 25153 13006 1 14 . 1 1 153 153 SER HA H 153 3.960 3.960 4.092 -0.132 25153 13007 1 14 . 1 1 153 153 SER C C 153 174.590 174.590 176.048 -1.458 25153 13008 1 14 . 1 1 153 153 SER CA C 153 63.400 63.400 62.924 0.476 25153 13009 1 14 . 1 1 153 153 SER CB C 153 63.100 63.100 62.757 0.343 25153 13010 1 14 . 1 1 153 153 SER H H 153 7.360 7.360 8.773 -1.413 25153 13011 1 14 . 1 1 154 154 ASP N N 154 121.960 121.960 120.844 1.116 25153 13012 1 14 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.428 -0.118 25153 13013 1 14 . 1 1 154 154 ASP C C 154 178.640 178.640 177.448 1.192 25153 13014 1 14 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.294 1.706 25153 13015 1 14 . 1 1 154 154 ASP CB C 154 39.570 39.570 41.067 -1.497 25153 13016 1 14 . 1 1 155 155 GLU N N 155 121.310 121.310 119.056 2.254 25153 13017 1 14 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.020 0.165 25153 13018 1 14 . 1 1 155 155 GLU C C 155 179.600 179.600 178.992 0.608 25153 13019 1 14 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.015 0.435 25153 13020 1 14 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.506 -0.106 25153 13021 1 14 . 1 1 156 156 ARG N N 156 121.394 121.394 118.985 2.409 25153 13022 1 14 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.339 -0.039 25153 13023 1 14 . 1 1 156 156 ARG C C 156 177.330 177.330 178.673 -1.343 25153 13024 1 14 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.270 2.190 25153 13025 1 14 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.441 0.319 25153 13026 1 14 . 1 1 157 157 ILE N N 157 118.390 118.390 121.498 -3.108 25153 13027 1 14 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.779 -0.345 25153 13028 1 14 . 1 1 157 157 ILE C C 157 178.814 178.814 178.103 0.711 25153 13029 1 14 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.657 1.037 25153 13030 1 14 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.905 0.948 25153 13031 1 14 . 1 1 157 157 ILE H H 157 8.966 8.966 7.616 1.350 25153 13032 1 14 . 1 1 158 158 GLN N N 158 120.060 120.060 118.641 1.419 25153 13033 1 14 . 1 1 158 158 GLN HA H 158 3.956 3.956 4.009 -0.053 25153 13034 1 14 . 1 1 158 158 GLN C C 158 178.843 178.843 178.805 0.038 25153 13035 1 14 . 1 1 158 158 GLN CA C 158 60.600 60.600 58.868 1.732 25153 13036 1 14 . 1 1 158 158 GLN CB C 158 28.390 28.390 27.905 0.485 25153 13037 1 14 . 1 1 158 158 GLN H H 158 8.394 8.394 7.900 0.494 25153 13038 1 14 . 1 1 159 159 SER N N 159 115.613 115.613 116.240 -0.627 25153 13039 1 14 . 1 1 159 159 SER HA H 159 4.455 4.455 4.365 0.090 25153 13040 1 14 . 1 1 159 159 SER C C 159 177.330 177.330 176.741 0.589 25153 13041 1 14 . 1 1 159 159 SER CA C 159 62.400 62.400 61.029 1.371 25153 13042 1 14 . 1 1 159 159 SER CB C 159 63.760 63.760 63.234 0.526 25153 13043 1 14 . 1 1 159 159 SER H H 159 8.460 8.460 7.860 0.600 25153 13044 1 14 . 1 1 160 160 TRP N N 160 126.820 126.820 125.237 1.583 25153 13045 1 14 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.212 0.254 25153 13046 1 14 . 1 1 160 160 TRP C C 160 178.050 178.050 177.526 0.524 25153 13047 1 14 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.958 0.742 25153 13048 1 14 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.407 -0.047 25153 13049 1 14 . 1 1 160 160 TRP H H 160 9.318 9.318 8.488 0.830 25153 13050 1 14 . 1 1 161 161 CYS N N 161 116.750 116.750 117.786 -1.036 25153 13051 1 14 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.781 0.102 25153 13052 1 14 . 1 1 161 161 CYS C C 161 176.270 176.270 176.805 -0.535 25153 13053 1 14 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.198 1.163 25153 13054 1 14 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.918 0.962 25153 13055 1 14 . 1 1 161 161 CYS H H 161 8.950 8.950 9.048 -0.098 25153 13056 1 14 . 1 1 162 162 GLU N N 162 118.096 118.096 120.120 -2.024 25153 13057 1 14 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.118 -0.188 25153 13058 1 14 . 1 1 162 162 GLU C C 162 178.680 178.680 177.407 1.273 25153 13059 1 14 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.125 0.605 25153 13060 1 14 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.373 0.057 25153 13061 1 14 . 1 1 163 163 GLN N N 163 120.790 120.790 117.706 3.084 25153 13062 1 14 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.093 0.084 25153 13063 1 14 . 1 1 163 163 GLN C C 163 179.690 179.690 178.093 1.597 25153 13064 1 14 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.824 1.716 25153 13065 1 14 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.771 0.229 25153 13066 1 14 . 1 1 163 163 GLN H H 163 8.205 8.205 7.518 0.687 25153 13067 1 14 . 1 1 164 164 ILE N N 164 114.860 114.860 118.724 -3.864 25153 13068 1 14 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.875 0.168 25153 13069 1 14 . 1 1 164 164 ILE C C 164 178.680 178.680 177.316 1.364 25153 13070 1 14 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.007 2.204 25153 13071 1 14 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.635 0.066 25153 13072 1 14 . 1 1 164 164 ILE H H 164 9.005 9.005 8.029 0.976 25153 13073 1 14 . 1 1 165 165 LEU N N 165 123.900 123.900 115.929 7.971 25153 13074 1 14 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.227 -0.077 25153 13075 1 14 . 1 1 165 165 LEU C C 165 180.520 180.520 177.263 3.257 25153 13076 1 14 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.140 1.160 25153 13077 1 14 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.250 -0.200 25153 13078 1 14 . 1 1 165 165 LEU H H 165 7.825 7.825 8.011 -0.186 25153 13079 1 14 . 1 1 166 166 ASN N N 166 120.112 120.112 117.930 2.182 25153 13080 1 14 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.767 -0.184 25153 13081 1 14 . 1 1 166 166 ASN C C 166 178.440 178.440 177.113 1.327 25153 13082 1 14 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.944 0.476 25153 13083 1 14 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.839 -1.419 25153 13084 1 14 . 1 1 166 166 ASN H H 166 7.760 7.760 7.939 -0.179 25153 13085 1 14 . 1 1 167 167 GLU N N 167 121.370 121.370 121.824 -0.454 25153 13086 1 14 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.001 0.102 25153 13087 1 14 . 1 1 167 167 GLU C C 167 180.332 180.332 179.355 0.977 25153 13088 1 14 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.755 0.395 25153 13089 1 14 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.678 1.342 25153 13090 1 14 . 1 1 168 168 MET N N 168 118.532 118.532 117.311 1.221 25153 13091 1 14 . 1 1 168 168 MET HA H 168 4.015 4.015 4.270 -0.255 25153 13092 1 14 . 1 1 168 168 MET C C 168 176.600 176.600 178.047 -1.447 25153 13093 1 14 . 1 1 168 168 MET CA C 168 59.300 59.300 59.343 -0.043 25153 13094 1 14 . 1 1 168 168 MET CB C 168 33.400 33.400 32.825 0.575 25153 13095 1 14 . 1 1 168 168 MET H H 168 8.718 8.718 8.452 0.266 25153 13096 1 14 . 1 1 169 169 ALA N N 169 121.922 121.922 122.595 -0.673 25153 13097 1 14 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.219 -0.045 25153 13098 1 14 . 1 1 169 169 ALA C C 169 179.410 179.410 179.681 -0.271 25153 13099 1 14 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.838 -0.438 25153 13100 1 14 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.525 -0.115 25153 13101 1 14 . 1 1 169 169 ALA H H 169 7.448 7.448 7.834 -0.386 25153 13102 1 14 . 1 1 170 170 GLU N N 170 117.300 117.300 117.130 0.170 25153 13103 1 14 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.103 -0.008 25153 13104 1 14 . 1 1 170 170 GLU C C 170 177.470 177.470 178.370 -0.900 25153 13105 1 14 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.545 -0.595 25153 13106 1 14 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.537 0.238 25153 13107 1 14 . 1 1 171 171 HIS N N 171 117.944 117.944 118.181 -0.237 25153 13108 1 14 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.296 0.204 25153 13109 1 14 . 1 1 171 171 HIS C C 171 175.120 175.120 176.716 -1.596 25153 13110 1 14 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.608 -1.408 25153 13111 1 14 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.957 0.643 25153 13112 1 14 . 1 1 171 171 HIS H H 171 7.788 7.788 7.716 0.072 25153 13113 1 14 . 1 1 172 172 TYR N N 172 120.040 120.040 118.794 1.246 25153 13114 1 14 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.318 0.275 25153 13115 1 14 . 1 1 172 172 TYR C C 172 174.612 174.612 175.948 -1.336 25153 13116 1 14 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.700 -0.720 25153 13117 1 14 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.798 0.182 25153 13118 1 14 . 1 1 172 172 TYR H H 172 7.820 7.820 7.934 -0.114 25153 13119 1 15 . 1 1 2 2 ASN N N 2 123.320 123.320 119.443 3.877 25153 13120 1 15 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.067 0.141 25153 13121 1 15 . 1 1 2 2 ASN C C 2 174.590 174.590 174.411 0.179 25153 13122 1 15 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.758 0.242 25153 13123 1 15 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.181 -0.211 25153 13124 1 15 . 1 1 2 2 ASN H H 2 9.428 9.428 8.634 0.794 25153 13125 1 15 . 1 1 3 3 MET N N 3 120.920 120.920 118.732 2.188 25153 13126 1 15 . 1 1 3 3 MET HA H 3 5.530 5.530 5.302 0.228 25153 13127 1 15 . 1 1 3 3 MET C C 3 174.400 174.400 174.866 -0.466 25153 13128 1 15 . 1 1 3 3 MET CA C 3 54.643 54.643 54.314 0.329 25153 13129 1 15 . 1 1 3 3 MET CB C 3 34.637 34.637 37.760 -3.123 25153 13130 1 15 . 1 1 3 3 MET H H 3 8.751 8.751 9.136 -0.385 25153 13131 1 15 . 1 1 4 4 GLY N N 4 115.542 115.542 108.927 6.615 25153 13132 1 15 . 1 1 4 4 GLY C C 4 170.413 170.413 172.081 -1.668 25153 13133 1 15 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.798 -0.696 25153 13134 1 15 . 1 1 4 4 GLY H H 4 8.927 8.927 8.835 0.092 25153 13135 1 15 . 1 1 5 5 LEU N N 5 131.030 131.030 127.766 3.264 25153 13136 1 15 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.319 1.083 25153 13137 1 15 . 1 1 5 5 LEU C C 5 175.952 175.952 174.454 1.498 25153 13138 1 15 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.020 0.430 25153 13139 1 15 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.079 2.513 25153 13140 1 15 . 1 1 5 5 LEU H H 5 8.928 8.928 8.650 0.278 25153 13141 1 15 . 1 1 6 6 PHE N N 6 125.790 125.790 126.167 -0.377 25153 13142 1 15 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.823 -0.083 25153 13143 1 15 . 1 1 6 6 PHE C C 6 174.300 174.300 175.787 -1.487 25153 13144 1 15 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.237 -0.917 25153 13145 1 15 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.780 -0.550 25153 13146 1 15 . 1 1 6 6 PHE H H 6 9.237 9.237 9.463 -0.226 25153 13147 1 15 . 1 1 7 7 TYR N N 7 117.289 117.289 116.906 0.383 25153 13148 1 15 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.786 0.179 25153 13149 1 15 . 1 1 7 7 TYR C C 7 171.262 171.262 173.226 -1.964 25153 13150 1 15 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.309 -0.909 25153 13151 1 15 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.002 0.238 25153 13152 1 15 . 1 1 7 7 TYR H H 7 8.125 8.125 8.305 -0.180 25153 13153 1 15 . 1 1 8 8 GLY N N 8 107.420 107.420 106.717 0.703 25153 13154 1 15 . 1 1 8 8 GLY C C 8 172.000 172.000 172.384 -0.384 25153 13155 1 15 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.207 -0.263 25153 13156 1 15 . 1 1 8 8 GLY H H 8 7.031 7.031 8.591 -1.560 25153 13157 1 15 . 1 1 9 9 SER N N 9 118.150 118.150 116.855 1.295 25153 13158 1 15 . 1 1 9 9 SER HA H 9 5.200 5.200 5.188 0.012 25153 13159 1 15 . 1 1 9 9 SER C C 9 175.000 175.000 174.362 0.638 25153 13160 1 15 . 1 1 9 9 SER CA C 9 57.570 57.570 56.901 0.669 25153 13161 1 15 . 1 1 9 9 SER CB C 9 66.700 66.700 65.717 0.983 25153 13162 1 15 . 1 1 9 9 SER H H 9 9.604 9.604 8.360 1.244 25153 13163 1 15 . 1 1 10 10 SER N N 10 131.193 131.193 120.596 10.597 25153 13164 1 15 . 1 1 10 10 SER HA H 10 4.775 4.775 4.319 0.456 25153 13165 1 15 . 1 1 10 10 SER C C 10 175.730 175.730 175.773 -0.043 25153 13166 1 15 . 1 1 10 10 SER CA C 10 61.750 61.750 60.694 1.056 25153 13167 1 15 . 1 1 10 10 SER CB C 10 64.400 64.400 63.528 0.873 25153 13168 1 15 . 1 1 10 10 SER H H 10 11.636 11.636 8.990 2.646 25153 13169 1 15 . 1 1 11 11 THR N N 11 115.848 115.848 116.011 -0.163 25153 13170 1 15 . 1 1 11 11 THR HA H 11 4.770 4.770 4.226 0.544 25153 13171 1 15 . 1 1 11 11 THR C C 11 173.700 173.700 174.914 -1.214 25153 13172 1 15 . 1 1 11 11 THR CA C 11 60.700 60.700 62.735 -2.035 25153 13173 1 15 . 1 1 11 11 THR CB C 11 67.430 67.430 69.441 -2.011 25153 13174 1 15 . 1 1 11 11 THR H H 11 9.550 9.550 8.601 0.949 25153 13175 1 15 . 1 1 12 12 CYS N N 12 109.780 109.780 116.020 -6.240 25153 13176 1 15 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.743 -0.673 25153 13177 1 15 . 1 1 12 12 CYS C C 12 176.220 176.220 176.003 0.217 25153 13178 1 15 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.229 5.371 25153 13179 1 15 . 1 1 12 12 CYS CB C 12 26.400 26.400 28.265 -1.865 25153 13180 1 15 . 1 1 12 12 CYS H H 12 7.437 7.437 7.495 -0.058 25153 13181 1 15 . 1 1 13 13 TYR N N 13 127.830 127.830 123.012 4.818 25153 13182 1 15 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.284 -0.181 25153 13183 1 15 . 1 1 13 13 TYR C C 13 180.880 180.880 178.230 2.650 25153 13184 1 15 . 1 1 13 13 TYR CA C 13 65.100 65.100 62.414 2.686 25153 13185 1 15 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.824 -0.989 25153 13186 1 15 . 1 1 13 13 TYR H H 13 10.886 10.886 7.221 3.665 25153 13187 1 15 . 1 1 14 14 THR N N 14 124.428 124.428 113.457 10.971 25153 13188 1 15 . 1 1 14 14 THR HA H 14 4.160 4.160 4.123 0.037 25153 13189 1 15 . 1 1 14 14 THR C C 14 177.760 177.760 176.250 1.510 25153 13190 1 15 . 1 1 14 14 THR CA C 14 67.823 67.823 67.140 0.683 25153 13191 1 15 . 1 1 14 14 THR CB C 14 68.040 68.040 68.228 -0.188 25153 13192 1 15 . 1 1 14 14 THR H H 14 11.405 11.405 8.719 2.686 25153 13193 1 15 . 1 1 15 15 GLU N N 15 123.050 123.050 123.147 -0.097 25153 13194 1 15 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.296 -0.406 25153 13195 1 15 . 1 1 15 15 GLU C C 15 176.392 176.392 178.043 -1.651 25153 13196 1 15 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.446 -0.246 25153 13197 1 15 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.394 1.056 25153 13198 1 15 . 1 1 16 16 MET N N 16 120.173 120.173 118.352 1.821 25153 13199 1 15 . 1 1 16 16 MET HA H 16 4.050 4.050 4.154 -0.104 25153 13200 1 15 . 1 1 16 16 MET C C 16 179.940 179.940 178.696 1.244 25153 13201 1 15 . 1 1 16 16 MET CA C 16 59.240 59.240 59.236 0.005 25153 13202 1 15 . 1 1 16 16 MET CB C 16 32.970 32.970 32.906 0.064 25153 13203 1 15 . 1 1 16 16 MET H H 16 8.469 8.469 8.479 -0.010 25153 13204 1 15 . 1 1 17 17 ALA N N 17 121.930 121.930 121.696 0.234 25153 13205 1 15 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.857 -0.021 25153 13206 1 15 . 1 1 17 17 ALA C C 17 177.900 177.900 178.795 -0.895 25153 13207 1 15 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.096 0.104 25153 13208 1 15 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.120 -0.120 25153 13209 1 15 . 1 1 17 17 ALA H H 17 7.880 7.880 8.288 -0.408 25153 13210 1 15 . 1 1 18 18 ALA N N 18 121.477 121.477 121.368 0.109 25153 13211 1 15 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.851 -0.114 25153 13212 1 15 . 1 1 18 18 ALA C C 18 179.380 179.380 179.542 -0.162 25153 13213 1 15 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.197 -0.197 25153 13214 1 15 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.802 1.028 25153 13215 1 15 . 1 1 18 18 ALA H H 18 7.374 7.374 8.288 -0.914 25153 13216 1 15 . 1 1 19 19 GLU N N 19 116.650 116.650 118.102 -1.452 25153 13217 1 15 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.851 -0.235 25153 13218 1 15 . 1 1 19 19 GLU C C 19 178.479 178.479 179.296 -0.817 25153 13219 1 15 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.513 0.217 25153 13220 1 15 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.374 -0.074 25153 13221 1 15 . 1 1 20 20 LYS N N 20 119.470 119.470 119.894 -0.424 25153 13222 1 15 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.022 0.028 25153 13223 1 15 . 1 1 20 20 LYS C C 20 179.116 179.116 179.070 0.046 25153 13224 1 15 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.458 0.372 25153 13225 1 15 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.433 0.417 25153 13226 1 15 . 1 1 21 21 ILE N N 21 121.030 121.030 120.764 0.266 25153 13227 1 15 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.685 -0.295 25153 13228 1 15 . 1 1 21 21 ILE C C 21 177.580 177.580 178.194 -0.614 25153 13229 1 15 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.790 0.030 25153 13230 1 15 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.928 0.420 25153 13231 1 15 . 1 1 21 21 ILE H H 21 8.100 8.100 8.628 -0.528 25153 13232 1 15 . 1 1 22 22 ARG N N 22 119.720 119.720 119.490 0.230 25153 13233 1 15 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.858 -0.303 25153 13234 1 15 . 1 1 22 22 ARG C C 22 177.320 177.320 178.108 -0.788 25153 13235 1 15 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.716 0.004 25153 13236 1 15 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.740 -0.808 25153 13237 1 15 . 1 1 23 23 ASP N N 23 118.730 118.730 119.449 -0.719 25153 13238 1 15 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.410 -0.047 25153 13239 1 15 . 1 1 23 23 ASP C C 23 178.330 178.330 178.784 -0.454 25153 13240 1 15 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.367 -0.417 25153 13241 1 15 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.861 -0.621 25153 13242 1 15 . 1 1 24 24 ILE N N 24 121.090 121.090 119.502 1.588 25153 13243 1 15 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.776 0.020 25153 13244 1 15 . 1 1 24 24 ILE C C 24 178.250 178.250 177.959 0.291 25153 13245 1 15 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.838 -0.688 25153 13246 1 15 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.287 0.193 25153 13247 1 15 . 1 1 24 24 ILE H H 24 7.910 7.910 8.189 -0.279 25153 13248 1 15 . 1 1 25 25 ILE N N 25 121.406 121.406 117.261 4.145 25153 13249 1 15 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.868 -0.222 25153 13250 1 15 . 1 1 25 25 ILE C C 25 176.800 176.800 176.779 0.021 25153 13251 1 15 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.058 2.642 25153 13252 1 15 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.927 -0.737 25153 13253 1 15 . 1 1 25 25 ILE H H 25 8.476 8.476 8.066 0.410 25153 13254 1 15 . 1 1 26 26 GLY N N 26 108.900 108.900 105.167 3.733 25153 13255 1 15 . 1 1 26 26 GLY C C 26 173.710 173.710 172.268 1.442 25153 13256 1 15 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.664 -0.334 25153 13257 1 15 . 1 1 26 26 GLY H H 26 8.016 8.016 7.806 0.210 25153 13258 1 15 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.711 -0.373 25153 13259 1 15 . 1 1 27 27 PRO C C 27 177.200 177.200 177.162 0.038 25153 13260 1 15 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.501 1.185 25153 13261 1 15 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.026 0.174 25153 13262 1 15 . 1 1 28 28 GLU N N 28 116.295 116.295 117.992 -1.697 25153 13263 1 15 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.213 0.057 25153 13264 1 15 . 1 1 28 28 GLU C C 28 176.980 176.980 177.297 -0.317 25153 13265 1 15 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.167 -0.427 25153 13266 1 15 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.609 -0.939 25153 13267 1 15 . 1 1 29 29 LEU N N 29 120.250 120.250 112.032 8.218 25153 13268 1 15 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.709 -0.073 25153 13269 1 15 . 1 1 29 29 LEU C C 29 175.770 175.770 175.559 0.211 25153 13270 1 15 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.023 0.777 25153 13271 1 15 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.051 1.049 25153 13272 1 15 . 1 1 29 29 LEU H H 29 7.940 7.940 7.613 0.327 25153 13273 1 15 . 1 1 30 30 VAL N N 30 118.693 118.693 120.903 -2.210 25153 13274 1 15 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.801 -0.153 25153 13275 1 15 . 1 1 30 30 VAL C C 30 174.347 174.347 175.781 -1.434 25153 13276 1 15 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.427 -0.559 25153 13277 1 15 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.971 1.609 25153 13278 1 15 . 1 1 30 30 VAL H H 30 7.434 7.434 7.975 -0.541 25153 13279 1 15 . 1 1 31 31 THR N N 31 123.800 123.800 121.942 1.858 25153 13280 1 15 . 1 1 31 31 THR HA H 31 4.362 4.362 4.574 -0.212 25153 13281 1 15 . 1 1 31 31 THR C C 31 172.964 172.964 173.314 -0.350 25153 13282 1 15 . 1 1 31 31 THR CA C 31 61.720 61.720 60.865 0.855 25153 13283 1 15 . 1 1 31 31 THR CB C 31 70.485 70.485 70.852 -0.367 25153 13284 1 15 . 1 1 31 31 THR H H 31 7.844 7.844 8.159 -0.315 25153 13285 1 15 . 1 1 32 32 LEU N N 32 127.800 127.800 127.205 0.595 25153 13286 1 15 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.539 0.145 25153 13287 1 15 . 1 1 32 32 LEU C C 32 176.600 176.600 176.520 0.080 25153 13288 1 15 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.099 0.056 25153 13289 1 15 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.719 1.131 25153 13290 1 15 . 1 1 32 32 LEU H H 32 8.660 8.660 8.594 0.066 25153 13291 1 15 . 1 1 33 33 HIS N N 33 119.670 119.670 119.851 -0.181 25153 13292 1 15 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.800 -0.400 25153 13293 1 15 . 1 1 33 33 HIS C C 33 171.667 171.667 173.409 -1.742 25153 13294 1 15 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.165 0.035 25153 13295 1 15 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.825 0.375 25153 13296 1 15 . 1 1 33 33 HIS H H 33 9.060 9.060 8.702 0.358 25153 13297 1 15 . 1 1 34 34 ASN N N 34 124.068 124.068 123.505 0.563 25153 13298 1 15 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.123 -0.689 25153 13299 1 15 . 1 1 34 34 ASN C C 34 178.000 178.000 175.909 2.091 25153 13300 1 15 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.876 -0.447 25153 13301 1 15 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.138 -0.577 25153 13302 1 15 . 1 1 34 34 ASN H H 34 8.780 8.780 8.390 0.390 25153 13303 1 15 . 1 1 35 35 LEU N N 35 129.040 129.040 126.489 2.551 25153 13304 1 15 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.203 0.112 25153 13305 1 15 . 1 1 35 35 LEU C C 35 177.700 177.700 177.863 -0.163 25153 13306 1 15 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.413 0.067 25153 13307 1 15 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.819 1.482 25153 13308 1 15 . 1 1 35 35 LEU H H 35 8.821 8.821 8.543 0.278 25153 13309 1 15 . 1 1 36 36 LYS N N 36 121.043 121.043 116.565 4.478 25153 13310 1 15 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.068 -0.188 25153 13311 1 15 . 1 1 36 36 LYS C C 36 176.230 176.230 176.995 -0.765 25153 13312 1 15 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.384 1.036 25153 13313 1 15 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.498 0.772 25153 13314 1 15 . 1 1 37 37 ASP N N 37 114.965 114.965 118.058 -3.093 25153 13315 1 15 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.791 -0.014 25153 13316 1 15 . 1 1 37 37 ASP C C 37 175.440 175.440 175.876 -0.436 25153 13317 1 15 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.537 0.174 25153 13318 1 15 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.582 1.118 25153 13319 1 15 . 1 1 38 38 ASP N N 38 121.650 121.650 121.626 0.024 25153 13320 1 15 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.902 -0.032 25153 13321 1 15 . 1 1 38 38 ASP C C 38 174.852 174.852 175.930 -1.078 25153 13322 1 15 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.496 -1.416 25153 13323 1 15 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.388 -0.278 25153 13324 1 15 . 1 1 39 39 SER N N 39 115.207 115.207 117.925 -2.718 25153 13325 1 15 . 1 1 39 39 SER HA H 39 4.585 4.585 4.712 -0.127 25153 13326 1 15 . 1 1 39 39 SER C C 39 175.040 175.040 174.259 0.781 25153 13327 1 15 . 1 1 39 39 SER CA C 39 54.960 54.960 56.208 -1.248 25153 13328 1 15 . 1 1 39 39 SER CB C 39 64.720 64.720 63.614 1.106 25153 13329 1 15 . 1 1 39 39 SER H H 39 8.351 8.351 8.625 -0.274 25153 13330 1 15 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.178 -0.173 25153 13331 1 15 . 1 1 40 40 PRO C C 40 176.730 176.730 177.667 -0.937 25153 13332 1 15 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.929 -0.029 25153 13333 1 15 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.711 -0.311 25153 13334 1 15 . 1 1 41 41 LYS N N 41 121.150 121.150 119.669 1.481 25153 13335 1 15 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.044 -0.132 25153 13336 1 15 . 1 1 41 41 LYS C C 41 179.600 179.600 178.650 0.950 25153 13337 1 15 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.201 -1.001 25153 13338 1 15 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.702 0.298 25153 13339 1 15 . 1 1 42 42 LEU N N 42 118.103 118.103 116.607 1.496 25153 13340 1 15 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.200 -0.163 25153 13341 1 15 . 1 1 42 42 LEU C C 42 178.760 178.760 178.763 -0.003 25153 13342 1 15 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.140 0.040 25153 13343 1 15 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.922 1.052 25153 13344 1 15 . 1 1 42 42 LEU H H 42 7.600 7.600 7.513 0.087 25153 13345 1 15 . 1 1 43 43 MET N N 43 118.917 118.917 117.131 1.786 25153 13346 1 15 . 1 1 43 43 MET HA H 43 3.750 3.750 4.185 -0.435 25153 13347 1 15 . 1 1 43 43 MET C C 43 177.680 177.680 176.910 0.770 25153 13348 1 15 . 1 1 43 43 MET CA C 43 59.730 59.730 58.022 1.708 25153 13349 1 15 . 1 1 43 43 MET CB C 43 32.700 32.700 31.906 0.794 25153 13350 1 15 . 1 1 43 43 MET H H 43 8.202 8.202 7.545 0.657 25153 13351 1 15 . 1 1 44 44 GLU N N 44 110.924 110.924 116.520 -5.596 25153 13352 1 15 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.271 -0.531 25153 13353 1 15 . 1 1 44 44 GLU C C 44 178.130 178.130 178.855 -0.725 25153 13354 1 15 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.337 1.063 25153 13355 1 15 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.901 -0.351 25153 13356 1 15 . 1 1 45 45 GLN N N 45 115.756 115.756 118.520 -2.764 25153 13357 1 15 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.028 0.155 25153 13358 1 15 . 1 1 45 45 GLN C C 45 175.414 175.414 177.172 -1.758 25153 13359 1 15 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.517 -1.337 25153 13360 1 15 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.117 -0.517 25153 13361 1 15 . 1 1 45 45 GLN H H 45 7.516 7.516 7.480 0.036 25153 13362 1 15 . 1 1 46 46 TYR N N 46 117.860 117.860 118.518 -0.658 25153 13363 1 15 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.349 0.314 25153 13364 1 15 . 1 1 46 46 TYR C C 46 175.500 175.500 177.036 -1.536 25153 13365 1 15 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.375 -0.889 25153 13366 1 15 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.297 3.173 25153 13367 1 15 . 1 1 46 46 TYR H H 46 6.996 6.996 7.166 -0.170 25153 13368 1 15 . 1 1 47 47 ASP N N 47 121.683 121.683 120.924 0.759 25153 13369 1 15 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.657 0.043 25153 13370 1 15 . 1 1 47 47 ASP C C 47 175.610 175.610 175.005 0.605 25153 13371 1 15 . 1 1 47 47 ASP CA C 47 56.700 56.700 56.819 -0.119 25153 13372 1 15 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.003 0.997 25153 13373 1 15 . 1 1 48 48 VAL N N 48 118.628 118.628 117.035 1.593 25153 13374 1 15 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.798 0.236 25153 13375 1 15 . 1 1 48 48 VAL C C 48 174.190 174.190 174.034 0.156 25153 13376 1 15 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.315 -1.125 25153 13377 1 15 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.831 0.269 25153 13378 1 15 . 1 1 48 48 VAL H H 48 7.628 7.628 7.440 0.188 25153 13379 1 15 . 1 1 49 49 LEU N N 49 128.190 128.190 124.970 3.220 25153 13380 1 15 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.484 0.119 25153 13381 1 15 . 1 1 49 49 LEU C C 49 174.880 174.880 175.767 -0.887 25153 13382 1 15 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.024 -0.784 25153 13383 1 15 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.535 -0.195 25153 13384 1 15 . 1 1 49 49 LEU H H 49 9.407 9.407 9.088 0.319 25153 13385 1 15 . 1 1 50 50 ILE N N 50 124.550 124.550 120.993 3.557 25153 13386 1 15 . 1 1 50 50 ILE HA H 50 5.700 5.700 4.992 0.708 25153 13387 1 15 . 1 1 50 50 ILE C C 50 175.300 175.300 174.630 0.670 25153 13388 1 15 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.019 -1.155 25153 13389 1 15 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.896 -0.646 25153 13390 1 15 . 1 1 50 50 ILE H H 50 9.238 9.238 9.231 0.007 25153 13391 1 15 . 1 1 51 51 LEU N N 51 127.460 127.460 128.140 -0.680 25153 13392 1 15 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.818 0.367 25153 13393 1 15 . 1 1 51 51 LEU C C 51 174.544 174.544 175.759 -1.215 25153 13394 1 15 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.747 -0.927 25153 13395 1 15 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.303 -2.666 25153 13396 1 15 . 1 1 51 51 LEU H H 51 9.228 9.228 9.339 -0.111 25153 13397 1 15 . 1 1 52 52 GLY N N 52 107.760 107.760 111.624 -3.864 25153 13398 1 15 . 1 1 52 52 GLY C C 52 174.710 174.710 172.685 2.025 25153 13399 1 15 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.485 0.385 25153 13400 1 15 . 1 1 52 52 GLY H H 52 8.860 8.860 9.070 -0.210 25153 13401 1 15 . 1 1 53 53 ILE N N 53 123.890 123.890 121.069 2.821 25153 13402 1 15 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.776 0.494 25153 13403 1 15 . 1 1 53 53 ILE C C 53 172.630 172.630 173.106 -0.476 25153 13404 1 15 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.472 0.208 25153 13405 1 15 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.647 4.513 25153 13406 1 15 . 1 1 53 53 ILE H H 53 8.458 8.458 8.214 0.244 25153 13407 1 15 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.954 0.434 25153 13408 1 15 . 1 1 54 54 PRO C C 54 175.000 175.000 176.356 -1.356 25153 13409 1 15 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.840 -0.240 25153 13410 1 15 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.741 -0.441 25153 13411 1 15 . 1 1 55 55 THR N N 55 112.754 112.754 119.540 -6.786 25153 13412 1 15 . 1 1 55 55 THR HA H 55 4.452 4.452 4.672 -0.220 25153 13413 1 15 . 1 1 55 55 THR C C 55 172.480 172.480 174.052 -1.572 25153 13414 1 15 . 1 1 55 55 THR CA C 55 62.350 62.350 62.882 -0.532 25153 13415 1 15 . 1 1 55 55 THR CB C 55 70.230 70.230 69.651 0.579 25153 13416 1 15 . 1 1 55 55 THR H H 55 6.523 6.523 8.057 -1.534 25153 13417 1 15 . 1 1 56 56 TRP N N 56 130.044 130.044 127.441 2.603 25153 13418 1 15 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.589 -1.874 25153 13419 1 15 . 1 1 56 56 TRP C C 56 172.890 172.890 175.576 -2.686 25153 13420 1 15 . 1 1 56 56 TRP CA C 56 56.650 56.650 57.294 -0.644 25153 13421 1 15 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.894 2.106 25153 13422 1 15 . 1 1 56 56 TRP H H 56 8.450 8.450 8.573 -0.123 25153 13423 1 15 . 1 1 57 57 ASP N N 57 115.275 115.275 120.441 -5.166 25153 13424 1 15 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.981 0.371 25153 13425 1 15 . 1 1 57 57 ASP C C 57 173.660 173.660 174.902 -1.242 25153 13426 1 15 . 1 1 57 57 ASP CA C 57 56.230 56.230 54.936 1.294 25153 13427 1 15 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.729 0.441 25153 13428 1 15 . 1 1 58 58 PHE N N 58 112.840 112.840 116.200 -3.360 25153 13429 1 15 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.638 -0.314 25153 13430 1 15 . 1 1 58 58 PHE C C 58 175.730 175.730 175.327 0.403 25153 13431 1 15 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.249 0.574 25153 13432 1 15 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.667 -1.913 25153 13433 1 15 . 1 1 58 58 PHE H H 58 7.640 7.640 7.644 -0.004 25153 13434 1 15 . 1 1 59 59 GLY N N 59 104.940 104.940 105.420 -0.480 25153 13435 1 15 . 1 1 59 59 GLY C C 59 173.750 173.750 174.943 -1.193 25153 13436 1 15 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.562 0.728 25153 13437 1 15 . 1 1 59 59 GLY H H 59 8.024 8.024 8.706 -0.682 25153 13438 1 15 . 1 1 60 60 GLU N N 60 120.045 120.045 119.392 0.653 25153 13439 1 15 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.402 0.011 25153 13440 1 15 . 1 1 60 60 GLU C C 60 176.050 176.050 176.002 0.048 25153 13441 1 15 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.756 -1.136 25153 13442 1 15 . 1 1 60 60 GLU CB C 60 30.610 30.610 30.851 -0.241 25153 13443 1 15 . 1 1 61 61 ILE N N 61 120.790 120.790 120.032 0.758 25153 13444 1 15 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.225 -0.758 25153 13445 1 15 . 1 1 61 61 ILE C C 61 175.130 175.130 175.897 -0.767 25153 13446 1 15 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.546 1.001 25153 13447 1 15 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.593 -0.744 25153 13448 1 15 . 1 1 61 61 ILE H H 61 8.200 8.200 8.027 0.173 25153 13449 1 15 . 1 1 62 62 GLN N N 62 124.520 124.520 122.819 1.701 25153 13450 1 15 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.041 -0.085 25153 13451 1 15 . 1 1 62 62 GLN C C 62 177.160 177.160 177.071 0.089 25153 13452 1 15 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.620 0.991 25153 13453 1 15 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.126 -2.476 25153 13454 1 15 . 1 1 62 62 GLN H H 62 5.667 5.667 8.484 -2.817 25153 13455 1 15 . 1 1 63 63 GLU N N 63 124.570 124.570 126.091 -1.521 25153 13456 1 15 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.239 -0.253 25153 13457 1 15 . 1 1 63 63 GLU C C 63 177.300 177.300 177.408 -0.108 25153 13458 1 15 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.909 1.811 25153 13459 1 15 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.285 0.835 25153 13460 1 15 . 1 1 64 64 ASP N N 64 119.060 119.060 119.777 -0.717 25153 13461 1 15 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.504 0.116 25153 13462 1 15 . 1 1 64 64 ASP C C 64 179.180 179.180 177.630 1.550 25153 13463 1 15 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.141 1.810 25153 13464 1 15 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.710 0.240 25153 13465 1 15 . 1 1 65 65 TRP N N 65 121.070 121.070 121.444 -0.374 25153 13466 1 15 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.521 -0.181 25153 13467 1 15 . 1 1 65 65 TRP C C 65 178.970 178.970 178.262 0.708 25153 13468 1 15 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.472 0.348 25153 13469 1 15 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.278 0.122 25153 13470 1 15 . 1 1 65 65 TRP H H 65 7.350 7.350 7.922 -0.572 25153 13471 1 15 . 1 1 66 66 GLU N N 66 120.900 120.900 118.586 2.314 25153 13472 1 15 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.871 -0.031 25153 13473 1 15 . 1 1 66 66 GLU C C 66 178.750 178.750 179.125 -0.375 25153 13474 1 15 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.453 0.547 25153 13475 1 15 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.255 -0.395 25153 13476 1 15 . 1 1 67 67 ALA N N 67 119.130 119.130 119.948 -0.818 25153 13477 1 15 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.262 -0.009 25153 13478 1 15 . 1 1 67 67 ALA C C 67 179.410 179.410 179.126 0.284 25153 13479 1 15 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.781 -0.201 25153 13480 1 15 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.873 -0.063 25153 13481 1 15 . 1 1 67 67 ALA H H 67 7.640 7.640 7.961 -0.321 25153 13482 1 15 . 1 1 68 68 VAL N N 68 106.845 106.845 111.947 -5.102 25153 13483 1 15 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.533 0.277 25153 13484 1 15 . 1 1 68 68 VAL C C 68 176.750 176.750 176.927 -0.177 25153 13485 1 15 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.020 -2.410 25153 13486 1 15 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.224 0.396 25153 13487 1 15 . 1 1 68 68 VAL H H 68 7.219 7.219 7.630 -0.411 25153 13488 1 15 . 1 1 69 69 TRP N N 69 127.630 127.630 124.179 3.451 25153 13489 1 15 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.315 -0.077 25153 13490 1 15 . 1 1 69 69 TRP C C 69 178.670 178.670 177.178 1.492 25153 13491 1 15 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.342 -1.122 25153 13492 1 15 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.338 2.292 25153 13493 1 15 . 1 1 69 69 TRP H H 69 7.832 7.832 8.597 -0.765 25153 13494 1 15 . 1 1 70 70 ASP N N 70 114.544 114.544 118.276 -3.732 25153 13495 1 15 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.445 0.077 25153 13496 1 15 . 1 1 70 70 ASP C C 70 178.670 178.670 178.974 -0.304 25153 13497 1 15 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.225 -1.225 25153 13498 1 15 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.984 -1.134 25153 13499 1 15 . 1 1 71 71 GLN N N 71 120.040 120.040 119.309 0.731 25153 13500 1 15 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.120 0.064 25153 13501 1 15 . 1 1 71 71 GLN C C 71 178.910 178.910 178.826 0.084 25153 13502 1 15 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.305 -0.695 25153 13503 1 15 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.779 0.321 25153 13504 1 15 . 1 1 71 71 GLN H H 71 7.995 7.995 7.716 0.279 25153 13505 1 15 . 1 1 72 72 LEU N N 72 117.400 117.400 119.167 -1.767 25153 13506 1 15 . 1 1 72 72 LEU HA H 72 3.813 3.813 4.010 -0.197 25153 13507 1 15 . 1 1 72 72 LEU C C 72 178.650 178.650 178.308 0.342 25153 13508 1 15 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.279 -0.079 25153 13509 1 15 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.229 0.181 25153 13510 1 15 . 1 1 72 72 LEU H H 72 7.450 7.450 7.590 -0.140 25153 13511 1 15 . 1 1 73 73 ASP N N 73 115.750 115.750 118.403 -2.653 25153 13512 1 15 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.425 -0.257 25153 13513 1 15 . 1 1 73 73 ASP C C 73 177.560 177.560 177.413 0.147 25153 13514 1 15 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.762 0.638 25153 13515 1 15 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.193 -1.093 25153 13516 1 15 . 1 1 74 74 ASP N N 74 117.223 117.223 119.871 -2.648 25153 13517 1 15 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.594 0.109 25153 13518 1 15 . 1 1 74 74 ASP C C 74 176.388 176.388 177.152 -0.764 25153 13519 1 15 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.031 -0.531 25153 13520 1 15 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.567 0.133 25153 13521 1 15 . 1 1 75 75 LEU N N 75 118.316 118.316 118.802 -0.486 25153 13522 1 15 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.401 -0.116 25153 13523 1 15 . 1 1 75 75 LEU C C 75 176.820 176.820 175.511 1.309 25153 13524 1 15 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.499 -0.099 25153 13525 1 15 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.881 0.399 25153 13526 1 15 . 1 1 75 75 LEU H H 75 6.960 6.960 7.305 -0.345 25153 13527 1 15 . 1 1 76 76 ASN N N 76 123.045 123.045 116.872 6.173 25153 13528 1 15 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.784 0.106 25153 13529 1 15 . 1 1 76 76 ASN C C 76 174.950 174.950 174.587 0.363 25153 13530 1 15 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.550 -0.499 25153 13531 1 15 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.631 -1.131 25153 13532 1 15 . 1 1 76 76 ASN H H 76 9.890 9.890 8.729 1.161 25153 13533 1 15 . 1 1 77 77 LEU N N 77 123.494 123.494 123.747 -0.253 25153 13534 1 15 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.573 -0.203 25153 13535 1 15 . 1 1 77 77 LEU C C 77 175.040 175.040 176.074 -1.034 25153 13536 1 15 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.320 -1.070 25153 13537 1 15 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.373 0.527 25153 13538 1 15 . 1 1 77 77 LEU H H 77 8.730 8.730 8.573 0.157 25153 13539 1 15 . 1 1 78 78 GLU N N 78 120.870 120.870 121.427 -0.557 25153 13540 1 15 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.295 -0.395 25153 13541 1 15 . 1 1 78 78 GLU C C 78 178.660 178.660 177.764 0.896 25153 13542 1 15 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.502 1.258 25153 13543 1 15 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.153 0.247 25153 13544 1 15 . 1 1 79 79 GLY N N 79 113.240 113.240 114.063 -0.823 25153 13545 1 15 . 1 1 79 79 GLY C C 79 174.460 174.460 174.340 0.120 25153 13546 1 15 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.372 0.058 25153 13547 1 15 . 1 1 79 79 GLY H H 79 8.474 8.474 8.848 -0.374 25153 13548 1 15 . 1 1 80 80 LYS N N 80 120.295 120.295 119.819 0.476 25153 13549 1 15 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.550 -0.192 25153 13550 1 15 . 1 1 80 80 LYS C C 80 175.360 175.360 176.159 -0.799 25153 13551 1 15 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.293 0.677 25153 13552 1 15 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.797 -0.597 25153 13553 1 15 . 1 1 81 81 ILE N N 81 122.400 122.400 121.490 0.910 25153 13554 1 15 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.676 0.117 25153 13555 1 15 . 1 1 81 81 ILE C C 81 174.760 174.760 175.639 -0.879 25153 13556 1 15 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.199 -1.369 25153 13557 1 15 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.052 -0.352 25153 13558 1 15 . 1 1 81 81 ILE H H 81 7.400 7.400 7.864 -0.464 25153 13559 1 15 . 1 1 82 82 VAL N N 82 127.840 127.840 125.350 2.490 25153 13560 1 15 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.069 0.193 25153 13561 1 15 . 1 1 82 82 VAL C C 82 172.724 172.724 174.407 -1.683 25153 13562 1 15 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.352 0.058 25153 13563 1 15 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.256 0.144 25153 13564 1 15 . 1 1 82 82 VAL H H 82 8.790 8.790 8.807 -0.017 25153 13565 1 15 . 1 1 83 83 ALA N N 83 131.347 131.347 130.867 0.480 25153 13566 1 15 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.308 0.074 25153 13567 1 15 . 1 1 83 83 ALA C C 83 175.750 175.750 176.381 -0.631 25153 13568 1 15 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.126 -0.256 25153 13569 1 15 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.219 3.231 25153 13570 1 15 . 1 1 83 83 ALA H H 83 9.300 9.300 8.916 0.384 25153 13571 1 15 . 1 1 84 84 LEU N N 84 124.200 124.200 127.053 -2.853 25153 13572 1 15 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.580 -0.060 25153 13573 1 15 . 1 1 84 84 LEU C C 84 175.760 175.760 176.862 -1.102 25153 13574 1 15 . 1 1 84 84 LEU CA C 84 53.500 53.500 54.004 -0.504 25153 13575 1 15 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.412 1.488 25153 13576 1 15 . 1 1 84 84 LEU H H 84 10.287 10.287 8.981 1.306 25153 13577 1 15 . 1 1 85 85 TYR N N 85 115.912 115.912 119.104 -3.192 25153 13578 1 15 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.305 -0.345 25153 13579 1 15 . 1 1 85 85 TYR C C 85 172.372 172.372 173.773 -1.401 25153 13580 1 15 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.145 0.955 25153 13581 1 15 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.425 1.605 25153 13582 1 15 . 1 1 85 85 TYR H H 85 9.257 9.257 8.963 0.294 25153 13583 1 15 . 1 1 86 86 GLY N N 86 107.800 107.800 105.570 2.230 25153 13584 1 15 . 1 1 86 86 GLY C C 86 170.330 170.330 171.443 -1.113 25153 13585 1 15 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.696 -0.326 25153 13586 1 15 . 1 1 86 86 GLY H H 86 9.027 9.027 8.715 0.312 25153 13587 1 15 . 1 1 87 87 LEU N N 87 123.458 123.458 118.199 5.259 25153 13588 1 15 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.197 0.268 25153 13589 1 15 . 1 1 87 87 LEU C C 87 178.100 178.100 175.906 2.194 25153 13590 1 15 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.937 0.653 25153 13591 1 15 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.671 -0.331 25153 13592 1 15 . 1 1 87 87 LEU H H 87 6.580 6.580 7.763 -1.183 25153 13593 1 15 . 1 1 88 88 GLY N N 88 108.966 108.966 106.788 2.178 25153 13594 1 15 . 1 1 88 88 GLY C C 88 172.820 172.820 171.238 1.582 25153 13595 1 15 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.960 0.700 25153 13596 1 15 . 1 1 88 88 GLY H H 88 8.070 8.070 7.822 0.248 25153 13597 1 15 . 1 1 89 89 ASP N N 89 121.150 121.150 117.522 3.628 25153 13598 1 15 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.237 0.009 25153 13599 1 15 . 1 1 89 89 ASP C C 89 176.220 176.220 176.082 0.138 25153 13600 1 15 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.859 -0.389 25153 13601 1 15 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.410 -0.930 25153 13602 1 15 . 1 1 90 90 GLN N N 90 123.970 123.970 122.078 1.892 25153 13603 1 15 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.209 -0.721 25153 13604 1 15 . 1 1 90 90 GLN C C 90 173.646 173.646 175.993 -2.347 25153 13605 1 15 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.478 0.832 25153 13606 1 15 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.555 -0.345 25153 13607 1 15 . 1 1 90 90 GLN H H 90 8.623 8.623 8.709 -0.086 25153 13608 1 15 . 1 1 91 91 LEU N N 91 118.017 118.017 118.969 -0.952 25153 13609 1 15 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.221 0.154 25153 13610 1 15 . 1 1 91 91 LEU C C 91 180.160 180.160 178.898 1.262 25153 13611 1 15 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.166 -0.106 25153 13612 1 15 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.097 -0.547 25153 13613 1 15 . 1 1 91 91 LEU H H 91 7.046 7.046 8.734 -1.688 25153 13614 1 15 . 1 1 92 92 GLY N N 92 110.028 110.028 104.941 5.087 25153 13615 1 15 . 1 1 92 92 GLY C C 92 174.912 174.912 173.996 0.916 25153 13616 1 15 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.978 0.202 25153 13617 1 15 . 1 1 92 92 GLY H H 92 9.238 9.238 8.802 0.436 25153 13618 1 15 . 1 1 93 93 TYR N N 93 115.910 115.910 119.057 -3.147 25153 13619 1 15 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.205 -0.196 25153 13620 1 15 . 1 1 93 93 TYR C C 93 176.850 176.850 177.990 -1.140 25153 13621 1 15 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.616 -1.886 25153 13622 1 15 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.195 -2.065 25153 13623 1 15 . 1 1 93 93 TYR H H 93 6.962 6.962 7.483 -0.521 25153 13624 1 15 . 1 1 94 94 GLY N N 94 111.630 111.630 106.785 4.845 25153 13625 1 15 . 1 1 94 94 GLY C C 94 177.777 177.777 175.890 1.887 25153 13626 1 15 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.057 2.973 25153 13627 1 15 . 1 1 94 94 GLY H H 94 7.835 7.835 8.677 -0.842 25153 13628 1 15 . 1 1 95 95 GLU N N 95 122.450 122.450 121.812 0.638 25153 13629 1 15 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.979 -0.061 25153 13630 1 15 . 1 1 95 95 GLU C C 95 175.300 175.300 176.362 -1.062 25153 13631 1 15 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.450 -0.350 25153 13632 1 15 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.081 -1.569 25153 13633 1 15 . 1 1 96 96 TRP N N 96 118.790 118.790 114.063 4.727 25153 13634 1 15 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.995 0.449 25153 13635 1 15 . 1 1 96 96 TRP C C 96 179.280 179.280 175.881 3.399 25153 13636 1 15 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.522 1.493 25153 13637 1 15 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.014 0.006 25153 13638 1 15 . 1 1 96 96 TRP H H 96 8.070 8.070 8.094 -0.024 25153 13639 1 15 . 1 1 97 97 PHE N N 97 128.067 128.067 123.494 4.573 25153 13640 1 15 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.166 1.139 25153 13641 1 15 . 1 1 97 97 PHE C C 97 173.227 173.227 176.068 -2.841 25153 13642 1 15 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.791 -3.071 25153 13643 1 15 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.217 0.723 25153 13644 1 15 . 1 1 97 97 PHE H H 97 7.165 7.165 7.817 -0.652 25153 13645 1 15 . 1 1 98 98 LEU N N 98 114.306 114.306 122.227 -7.921 25153 13646 1 15 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.653 -0.163 25153 13647 1 15 . 1 1 98 98 LEU C C 98 179.365 179.365 177.179 2.186 25153 13648 1 15 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.232 0.228 25153 13649 1 15 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.531 -0.301 25153 13650 1 15 . 1 1 98 98 LEU H H 98 7.453 7.453 8.249 -0.796 25153 13651 1 15 . 1 1 99 99 ASP N N 99 122.354 122.354 120.623 1.731 25153 13652 1 15 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.347 -0.414 25153 13653 1 15 . 1 1 99 99 ASP C C 99 178.800 178.800 177.243 1.557 25153 13654 1 15 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.425 1.755 25153 13655 1 15 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.332 -0.902 25153 13656 1 15 . 1 1 100 100 ALA N N 100 118.568 118.568 121.734 -3.166 25153 13657 1 15 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.072 -0.232 25153 13658 1 15 . 1 1 100 100 ALA C C 100 178.500 178.500 178.930 -0.430 25153 13659 1 15 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.956 -0.040 25153 13660 1 15 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.578 1.082 25153 13661 1 15 . 1 1 100 100 ALA H H 100 8.682 8.682 7.909 0.773 25153 13662 1 15 . 1 1 101 101 LEU N N 101 118.815 118.815 120.607 -1.792 25153 13663 1 15 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.996 -0.316 25153 13664 1 15 . 1 1 101 101 LEU C C 101 178.930 178.930 178.837 0.093 25153 13665 1 15 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.779 -0.078 25153 13666 1 15 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.561 0.839 25153 13667 1 15 . 1 1 101 101 LEU H H 101 6.637 6.637 7.616 -0.979 25153 13668 1 15 . 1 1 102 102 GLY N N 102 103.700 103.700 106.416 -2.716 25153 13669 1 15 . 1 1 102 102 GLY C C 102 175.530 175.530 176.139 -0.609 25153 13670 1 15 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.301 0.699 25153 13671 1 15 . 1 1 102 102 GLY H H 102 7.330 7.330 7.814 -0.484 25153 13672 1 15 . 1 1 103 103 MET N N 103 120.330 120.330 121.580 -1.250 25153 13673 1 15 . 1 1 103 103 MET HA H 103 4.254 4.254 4.252 0.002 25153 13674 1 15 . 1 1 103 103 MET C C 103 179.688 179.688 178.575 1.113 25153 13675 1 15 . 1 1 103 103 MET CA C 103 59.615 59.615 59.593 0.022 25153 13676 1 15 . 1 1 103 103 MET CB C 103 33.290 33.290 32.651 0.639 25153 13677 1 15 . 1 1 103 103 MET H H 103 8.407 8.407 7.857 0.550 25153 13678 1 15 . 1 1 104 104 LEU N N 104 123.450 123.450 120.215 3.235 25153 13679 1 15 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.652 0.544 25153 13680 1 15 . 1 1 104 104 LEU C C 104 177.620 177.620 178.836 -1.216 25153 13681 1 15 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.794 0.176 25153 13682 1 15 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.125 0.175 25153 13683 1 15 . 1 1 104 104 LEU H H 104 8.330 8.330 8.697 -0.367 25153 13684 1 15 . 1 1 105 105 HIS N N 105 119.040 119.040 119.068 -0.028 25153 13685 1 15 . 1 1 105 105 HIS HA H 105 3.877 3.877 3.968 -0.091 25153 13686 1 15 . 1 1 105 105 HIS C C 105 177.100 177.100 177.317 -0.217 25153 13687 1 15 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.953 0.017 25153 13688 1 15 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.698 -1.105 25153 13689 1 15 . 1 1 105 105 HIS H H 105 8.050 8.050 8.243 -0.193 25153 13690 1 15 . 1 1 106 106 ASP N N 106 119.950 119.950 119.194 0.756 25153 13691 1 15 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.428 -0.098 25153 13692 1 15 . 1 1 106 106 ASP C C 106 179.300 179.300 178.484 0.816 25153 13693 1 15 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.270 0.540 25153 13694 1 15 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.111 -0.711 25153 13695 1 15 . 1 1 107 107 LYS N N 107 122.060 122.060 119.929 2.131 25153 13696 1 15 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.057 0.076 25153 13697 1 15 . 1 1 107 107 LYS C C 107 178.100 178.100 179.470 -1.370 25153 13698 1 15 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.670 -0.470 25153 13699 1 15 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.139 0.222 25153 13700 1 15 . 1 1 108 108 LEU N N 108 115.610 115.610 117.977 -2.367 25153 13701 1 15 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.183 -0.115 25153 13702 1 15 . 1 1 108 108 LEU C C 108 178.866 178.866 178.327 0.539 25153 13703 1 15 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.742 -0.788 25153 13704 1 15 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.627 0.533 25153 13705 1 15 . 1 1 108 108 LEU H H 108 7.828 7.828 8.395 -0.567 25153 13706 1 15 . 1 1 109 109 SER N N 109 116.362 116.362 115.096 1.266 25153 13707 1 15 . 1 1 109 109 SER HA H 109 4.299 4.299 4.288 0.011 25153 13708 1 15 . 1 1 109 109 SER C C 109 175.660 175.660 176.810 -1.150 25153 13709 1 15 . 1 1 109 109 SER CA C 109 62.350 62.350 61.480 0.870 25153 13710 1 15 . 1 1 109 109 SER CB C 109 62.815 62.815 63.178 -0.363 25153 13711 1 15 . 1 1 109 109 SER H H 109 8.278 8.278 8.755 -0.477 25153 13712 1 15 . 1 1 110 110 THR N N 110 110.230 110.230 115.888 -5.658 25153 13713 1 15 . 1 1 110 110 THR HA H 110 4.615 4.615 4.283 0.332 25153 13714 1 15 . 1 1 110 110 THR C C 110 175.990 175.990 175.486 0.504 25153 13715 1 15 . 1 1 110 110 THR CA C 110 62.090 62.090 64.304 -2.214 25153 13716 1 15 . 1 1 110 110 THR CB C 110 68.800 68.800 68.490 0.310 25153 13717 1 15 . 1 1 110 110 THR H H 110 7.211 7.211 7.773 -0.562 25153 13718 1 15 . 1 1 111 111 LYS N N 111 119.900 119.900 119.383 0.517 25153 13719 1 15 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.418 0.094 25153 13720 1 15 . 1 1 111 111 LYS C C 111 176.916 176.916 176.430 0.486 25153 13721 1 15 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.215 0.439 25153 13722 1 15 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.242 -1.399 25153 13723 1 15 . 1 1 112 112 GLY N N 112 107.910 107.910 108.238 -0.328 25153 13724 1 15 . 1 1 112 112 GLY C C 112 176.250 176.250 174.071 2.179 25153 13725 1 15 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.657 1.383 25153 13726 1 15 . 1 1 112 112 GLY H H 112 8.366 8.366 7.604 0.762 25153 13727 1 15 . 1 1 113 113 VAL N N 113 113.530 113.530 116.010 -2.480 25153 13728 1 15 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.528 -0.054 25153 13729 1 15 . 1 1 113 113 VAL C C 113 174.630 174.630 174.751 -0.121 25153 13730 1 15 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.701 -1.251 25153 13731 1 15 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.216 -0.666 25153 13732 1 15 . 1 1 113 113 VAL H H 113 6.903 6.903 6.986 -0.083 25153 13733 1 15 . 1 1 114 114 LYS N N 114 123.020 123.020 119.115 3.905 25153 13734 1 15 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.476 0.029 25153 13735 1 15 . 1 1 114 114 LYS C C 114 175.000 175.000 174.732 0.268 25153 13736 1 15 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.382 -0.182 25153 13737 1 15 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.738 -1.398 25153 13738 1 15 . 1 1 115 115 PHE N N 115 123.290 123.290 119.816 3.474 25153 13739 1 15 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.776 -0.063 25153 13740 1 15 . 1 1 115 115 PHE C C 115 177.605 177.605 176.072 1.533 25153 13741 1 15 . 1 1 115 115 PHE CA C 115 58.610 58.610 57.007 1.603 25153 13742 1 15 . 1 1 115 115 PHE CB C 115 41.000 41.000 42.005 -1.005 25153 13743 1 15 . 1 1 115 115 PHE H H 115 8.494 8.494 8.438 0.056 25153 13744 1 15 . 1 1 116 116 VAL N N 116 115.790 115.790 114.296 1.494 25153 13745 1 15 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.362 0.130 25153 13746 1 15 . 1 1 116 116 VAL C C 116 175.414 175.414 176.129 -0.715 25153 13747 1 15 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.602 -0.617 25153 13748 1 15 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.547 -0.447 25153 13749 1 15 . 1 1 116 116 VAL H H 116 8.889 8.889 8.344 0.545 25153 13750 1 15 . 1 1 117 117 GLY N N 117 108.300 108.300 107.378 0.922 25153 13751 1 15 . 1 1 117 117 GLY C C 117 176.180 176.180 174.883 1.297 25153 13752 1 15 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.550 2.250 25153 13753 1 15 . 1 1 117 117 GLY H H 117 9.810 9.810 8.578 1.232 25153 13754 1 15 . 1 1 118 118 TYR N N 118 120.050 120.050 119.714 0.336 25153 13755 1 15 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.816 0.138 25153 13756 1 15 . 1 1 118 118 TYR C C 118 177.450 177.450 175.868 1.582 25153 13757 1 15 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.308 -1.068 25153 13758 1 15 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.193 -3.083 25153 13759 1 15 . 1 1 118 118 TYR H H 118 8.592 8.592 7.533 1.059 25153 13760 1 15 . 1 1 119 119 TRP N N 119 125.500 125.500 120.856 4.644 25153 13761 1 15 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.175 0.853 25153 13762 1 15 . 1 1 119 119 TRP C C 119 173.090 173.090 174.069 -0.979 25153 13763 1 15 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.506 -0.606 25153 13764 1 15 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.601 2.649 25153 13765 1 15 . 1 1 119 119 TRP H H 119 7.926 7.926 8.189 -0.263 25153 13766 1 15 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.766 0.044 25153 13767 1 15 . 1 1 120 120 PRO CA C 120 63.680 63.680 63.021 0.659 25153 13768 1 15 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.223 0.027 25153 13769 1 15 . 1 1 121 121 THR N N 121 109.114 109.114 112.479 -3.365 25153 13770 1 15 . 1 1 121 121 THR HA H 121 4.142 4.142 3.487 0.655 25153 13771 1 15 . 1 1 121 121 THR C C 121 176.300 176.300 175.098 1.202 25153 13772 1 15 . 1 1 121 121 THR CA C 121 61.230 61.230 62.466 -1.236 25153 13773 1 15 . 1 1 121 121 THR CB C 121 69.890 69.890 68.513 1.377 25153 13774 1 15 . 1 1 121 121 THR H H 121 7.356 7.356 8.370 -1.014 25153 13775 1 15 . 1 1 122 122 GLU N N 122 123.980 123.980 121.316 2.664 25153 13776 1 15 . 1 1 122 122 GLU HA H 122 4.238 4.238 3.981 0.257 25153 13777 1 15 . 1 1 122 122 GLU C C 122 177.830 177.830 178.019 -0.189 25153 13778 1 15 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.768 0.462 25153 13779 1 15 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.853 -0.083 25153 13780 1 15 . 1 1 123 123 GLY N N 123 114.570 114.570 113.517 1.053 25153 13781 1 15 . 1 1 123 123 GLY C C 123 173.700 173.700 173.575 0.125 25153 13782 1 15 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.248 0.152 25153 13783 1 15 . 1 1 123 123 GLY H H 123 9.181 9.181 8.774 0.406 25153 13784 1 15 . 1 1 124 124 TYR N N 124 118.923 118.923 121.740 -2.817 25153 13785 1 15 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.784 0.526 25153 13786 1 15 . 1 1 124 124 TYR C C 124 175.680 175.680 175.075 0.605 25153 13787 1 15 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.887 -1.417 25153 13788 1 15 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.588 0.412 25153 13789 1 15 . 1 1 124 124 TYR H H 124 7.877 7.877 7.789 0.088 25153 13790 1 15 . 1 1 125 125 GLU N N 125 124.890 124.890 122.261 2.629 25153 13791 1 15 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.617 0.083 25153 13792 1 15 . 1 1 125 125 GLU C C 125 172.880 172.880 175.230 -2.350 25153 13793 1 15 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.394 0.036 25153 13794 1 15 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.377 0.044 25153 13795 1 15 . 1 1 126 126 PHE N N 126 119.166 119.166 119.178 -0.012 25153 13796 1 15 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.695 0.114 25153 13797 1 15 . 1 1 126 126 PHE C C 126 173.750 173.750 175.223 -1.473 25153 13798 1 15 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.336 -1.546 25153 13799 1 15 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.625 0.425 25153 13800 1 15 . 1 1 126 126 PHE H H 126 7.716 7.716 7.964 -0.248 25153 13801 1 15 . 1 1 127 127 THR N N 127 106.800 106.800 113.735 -6.935 25153 13802 1 15 . 1 1 127 127 THR HA H 127 4.400 4.400 3.406 0.994 25153 13803 1 15 . 1 1 127 127 THR C C 127 175.300 175.300 174.126 1.174 25153 13804 1 15 . 1 1 127 127 THR CA C 127 61.100 61.100 62.758 -1.657 25153 13805 1 15 . 1 1 127 127 THR CB C 127 70.600 70.600 68.181 2.418 25153 13806 1 15 . 1 1 127 127 THR H H 127 7.220 7.220 6.920 0.300 25153 13807 1 15 . 1 1 128 128 SER N N 128 118.360 118.360 116.063 2.297 25153 13808 1 15 . 1 1 128 128 SER HA H 128 4.680 4.680 4.627 0.053 25153 13809 1 15 . 1 1 128 128 SER C C 128 175.720 175.720 174.002 1.718 25153 13810 1 15 . 1 1 128 128 SER CA C 128 56.250 56.250 56.967 -0.717 25153 13811 1 15 . 1 1 128 128 SER CB C 128 65.635 65.635 64.272 1.363 25153 13812 1 15 . 1 1 128 128 SER H H 128 7.411 7.411 8.062 -0.651 25153 13813 1 15 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.604 0.171 25153 13814 1 15 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.182 -1.682 25153 13815 1 15 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.396 0.004 25153 13816 1 15 . 1 1 130 130 LYS N N 130 122.014 122.014 120.111 1.903 25153 13817 1 15 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.313 -0.080 25153 13818 1 15 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.566 3.134 25153 13819 1 15 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.923 -0.353 25153 13820 1 15 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.536 -0.018 25153 13821 1 15 . 1 1 131 131 PRO C C 131 174.000 174.000 175.105 -1.105 25153 13822 1 15 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.428 2.272 25153 13823 1 15 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.146 1.054 25153 13824 1 15 . 1 1 132 132 VAL N N 132 113.260 113.260 116.421 -3.161 25153 13825 1 15 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.881 0.319 25153 13826 1 15 . 1 1 132 132 VAL C C 132 175.210 175.210 174.757 0.453 25153 13827 1 15 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.218 -0.598 25153 13828 1 15 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.201 -1.221 25153 13829 1 15 . 1 1 132 132 VAL H H 132 6.697 6.697 7.464 -0.767 25153 13830 1 15 . 1 1 133 133 ILE N N 133 119.940 119.940 117.590 2.350 25153 13831 1 15 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.505 -0.125 25153 13832 1 15 . 1 1 133 133 ILE C C 133 175.440 175.440 175.216 0.224 25153 13833 1 15 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.025 1.425 25153 13834 1 15 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.051 2.049 25153 13835 1 15 . 1 1 133 133 ILE H H 133 8.756 8.756 8.711 0.045 25153 13836 1 15 . 1 1 134 134 ALA N N 134 122.632 122.632 123.905 -1.273 25153 13837 1 15 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.927 0.033 25153 13838 1 15 . 1 1 134 134 ALA C C 134 178.312 178.312 177.222 1.090 25153 13839 1 15 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.613 -1.533 25153 13840 1 15 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.263 -0.427 25153 13841 1 15 . 1 1 134 134 ALA H H 134 8.523 8.523 8.506 0.017 25153 13842 1 15 . 1 1 135 135 ASP N N 135 117.366 117.366 122.744 -5.378 25153 13843 1 15 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.672 -0.420 25153 13844 1 15 . 1 1 135 135 ASP C C 135 176.387 176.387 176.645 -0.258 25153 13845 1 15 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.363 1.847 25153 13846 1 15 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.239 -1.539 25153 13847 1 15 . 1 1 136 136 GLY N N 136 104.310 104.310 108.064 -3.754 25153 13848 1 15 . 1 1 136 136 GLY C C 136 174.922 174.922 174.958 -0.036 25153 13849 1 15 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.399 -0.299 25153 13850 1 15 . 1 1 136 136 GLY H H 136 7.610 7.610 8.325 -0.715 25153 13851 1 15 . 1 1 137 137 GLN N N 137 118.784 118.784 117.768 1.016 25153 13852 1 15 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.442 -0.387 25153 13853 1 15 . 1 1 137 137 GLN C C 137 176.390 176.390 175.462 0.928 25153 13854 1 15 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.854 1.786 25153 13855 1 15 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.220 0.010 25153 13856 1 15 . 1 1 137 137 GLN H H 137 7.870 7.870 7.893 -0.023 25153 13857 1 15 . 1 1 138 138 LEU N N 138 118.040 118.040 115.917 2.123 25153 13858 1 15 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.085 -0.098 25153 13859 1 15 . 1 1 138 138 LEU C C 138 175.913 175.913 175.142 0.771 25153 13860 1 15 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.233 0.367 25153 13861 1 15 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.904 1.496 25153 13862 1 15 . 1 1 138 138 LEU H H 138 7.356 7.356 7.230 0.126 25153 13863 1 15 . 1 1 139 139 PHE N N 139 119.060 119.060 119.123 -0.063 25153 13864 1 15 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.891 0.419 25153 13865 1 15 . 1 1 139 139 PHE C C 139 178.780 178.780 177.886 0.894 25153 13866 1 15 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.413 -0.562 25153 13867 1 15 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.607 3.853 25153 13868 1 15 . 1 1 139 139 PHE H H 139 10.094 10.094 8.927 1.167 25153 13869 1 15 . 1 1 140 140 VAL N N 140 109.690 109.690 116.138 -6.448 25153 13870 1 15 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.293 0.188 25153 13871 1 15 . 1 1 140 140 VAL C C 140 172.790 172.790 175.714 -2.924 25153 13872 1 15 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.818 -1.818 25153 13873 1 15 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.250 -0.700 25153 13874 1 15 . 1 1 140 140 VAL H H 140 7.470 7.470 8.198 -0.728 25153 13875 1 15 . 1 1 141 141 GLY N N 141 107.060 107.060 105.676 1.384 25153 13876 1 15 . 1 1 141 141 GLY C C 141 171.513 171.513 172.476 -0.963 25153 13877 1 15 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.424 1.006 25153 13878 1 15 . 1 1 141 141 GLY H H 141 7.137 7.137 7.389 -0.252 25153 13879 1 15 . 1 1 142 142 LEU N N 142 117.863 117.863 120.396 -2.533 25153 13880 1 15 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.105 -1.130 25153 13881 1 15 . 1 1 142 142 LEU C C 142 173.640 173.640 175.162 -1.522 25153 13882 1 15 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.853 1.067 25153 13883 1 15 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.112 -4.562 25153 13884 1 15 . 1 1 142 142 LEU H H 142 7.517 7.517 7.651 -0.134 25153 13885 1 15 . 1 1 143 143 ALA N N 143 126.990 126.990 128.688 -1.698 25153 13886 1 15 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.519 -0.242 25153 13887 1 15 . 1 1 143 143 ALA C C 143 175.730 175.730 175.697 0.033 25153 13888 1 15 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.216 -0.776 25153 13889 1 15 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.502 3.808 25153 13890 1 15 . 1 1 143 143 ALA H H 143 5.186 5.186 8.122 -2.936 25153 13891 1 15 . 1 1 144 144 LEU N N 144 125.477 125.477 122.261 3.216 25153 13892 1 15 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.767 0.013 25153 13893 1 15 . 1 1 144 144 LEU C C 144 174.473 174.473 175.299 -0.826 25153 13894 1 15 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.370 -0.130 25153 13895 1 15 . 1 1 144 144 LEU CB C 144 45.300 45.300 46.023 -0.723 25153 13896 1 15 . 1 1 144 144 LEU H H 144 8.758 8.758 7.935 0.823 25153 13897 1 15 . 1 1 145 145 ASP N N 145 118.915 118.915 119.254 -0.339 25153 13898 1 15 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.144 0.388 25153 13899 1 15 . 1 1 145 145 ASP C C 145 176.470 176.470 176.503 -0.033 25153 13900 1 15 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.836 -0.206 25153 13901 1 15 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.608 -0.608 25153 13902 1 15 . 1 1 146 146 GLU N N 146 124.813 124.813 125.868 -1.055 25153 13903 1 15 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.410 -0.034 25153 13904 1 15 . 1 1 146 146 GLU C C 146 177.290 177.290 176.150 1.140 25153 13905 1 15 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.922 0.198 25153 13906 1 15 . 1 1 146 146 GLU CB C 146 30.150 30.150 28.530 1.620 25153 13907 1 15 . 1 1 147 147 THR N N 147 118.328 118.328 113.192 5.136 25153 13908 1 15 . 1 1 147 147 THR HA H 147 4.200 4.200 4.320 -0.120 25153 13909 1 15 . 1 1 147 147 THR C C 147 175.683 175.683 174.263 1.420 25153 13910 1 15 . 1 1 147 147 THR CA C 147 66.250 66.250 62.208 4.042 25153 13911 1 15 . 1 1 147 147 THR CB C 147 69.600 69.600 69.522 0.078 25153 13912 1 15 . 1 1 147 147 THR H H 147 8.562 8.562 8.757 -0.195 25153 13913 1 15 . 1 1 148 148 ASN N N 148 115.550 115.550 117.781 -2.231 25153 13914 1 15 . 1 1 148 148 ASN HA H 148 4.987 4.987 5.078 -0.091 25153 13915 1 15 . 1 1 148 148 ASN C C 148 175.870 175.870 176.495 -0.625 25153 13916 1 15 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.302 -0.602 25153 13917 1 15 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.069 1.811 25153 13918 1 15 . 1 1 148 148 ASN H H 148 9.118 9.118 8.879 0.239 25153 13919 1 15 . 1 1 149 149 GLN N N 149 117.400 117.400 119.403 -2.003 25153 13920 1 15 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.338 0.505 25153 13921 1 15 . 1 1 149 149 GLN C C 149 177.780 177.780 177.347 0.433 25153 13922 1 15 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.579 -2.679 25153 13923 1 15 . 1 1 149 149 GLN CB C 149 29.300 29.300 27.686 1.614 25153 13924 1 15 . 1 1 149 149 GLN H H 149 7.555 7.555 8.090 -0.535 25153 13925 1 15 . 1 1 150 150 TYR N N 150 120.674 120.674 118.389 2.285 25153 13926 1 15 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.233 0.295 25153 13927 1 15 . 1 1 150 150 TYR C C 150 177.830 177.830 175.934 1.896 25153 13928 1 15 . 1 1 150 150 TYR CA C 150 58.487 58.487 59.266 -0.779 25153 13929 1 15 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.949 -0.349 25153 13930 1 15 . 1 1 150 150 TYR H H 150 6.983 6.983 7.724 -0.741 25153 13931 1 15 . 1 1 151 151 ASP N N 151 120.810 120.810 119.059 1.751 25153 13932 1 15 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.202 0.314 25153 13933 1 15 . 1 1 151 151 ASP C C 151 176.400 176.400 176.931 -0.531 25153 13934 1 15 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.140 0.260 25153 13935 1 15 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.117 -2.037 25153 13936 1 15 . 1 1 152 152 LEU N N 152 118.083 118.083 114.593 3.490 25153 13937 1 15 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.688 -0.012 25153 13938 1 15 . 1 1 152 152 LEU C C 152 178.470 178.470 178.364 0.106 25153 13939 1 15 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.602 -1.002 25153 13940 1 15 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.235 -0.635 25153 13941 1 15 . 1 1 152 152 LEU H H 152 7.453 7.453 7.757 -0.304 25153 13942 1 15 . 1 1 153 153 SER N N 153 116.407 116.407 118.860 -2.453 25153 13943 1 15 . 1 1 153 153 SER HA H 153 3.960 3.960 3.983 -0.023 25153 13944 1 15 . 1 1 153 153 SER C C 153 174.590 174.590 175.616 -1.026 25153 13945 1 15 . 1 1 153 153 SER CA C 153 63.400 63.400 63.165 0.235 25153 13946 1 15 . 1 1 153 153 SER CB C 153 63.100 63.100 62.748 0.352 25153 13947 1 15 . 1 1 153 153 SER H H 153 7.360 7.360 8.533 -1.173 25153 13948 1 15 . 1 1 154 154 ASP N N 154 121.960 121.960 120.943 1.017 25153 13949 1 15 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.325 -0.015 25153 13950 1 15 . 1 1 154 154 ASP C C 154 178.640 178.640 177.957 0.683 25153 13951 1 15 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.283 1.717 25153 13952 1 15 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.868 -1.298 25153 13953 1 15 . 1 1 155 155 GLU N N 155 121.310 121.310 118.337 2.973 25153 13954 1 15 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.104 0.081 25153 13955 1 15 . 1 1 155 155 GLU C C 155 179.600 179.600 178.917 0.683 25153 13956 1 15 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.148 0.302 25153 13957 1 15 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.424 -0.024 25153 13958 1 15 . 1 1 156 156 ARG N N 156 121.394 121.394 119.553 1.841 25153 13959 1 15 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.628 -0.328 25153 13960 1 15 . 1 1 156 156 ARG C C 156 177.330 177.330 178.639 -1.309 25153 13961 1 15 . 1 1 156 156 ARG CA C 156 60.460 60.460 55.983 4.476 25153 13962 1 15 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.852 0.908 25153 13963 1 15 . 1 1 157 157 ILE N N 157 118.390 118.390 122.084 -3.694 25153 13964 1 15 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.760 -0.326 25153 13965 1 15 . 1 1 157 157 ILE C C 157 178.814 178.814 177.417 1.397 25153 13966 1 15 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.263 0.431 25153 13967 1 15 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.931 0.922 25153 13968 1 15 . 1 1 157 157 ILE H H 157 8.966 8.966 8.324 0.642 25153 13969 1 15 . 1 1 158 158 GLN N N 158 120.060 120.060 119.163 0.897 25153 13970 1 15 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.970 -0.014 25153 13971 1 15 . 1 1 158 158 GLN C C 158 178.843 178.843 178.470 0.373 25153 13972 1 15 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.231 1.369 25153 13973 1 15 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.249 0.141 25153 13974 1 15 . 1 1 158 158 GLN H H 158 8.394 8.394 7.962 0.432 25153 13975 1 15 . 1 1 159 159 SER N N 159 115.613 115.613 115.762 -0.149 25153 13976 1 15 . 1 1 159 159 SER HA H 159 4.455 4.455 4.335 0.120 25153 13977 1 15 . 1 1 159 159 SER C C 159 177.330 177.330 176.676 0.654 25153 13978 1 15 . 1 1 159 159 SER CA C 159 62.400 62.400 61.092 1.308 25153 13979 1 15 . 1 1 159 159 SER CB C 159 63.760 63.760 62.930 0.830 25153 13980 1 15 . 1 1 159 159 SER H H 159 8.460 8.460 7.912 0.548 25153 13981 1 15 . 1 1 160 160 TRP N N 160 126.820 126.820 125.365 1.455 25153 13982 1 15 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.057 0.408 25153 13983 1 15 . 1 1 160 160 TRP C C 160 178.050 178.050 177.849 0.201 25153 13984 1 15 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.706 0.994 25153 13985 1 15 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.265 0.095 25153 13986 1 15 . 1 1 160 160 TRP H H 160 9.318 9.318 7.658 1.660 25153 13987 1 15 . 1 1 161 161 CYS N N 161 116.750 116.750 117.619 -0.869 25153 13988 1 15 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.775 0.108 25153 13989 1 15 . 1 1 161 161 CYS C C 161 176.270 176.270 176.585 -0.315 25153 13990 1 15 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.407 0.953 25153 13991 1 15 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.847 1.033 25153 13992 1 15 . 1 1 161 161 CYS H H 161 8.950 8.950 9.008 -0.058 25153 13993 1 15 . 1 1 162 162 GLU N N 162 118.096 118.096 120.051 -1.955 25153 13994 1 15 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.118 -0.188 25153 13995 1 15 . 1 1 162 162 GLU C C 162 178.680 178.680 177.489 1.191 25153 13996 1 15 . 1 1 162 162 GLU CA C 162 59.730 59.730 58.873 0.857 25153 13997 1 15 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.157 0.273 25153 13998 1 15 . 1 1 163 163 GLN N N 163 120.790 120.790 117.663 3.127 25153 13999 1 15 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.122 0.055 25153 14000 1 15 . 1 1 163 163 GLN C C 163 179.690 179.690 178.133 1.557 25153 14001 1 15 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.745 1.796 25153 14002 1 15 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.921 0.079 25153 14003 1 15 . 1 1 163 163 GLN H H 163 8.205 8.205 7.530 0.675 25153 14004 1 15 . 1 1 164 164 ILE N N 164 114.860 114.860 118.811 -3.951 25153 14005 1 15 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.868 0.175 25153 14006 1 15 . 1 1 164 164 ILE C C 164 178.680 178.680 177.235 1.445 25153 14007 1 15 . 1 1 164 164 ILE CA C 164 66.210 66.210 63.995 2.215 25153 14008 1 15 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.587 0.113 25153 14009 1 15 . 1 1 164 164 ILE H H 164 9.005 9.005 8.007 0.998 25153 14010 1 15 . 1 1 165 165 LEU N N 165 123.900 123.900 116.902 6.998 25153 14011 1 15 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.223 -0.073 25153 14012 1 15 . 1 1 165 165 LEU C C 165 180.520 180.520 177.642 2.878 25153 14013 1 15 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.044 1.256 25153 14014 1 15 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.051 -0.001 25153 14015 1 15 . 1 1 165 165 LEU H H 165 7.825 7.825 7.976 -0.151 25153 14016 1 15 . 1 1 166 166 ASN N N 166 120.112 120.112 118.373 1.739 25153 14017 1 15 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.646 -0.063 25153 14018 1 15 . 1 1 166 166 ASN C C 166 178.440 178.440 177.141 1.299 25153 14019 1 15 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.432 0.988 25153 14020 1 15 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.490 -1.071 25153 14021 1 15 . 1 1 166 166 ASN H H 166 7.760 7.760 8.035 -0.275 25153 14022 1 15 . 1 1 167 167 GLU N N 167 121.370 121.370 120.168 1.202 25153 14023 1 15 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.061 0.042 25153 14024 1 15 . 1 1 167 167 GLU C C 167 180.332 180.332 178.620 1.712 25153 14025 1 15 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.109 1.040 25153 14026 1 15 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.569 1.452 25153 14027 1 15 . 1 1 168 168 MET N N 168 118.532 118.532 116.660 1.872 25153 14028 1 15 . 1 1 168 168 MET HA H 168 4.015 4.015 4.451 -0.436 25153 14029 1 15 . 1 1 168 168 MET C C 168 176.600 176.600 177.621 -1.021 25153 14030 1 15 . 1 1 168 168 MET CA C 168 59.300 59.300 58.405 0.895 25153 14031 1 15 . 1 1 168 168 MET CB C 168 33.400 33.400 33.316 0.084 25153 14032 1 15 . 1 1 168 168 MET H H 168 8.718 8.718 8.325 0.393 25153 14033 1 15 . 1 1 169 169 ALA N N 169 121.922 121.922 121.731 0.191 25153 14034 1 15 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.260 -0.086 25153 14035 1 15 . 1 1 169 169 ALA C C 169 179.410 179.410 179.190 0.220 25153 14036 1 15 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.417 -0.017 25153 14037 1 15 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.637 -0.227 25153 14038 1 15 . 1 1 169 169 ALA H H 169 7.448 7.448 7.801 -0.353 25153 14039 1 15 . 1 1 170 170 GLU N N 170 117.300 117.300 116.815 0.485 25153 14040 1 15 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.119 -0.024 25153 14041 1 15 . 1 1 170 170 GLU C C 170 177.470 177.470 179.489 -2.019 25153 14042 1 15 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.739 -0.789 25153 14043 1 15 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.361 0.414 25153 14044 1 15 . 1 1 171 171 HIS N N 171 117.944 117.944 119.843 -1.899 25153 14045 1 15 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.334 0.166 25153 14046 1 15 . 1 1 171 171 HIS C C 171 175.120 175.120 176.591 -1.471 25153 14047 1 15 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.221 -2.021 25153 14048 1 15 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.931 0.669 25153 14049 1 15 . 1 1 171 171 HIS H H 171 7.788 7.788 8.073 -0.285 25153 14050 1 15 . 1 1 172 172 TYR N N 172 120.040 120.040 117.250 2.790 25153 14051 1 15 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.555 0.038 25153 14052 1 15 . 1 1 172 172 TYR C C 172 174.612 174.612 175.234 -0.622 25153 14053 1 15 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.169 -0.189 25153 14054 1 15 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.793 0.187 25153 14055 1 15 . 1 1 172 172 TYR H H 172 7.820 7.820 7.924 -0.104 25153 14056 1 16 . 1 1 2 2 ASN N N 2 123.320 123.320 119.806 3.514 25153 14057 1 16 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.117 0.091 25153 14058 1 16 . 1 1 2 2 ASN C C 2 174.590 174.590 174.497 0.093 25153 14059 1 16 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.832 0.168 25153 14060 1 16 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.329 -0.359 25153 14061 1 16 . 1 1 2 2 ASN H H 2 9.428 9.428 8.646 0.782 25153 14062 1 16 . 1 1 3 3 MET N N 3 120.920 120.920 118.823 2.097 25153 14063 1 16 . 1 1 3 3 MET HA H 3 5.530 5.530 5.318 0.212 25153 14064 1 16 . 1 1 3 3 MET C C 3 174.400 174.400 174.905 -0.505 25153 14065 1 16 . 1 1 3 3 MET CA C 3 54.643 54.643 54.310 0.333 25153 14066 1 16 . 1 1 3 3 MET CB C 3 34.637 34.637 37.720 -3.083 25153 14067 1 16 . 1 1 3 3 MET H H 3 8.751 8.751 9.140 -0.389 25153 14068 1 16 . 1 1 4 4 GLY N N 4 115.542 115.542 109.109 6.433 25153 14069 1 16 . 1 1 4 4 GLY C C 4 170.413 170.413 172.135 -1.722 25153 14070 1 16 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.805 -0.703 25153 14071 1 16 . 1 1 4 4 GLY H H 4 8.927 8.927 8.813 0.114 25153 14072 1 16 . 1 1 5 5 LEU N N 5 131.030 131.030 128.321 2.709 25153 14073 1 16 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.170 1.232 25153 14074 1 16 . 1 1 5 5 LEU C C 5 175.952 175.952 174.654 1.298 25153 14075 1 16 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.281 1.169 25153 14076 1 16 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.238 3.354 25153 14077 1 16 . 1 1 5 5 LEU H H 5 8.928 8.928 8.587 0.341 25153 14078 1 16 . 1 1 6 6 PHE N N 6 125.790 125.790 126.279 -0.489 25153 14079 1 16 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.756 -0.016 25153 14080 1 16 . 1 1 6 6 PHE C C 6 174.300 174.300 176.114 -1.814 25153 14081 1 16 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.563 -1.243 25153 14082 1 16 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.003 0.227 25153 14083 1 16 . 1 1 6 6 PHE H H 6 9.237 9.237 9.410 -0.173 25153 14084 1 16 . 1 1 7 7 TYR N N 7 117.289 117.289 116.484 0.805 25153 14085 1 16 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.843 0.122 25153 14086 1 16 . 1 1 7 7 TYR C C 7 171.262 171.262 173.438 -2.176 25153 14087 1 16 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.467 -1.067 25153 14088 1 16 . 1 1 7 7 TYR CB C 7 41.240 41.240 40.796 0.444 25153 14089 1 16 . 1 1 7 7 TYR H H 7 8.125 8.125 8.246 -0.121 25153 14090 1 16 . 1 1 8 8 GLY N N 8 107.420 107.420 106.558 0.862 25153 14091 1 16 . 1 1 8 8 GLY C C 8 172.000 172.000 172.336 -0.336 25153 14092 1 16 . 1 1 8 8 GLY CA C 8 43.944 43.944 43.993 -0.049 25153 14093 1 16 . 1 1 8 8 GLY H H 8 7.031 7.031 8.665 -1.634 25153 14094 1 16 . 1 1 9 9 SER N N 9 118.150 118.150 118.380 -0.230 25153 14095 1 16 . 1 1 9 9 SER HA H 9 5.200 5.200 5.128 0.072 25153 14096 1 16 . 1 1 9 9 SER C C 9 175.000 175.000 173.290 1.710 25153 14097 1 16 . 1 1 9 9 SER CA C 9 57.570 57.570 57.755 -0.185 25153 14098 1 16 . 1 1 9 9 SER CB C 9 66.700 66.700 65.257 1.443 25153 14099 1 16 . 1 1 9 9 SER H H 9 9.604 9.604 8.114 1.490 25153 14100 1 16 . 1 1 10 10 SER N N 10 131.193 131.193 120.007 11.186 25153 14101 1 16 . 1 1 10 10 SER HA H 10 4.775 4.775 4.841 -0.066 25153 14102 1 16 . 1 1 10 10 SER C C 10 175.730 175.730 175.745 -0.015 25153 14103 1 16 . 1 1 10 10 SER CA C 10 61.750 61.750 58.843 2.907 25153 14104 1 16 . 1 1 10 10 SER CB C 10 64.400 64.400 63.712 0.688 25153 14105 1 16 . 1 1 10 10 SER H H 10 11.636 11.636 9.070 2.566 25153 14106 1 16 . 1 1 11 11 THR N N 11 115.848 115.848 114.049 1.799 25153 14107 1 16 . 1 1 11 11 THR HA H 11 4.770 4.770 4.360 0.410 25153 14108 1 16 . 1 1 11 11 THR C C 11 173.700 173.700 174.501 -0.801 25153 14109 1 16 . 1 1 11 11 THR CA C 11 60.700 60.700 63.049 -2.349 25153 14110 1 16 . 1 1 11 11 THR CB C 11 67.430 67.430 68.970 -1.540 25153 14111 1 16 . 1 1 11 11 THR H H 11 9.550 9.550 8.519 1.031 25153 14112 1 16 . 1 1 12 12 CYS N N 12 109.780 109.780 117.850 -8.070 25153 14113 1 16 . 1 1 12 12 CYS HA H 12 4.070 4.070 3.936 0.134 25153 14114 1 16 . 1 1 12 12 CYS C C 12 176.220 176.220 175.883 0.337 25153 14115 1 16 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.357 3.243 25153 14116 1 16 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.793 0.607 25153 14117 1 16 . 1 1 12 12 CYS H H 12 7.437 7.437 7.967 -0.530 25153 14118 1 16 . 1 1 13 13 TYR N N 13 127.830 127.830 119.570 8.260 25153 14119 1 16 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.211 -0.108 25153 14120 1 16 . 1 1 13 13 TYR C C 13 180.880 180.880 178.115 2.765 25153 14121 1 16 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.828 3.272 25153 14122 1 16 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.502 -0.666 25153 14123 1 16 . 1 1 13 13 TYR H H 13 10.886 10.886 8.086 2.800 25153 14124 1 16 . 1 1 14 14 THR N N 14 124.428 124.428 113.497 10.931 25153 14125 1 16 . 1 1 14 14 THR HA H 14 4.160 4.160 4.079 0.081 25153 14126 1 16 . 1 1 14 14 THR C C 14 177.760 177.760 176.372 1.388 25153 14127 1 16 . 1 1 14 14 THR CA C 14 67.823 67.823 65.925 1.898 25153 14128 1 16 . 1 1 14 14 THR CB C 14 68.040 68.040 68.567 -0.527 25153 14129 1 16 . 1 1 14 14 THR H H 14 11.405 11.405 8.132 3.273 25153 14130 1 16 . 1 1 15 15 GLU N N 15 123.050 123.050 123.119 -0.069 25153 14131 1 16 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.262 -0.372 25153 14132 1 16 . 1 1 15 15 GLU C C 15 176.392 176.392 178.376 -1.984 25153 14133 1 16 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.241 -0.041 25153 14134 1 16 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.356 1.094 25153 14135 1 16 . 1 1 16 16 MET N N 16 120.173 120.173 118.518 1.655 25153 14136 1 16 . 1 1 16 16 MET HA H 16 4.050 4.050 4.110 -0.060 25153 14137 1 16 . 1 1 16 16 MET C C 16 179.940 179.940 178.635 1.305 25153 14138 1 16 . 1 1 16 16 MET CA C 16 59.240 59.240 59.273 -0.033 25153 14139 1 16 . 1 1 16 16 MET CB C 16 32.970 32.970 32.809 0.161 25153 14140 1 16 . 1 1 16 16 MET H H 16 8.469 8.469 8.437 0.032 25153 14141 1 16 . 1 1 17 17 ALA N N 17 121.930 121.930 121.595 0.335 25153 14142 1 16 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.837 -0.001 25153 14143 1 16 . 1 1 17 17 ALA C C 17 177.900 177.900 178.680 -0.780 25153 14144 1 16 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.113 0.087 25153 14145 1 16 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.062 -0.062 25153 14146 1 16 . 1 1 17 17 ALA H H 17 7.880 7.880 7.890 -0.010 25153 14147 1 16 . 1 1 18 18 ALA N N 18 121.477 121.477 121.420 0.057 25153 14148 1 16 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.708 0.029 25153 14149 1 16 . 1 1 18 18 ALA C C 18 179.380 179.380 179.377 0.003 25153 14150 1 16 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.100 -0.100 25153 14151 1 16 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.734 1.096 25153 14152 1 16 . 1 1 18 18 ALA H H 18 7.374 7.374 7.930 -0.556 25153 14153 1 16 . 1 1 19 19 GLU N N 19 116.650 116.650 118.154 -1.504 25153 14154 1 16 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.815 -0.199 25153 14155 1 16 . 1 1 19 19 GLU C C 19 178.479 178.479 179.293 -0.814 25153 14156 1 16 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.577 0.153 25153 14157 1 16 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.374 -0.074 25153 14158 1 16 . 1 1 20 20 LYS N N 20 119.470 119.470 119.700 -0.230 25153 14159 1 16 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.011 0.039 25153 14160 1 16 . 1 1 20 20 LYS C C 20 179.116 179.116 179.066 0.050 25153 14161 1 16 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.428 0.402 25153 14162 1 16 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.429 0.421 25153 14163 1 16 . 1 1 21 21 ILE N N 21 121.030 121.030 120.783 0.247 25153 14164 1 16 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.684 -0.294 25153 14165 1 16 . 1 1 21 21 ILE C C 21 177.580 177.580 178.176 -0.596 25153 14166 1 16 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.772 0.048 25153 14167 1 16 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.893 0.455 25153 14168 1 16 . 1 1 21 21 ILE H H 21 8.100 8.100 8.543 -0.443 25153 14169 1 16 . 1 1 22 22 ARG N N 22 119.720 119.720 119.533 0.187 25153 14170 1 16 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.835 -0.280 25153 14171 1 16 . 1 1 22 22 ARG C C 22 177.320 177.320 178.133 -0.813 25153 14172 1 16 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.719 0.001 25153 14173 1 16 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.695 -0.763 25153 14174 1 16 . 1 1 23 23 ASP N N 23 118.730 118.730 119.261 -0.531 25153 14175 1 16 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.411 -0.048 25153 14176 1 16 . 1 1 23 23 ASP C C 23 178.330 178.330 178.791 -0.461 25153 14177 1 16 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.347 -0.397 25153 14178 1 16 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.856 -0.616 25153 14179 1 16 . 1 1 24 24 ILE N N 24 121.090 121.090 119.552 1.538 25153 14180 1 16 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.777 0.019 25153 14181 1 16 . 1 1 24 24 ILE C C 24 178.250 178.250 177.957 0.293 25153 14182 1 16 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.839 -0.689 25153 14183 1 16 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.283 0.197 25153 14184 1 16 . 1 1 24 24 ILE H H 24 7.910 7.910 8.282 -0.372 25153 14185 1 16 . 1 1 25 25 ILE N N 25 121.406 121.406 117.373 4.033 25153 14186 1 16 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.862 -0.216 25153 14187 1 16 . 1 1 25 25 ILE C C 25 176.800 176.800 176.775 0.025 25153 14188 1 16 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.094 2.606 25153 14189 1 16 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.909 -0.719 25153 14190 1 16 . 1 1 25 25 ILE H H 25 8.476 8.476 8.124 0.352 25153 14191 1 16 . 1 1 26 26 GLY N N 26 108.900 108.900 105.040 3.860 25153 14192 1 16 . 1 1 26 26 GLY C C 26 173.710 173.710 172.253 1.457 25153 14193 1 16 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.693 -0.363 25153 14194 1 16 . 1 1 26 26 GLY H H 26 8.016 8.016 7.793 0.223 25153 14195 1 16 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.711 -0.373 25153 14196 1 16 . 1 1 27 27 PRO C C 27 177.200 177.200 177.180 0.020 25153 14197 1 16 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.522 1.164 25153 14198 1 16 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.032 0.168 25153 14199 1 16 . 1 1 28 28 GLU N N 28 116.295 116.295 117.940 -1.645 25153 14200 1 16 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.209 0.061 25153 14201 1 16 . 1 1 28 28 GLU C C 28 176.980 176.980 177.285 -0.305 25153 14202 1 16 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.169 -0.429 25153 14203 1 16 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.596 -0.926 25153 14204 1 16 . 1 1 29 29 LEU N N 29 120.250 120.250 112.129 8.121 25153 14205 1 16 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.697 -0.061 25153 14206 1 16 . 1 1 29 29 LEU C C 29 175.770 175.770 175.649 0.121 25153 14207 1 16 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.077 0.723 25153 14208 1 16 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.034 1.066 25153 14209 1 16 . 1 1 29 29 LEU H H 29 7.940 7.940 7.567 0.373 25153 14210 1 16 . 1 1 30 30 VAL N N 30 118.693 118.693 120.671 -1.978 25153 14211 1 16 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.826 -0.178 25153 14212 1 16 . 1 1 30 30 VAL C C 30 174.347 174.347 175.765 -1.418 25153 14213 1 16 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.429 -0.561 25153 14214 1 16 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.135 1.445 25153 14215 1 16 . 1 1 30 30 VAL H H 30 7.434 7.434 8.026 -0.592 25153 14216 1 16 . 1 1 31 31 THR N N 31 123.800 123.800 121.469 2.331 25153 14217 1 16 . 1 1 31 31 THR HA H 31 4.362 4.362 4.537 -0.175 25153 14218 1 16 . 1 1 31 31 THR C C 31 172.964 172.964 173.282 -0.318 25153 14219 1 16 . 1 1 31 31 THR CA C 31 61.720 61.720 60.841 0.879 25153 14220 1 16 . 1 1 31 31 THR CB C 31 70.485 70.485 70.770 -0.285 25153 14221 1 16 . 1 1 31 31 THR H H 31 7.844 7.844 8.164 -0.320 25153 14222 1 16 . 1 1 32 32 LEU N N 32 127.800 127.800 127.043 0.757 25153 14223 1 16 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.551 0.133 25153 14224 1 16 . 1 1 32 32 LEU C C 32 176.600 176.600 176.493 0.107 25153 14225 1 16 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.138 0.017 25153 14226 1 16 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.650 1.200 25153 14227 1 16 . 1 1 32 32 LEU H H 32 8.660 8.660 8.575 0.085 25153 14228 1 16 . 1 1 33 33 HIS N N 33 119.670 119.670 119.927 -0.257 25153 14229 1 16 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.630 -0.230 25153 14230 1 16 . 1 1 33 33 HIS C C 33 171.667 171.667 173.076 -1.409 25153 14231 1 16 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.787 0.413 25153 14232 1 16 . 1 1 33 33 HIS CB C 33 32.200 32.200 32.132 0.068 25153 14233 1 16 . 1 1 33 33 HIS H H 33 9.060 9.060 8.421 0.639 25153 14234 1 16 . 1 1 34 34 ASN N N 34 124.068 124.068 123.457 0.611 25153 14235 1 16 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.088 -0.654 25153 14236 1 16 . 1 1 34 34 ASN C C 34 178.000 178.000 176.109 1.891 25153 14237 1 16 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.969 -0.540 25153 14238 1 16 . 1 1 34 34 ASN CB C 34 38.560 38.560 38.674 -0.114 25153 14239 1 16 . 1 1 34 34 ASN H H 34 8.780 8.780 8.594 0.186 25153 14240 1 16 . 1 1 35 35 LEU N N 35 129.040 129.040 126.659 2.381 25153 14241 1 16 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.265 0.050 25153 14242 1 16 . 1 1 35 35 LEU C C 35 177.700 177.700 177.518 0.182 25153 14243 1 16 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.350 0.130 25153 14244 1 16 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.892 1.408 25153 14245 1 16 . 1 1 35 35 LEU H H 35 8.821 8.821 8.592 0.229 25153 14246 1 16 . 1 1 36 36 LYS N N 36 121.043 121.043 115.908 5.135 25153 14247 1 16 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.154 -0.274 25153 14248 1 16 . 1 1 36 36 LYS C C 36 176.230 176.230 177.224 -0.994 25153 14249 1 16 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.470 0.950 25153 14250 1 16 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.574 0.696 25153 14251 1 16 . 1 1 37 37 ASP N N 37 114.965 114.965 119.025 -4.060 25153 14252 1 16 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.697 0.080 25153 14253 1 16 . 1 1 37 37 ASP C C 37 175.440 175.440 175.383 0.057 25153 14254 1 16 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.473 0.238 25153 14255 1 16 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.599 1.101 25153 14256 1 16 . 1 1 38 38 ASP N N 38 121.650 121.650 120.555 1.095 25153 14257 1 16 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.774 0.096 25153 14258 1 16 . 1 1 38 38 ASP C C 38 174.852 174.852 175.951 -1.099 25153 14259 1 16 . 1 1 38 38 ASP CA C 38 53.080 53.080 53.446 -0.365 25153 14260 1 16 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.828 -0.718 25153 14261 1 16 . 1 1 39 39 SER N N 39 115.207 115.207 116.030 -0.823 25153 14262 1 16 . 1 1 39 39 SER HA H 39 4.585 4.585 4.725 -0.140 25153 14263 1 16 . 1 1 39 39 SER C C 39 175.040 175.040 174.318 0.722 25153 14264 1 16 . 1 1 39 39 SER CA C 39 54.960 54.960 55.017 -0.057 25153 14265 1 16 . 1 1 39 39 SER CB C 39 64.720 64.720 64.031 0.689 25153 14266 1 16 . 1 1 39 39 SER H H 39 8.351 8.351 8.499 -0.148 25153 14267 1 16 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.196 -0.191 25153 14268 1 16 . 1 1 40 40 PRO C C 40 176.730 176.730 178.105 -1.375 25153 14269 1 16 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.817 0.083 25153 14270 1 16 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.923 -0.523 25153 14271 1 16 . 1 1 41 41 LYS N N 41 121.150 121.150 119.832 1.318 25153 14272 1 16 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.976 -0.064 25153 14273 1 16 . 1 1 41 41 LYS C C 41 179.600 179.600 178.980 0.620 25153 14274 1 16 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.369 -1.169 25153 14275 1 16 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.611 0.389 25153 14276 1 16 . 1 1 42 42 LEU N N 42 118.103 118.103 115.636 2.467 25153 14277 1 16 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.155 -0.118 25153 14278 1 16 . 1 1 42 42 LEU C C 42 178.760 178.760 178.839 -0.079 25153 14279 1 16 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.607 -0.427 25153 14280 1 16 . 1 1 42 42 LEU CB C 42 41.973 41.973 41.188 0.785 25153 14281 1 16 . 1 1 42 42 LEU H H 42 7.600 7.600 7.629 -0.029 25153 14282 1 16 . 1 1 43 43 MET N N 43 118.917 118.917 116.884 2.033 25153 14283 1 16 . 1 1 43 43 MET HA H 43 3.750 3.750 4.457 -0.707 25153 14284 1 16 . 1 1 43 43 MET C C 43 177.680 177.680 176.899 0.781 25153 14285 1 16 . 1 1 43 43 MET CA C 43 59.730 59.730 57.943 1.787 25153 14286 1 16 . 1 1 43 43 MET CB C 43 32.700 32.700 31.793 0.907 25153 14287 1 16 . 1 1 43 43 MET H H 43 8.202 8.202 7.932 0.270 25153 14288 1 16 . 1 1 44 44 GLU N N 44 110.924 110.924 117.636 -6.712 25153 14289 1 16 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.232 -0.492 25153 14290 1 16 . 1 1 44 44 GLU C C 44 178.130 178.130 179.028 -0.898 25153 14291 1 16 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.198 1.202 25153 14292 1 16 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.887 -0.337 25153 14293 1 16 . 1 1 45 45 GLN N N 45 115.756 115.756 118.557 -2.801 25153 14294 1 16 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.036 0.147 25153 14295 1 16 . 1 1 45 45 GLN C C 45 175.414 175.414 177.228 -1.814 25153 14296 1 16 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.630 -1.450 25153 14297 1 16 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.080 -0.480 25153 14298 1 16 . 1 1 45 45 GLN H H 45 7.516 7.516 7.550 -0.034 25153 14299 1 16 . 1 1 46 46 TYR N N 46 117.860 117.860 118.649 -0.789 25153 14300 1 16 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.348 0.315 25153 14301 1 16 . 1 1 46 46 TYR C C 46 175.500 175.500 177.124 -1.624 25153 14302 1 16 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.613 -1.127 25153 14303 1 16 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.361 3.109 25153 14304 1 16 . 1 1 46 46 TYR H H 46 6.996 6.996 7.261 -0.265 25153 14305 1 16 . 1 1 47 47 ASP N N 47 121.683 121.683 120.775 0.908 25153 14306 1 16 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.658 0.042 25153 14307 1 16 . 1 1 47 47 ASP C C 47 175.610 175.610 175.520 0.090 25153 14308 1 16 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.620 -0.920 25153 14309 1 16 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.063 0.937 25153 14310 1 16 . 1 1 48 48 VAL N N 48 118.628 118.628 116.279 2.349 25153 14311 1 16 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.789 0.245 25153 14312 1 16 . 1 1 48 48 VAL C C 48 174.190 174.190 173.879 0.311 25153 14313 1 16 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.115 -0.925 25153 14314 1 16 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.894 0.206 25153 14315 1 16 . 1 1 48 48 VAL H H 48 7.628 7.628 7.408 0.220 25153 14316 1 16 . 1 1 49 49 LEU N N 49 128.190 128.190 124.128 4.062 25153 14317 1 16 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.455 0.148 25153 14318 1 16 . 1 1 49 49 LEU C C 49 174.880 174.880 175.711 -0.831 25153 14319 1 16 . 1 1 49 49 LEU CA C 49 52.240 52.240 52.550 -0.310 25153 14320 1 16 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.752 -0.412 25153 14321 1 16 . 1 1 49 49 LEU H H 49 9.407 9.407 9.054 0.353 25153 14322 1 16 . 1 1 50 50 ILE N N 50 124.550 124.550 120.426 4.124 25153 14323 1 16 . 1 1 50 50 ILE HA H 50 5.700 5.700 4.947 0.753 25153 14324 1 16 . 1 1 50 50 ILE C C 50 175.300 175.300 174.654 0.646 25153 14325 1 16 . 1 1 50 50 ILE CA C 50 59.864 59.864 61.061 -1.197 25153 14326 1 16 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.735 -0.485 25153 14327 1 16 . 1 1 50 50 ILE H H 50 9.238 9.238 9.128 0.110 25153 14328 1 16 . 1 1 51 51 LEU N N 51 127.460 127.460 127.870 -0.410 25153 14329 1 16 . 1 1 51 51 LEU HA H 51 6.185 6.185 6.012 0.173 25153 14330 1 16 . 1 1 51 51 LEU C C 51 174.544 174.544 176.156 -1.612 25153 14331 1 16 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.264 -0.444 25153 14332 1 16 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.424 -2.787 25153 14333 1 16 . 1 1 51 51 LEU H H 51 9.228 9.228 9.025 0.203 25153 14334 1 16 . 1 1 52 52 GLY N N 52 107.760 107.760 109.301 -1.541 25153 14335 1 16 . 1 1 52 52 GLY C C 52 174.710 174.710 172.055 2.655 25153 14336 1 16 . 1 1 52 52 GLY CA C 52 43.870 43.870 44.590 -0.720 25153 14337 1 16 . 1 1 52 52 GLY H H 52 8.860 8.860 8.413 0.447 25153 14338 1 16 . 1 1 53 53 ILE N N 53 123.890 123.890 116.242 7.648 25153 14339 1 16 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.880 0.390 25153 14340 1 16 . 1 1 53 53 ILE C C 53 172.630 172.630 173.078 -0.448 25153 14341 1 16 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.900 -0.220 25153 14342 1 16 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.694 3.466 25153 14343 1 16 . 1 1 53 53 ILE H H 53 8.458 8.458 7.827 0.631 25153 14344 1 16 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.779 0.609 25153 14345 1 16 . 1 1 54 54 PRO C C 54 175.000 175.000 176.340 -1.340 25153 14346 1 16 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.584 0.016 25153 14347 1 16 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.764 -0.464 25153 14348 1 16 . 1 1 55 55 THR N N 55 112.754 112.754 119.624 -6.870 25153 14349 1 16 . 1 1 55 55 THR HA H 55 4.452 4.452 4.564 -0.112 25153 14350 1 16 . 1 1 55 55 THR C C 55 172.480 172.480 174.253 -1.773 25153 14351 1 16 . 1 1 55 55 THR CA C 55 62.350 62.350 63.240 -0.890 25153 14352 1 16 . 1 1 55 55 THR CB C 55 70.230 70.230 68.812 1.418 25153 14353 1 16 . 1 1 55 55 THR H H 55 6.523 6.523 8.266 -1.743 25153 14354 1 16 . 1 1 56 56 TRP N N 56 130.044 130.044 127.244 2.800 25153 14355 1 16 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.470 -1.755 25153 14356 1 16 . 1 1 56 56 TRP C C 56 172.890 172.890 175.674 -2.784 25153 14357 1 16 . 1 1 56 56 TRP CA C 56 56.650 56.650 57.046 -0.396 25153 14358 1 16 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.528 2.472 25153 14359 1 16 . 1 1 56 56 TRP H H 56 8.450 8.450 8.534 -0.084 25153 14360 1 16 . 1 1 57 57 ASP N N 57 115.275 115.275 120.686 -5.411 25153 14361 1 16 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.056 0.296 25153 14362 1 16 . 1 1 57 57 ASP C C 57 173.660 173.660 175.062 -1.402 25153 14363 1 16 . 1 1 57 57 ASP CA C 57 56.230 56.230 54.969 1.261 25153 14364 1 16 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.773 0.397 25153 14365 1 16 . 1 1 58 58 PHE N N 58 112.840 112.840 117.023 -4.183 25153 14366 1 16 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.680 -0.356 25153 14367 1 16 . 1 1 58 58 PHE C C 58 175.730 175.730 175.199 0.531 25153 14368 1 16 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.424 0.399 25153 14369 1 16 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.837 -2.083 25153 14370 1 16 . 1 1 58 58 PHE H H 58 7.640 7.640 7.769 -0.129 25153 14371 1 16 . 1 1 59 59 GLY N N 59 104.940 104.940 105.253 -0.313 25153 14372 1 16 . 1 1 59 59 GLY C C 59 173.750 173.750 174.943 -1.193 25153 14373 1 16 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.431 0.860 25153 14374 1 16 . 1 1 59 59 GLY H H 59 8.024 8.024 8.648 -0.624 25153 14375 1 16 . 1 1 60 60 GLU N N 60 120.045 120.045 119.711 0.334 25153 14376 1 16 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.413 -0.000 25153 14377 1 16 . 1 1 60 60 GLU C C 60 176.050 176.050 176.070 -0.020 25153 14378 1 16 . 1 1 60 60 GLU CA C 60 54.620 54.620 56.020 -1.400 25153 14379 1 16 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.048 -0.438 25153 14380 1 16 . 1 1 61 61 ILE N N 61 120.790 120.790 121.619 -0.829 25153 14381 1 16 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.061 -0.594 25153 14382 1 16 . 1 1 61 61 ILE C C 61 175.130 175.130 176.277 -1.147 25153 14383 1 16 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.494 0.053 25153 14384 1 16 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.808 0.042 25153 14385 1 16 . 1 1 61 61 ILE H H 61 8.200 8.200 8.359 -0.159 25153 14386 1 16 . 1 1 62 62 GLN N N 62 124.520 124.520 123.525 0.995 25153 14387 1 16 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.274 -0.318 25153 14388 1 16 . 1 1 62 62 GLN C C 62 177.160 177.160 176.874 0.286 25153 14389 1 16 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.629 0.981 25153 14390 1 16 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.619 -2.969 25153 14391 1 16 . 1 1 62 62 GLN H H 62 5.667 5.667 8.865 -3.198 25153 14392 1 16 . 1 1 63 63 GLU N N 63 124.570 124.570 125.228 -0.658 25153 14393 1 16 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.236 -0.250 25153 14394 1 16 . 1 1 63 63 GLU C C 63 177.300 177.300 177.528 -0.228 25153 14395 1 16 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.930 1.790 25153 14396 1 16 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.434 0.686 25153 14397 1 16 . 1 1 64 64 ASP N N 64 119.060 119.060 120.502 -1.442 25153 14398 1 16 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.579 0.041 25153 14399 1 16 . 1 1 64 64 ASP C C 64 179.180 179.180 178.060 1.120 25153 14400 1 16 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.482 1.468 25153 14401 1 16 . 1 1 64 64 ASP CB C 64 40.950 40.950 41.041 -0.091 25153 14402 1 16 . 1 1 65 65 TRP N N 65 121.070 121.070 121.961 -0.891 25153 14403 1 16 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.396 -0.056 25153 14404 1 16 . 1 1 65 65 TRP C C 65 178.970 178.970 178.564 0.406 25153 14405 1 16 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.927 -0.107 25153 14406 1 16 . 1 1 65 65 TRP CB C 65 30.400 30.400 29.872 0.528 25153 14407 1 16 . 1 1 65 65 TRP H H 65 7.350 7.350 8.141 -0.791 25153 14408 1 16 . 1 1 66 66 GLU N N 66 120.900 120.900 117.911 2.989 25153 14409 1 16 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.848 -0.008 25153 14410 1 16 . 1 1 66 66 GLU C C 66 178.750 178.750 179.099 -0.349 25153 14411 1 16 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.397 0.603 25153 14412 1 16 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.233 -0.373 25153 14413 1 16 . 1 1 67 67 ALA N N 67 119.130 119.130 119.657 -0.527 25153 14414 1 16 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.258 -0.005 25153 14415 1 16 . 1 1 67 67 ALA C C 67 179.410 179.410 179.042 0.368 25153 14416 1 16 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.686 -0.106 25153 14417 1 16 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.792 0.018 25153 14418 1 16 . 1 1 67 67 ALA H H 67 7.640 7.640 7.705 -0.065 25153 14419 1 16 . 1 1 68 68 VAL N N 68 106.845 106.845 112.053 -5.208 25153 14420 1 16 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.421 0.389 25153 14421 1 16 . 1 1 68 68 VAL C C 68 176.750 176.750 177.280 -0.530 25153 14422 1 16 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.848 -3.238 25153 14423 1 16 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.405 0.215 25153 14424 1 16 . 1 1 68 68 VAL H H 68 7.219 7.219 7.434 -0.215 25153 14425 1 16 . 1 1 69 69 TRP N N 69 127.630 127.630 123.881 3.749 25153 14426 1 16 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.323 -0.085 25153 14427 1 16 . 1 1 69 69 TRP C C 69 178.670 178.670 177.373 1.297 25153 14428 1 16 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.050 -0.830 25153 14429 1 16 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.528 2.102 25153 14430 1 16 . 1 1 69 69 TRP H H 69 7.832 7.832 8.767 -0.935 25153 14431 1 16 . 1 1 70 70 ASP N N 70 114.544 114.544 118.300 -3.756 25153 14432 1 16 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.470 0.052 25153 14433 1 16 . 1 1 70 70 ASP C C 70 178.670 178.670 178.966 -0.296 25153 14434 1 16 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.219 -1.219 25153 14435 1 16 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.987 -1.137 25153 14436 1 16 . 1 1 71 71 GLN N N 71 120.040 120.040 119.567 0.473 25153 14437 1 16 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.117 0.067 25153 14438 1 16 . 1 1 71 71 GLN C C 71 178.910 178.910 178.815 0.095 25153 14439 1 16 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.399 -0.789 25153 14440 1 16 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.849 0.251 25153 14441 1 16 . 1 1 71 71 GLN H H 71 7.995 7.995 7.720 0.275 25153 14442 1 16 . 1 1 72 72 LEU N N 72 117.400 117.400 119.102 -1.702 25153 14443 1 16 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.940 -0.127 25153 14444 1 16 . 1 1 72 72 LEU C C 72 178.650 178.650 178.039 0.611 25153 14445 1 16 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.051 0.149 25153 14446 1 16 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.373 0.037 25153 14447 1 16 . 1 1 72 72 LEU H H 72 7.450 7.450 7.855 -0.405 25153 14448 1 16 . 1 1 73 73 ASP N N 73 115.750 115.750 117.467 -1.717 25153 14449 1 16 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.424 -0.256 25153 14450 1 16 . 1 1 73 73 ASP C C 73 177.560 177.560 177.337 0.223 25153 14451 1 16 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.483 0.917 25153 14452 1 16 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.510 -1.410 25153 14453 1 16 . 1 1 74 74 ASP N N 74 117.223 117.223 119.916 -2.693 25153 14454 1 16 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.590 0.113 25153 14455 1 16 . 1 1 74 74 ASP C C 74 176.388 176.388 177.125 -0.737 25153 14456 1 16 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.133 -0.633 25153 14457 1 16 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.590 0.110 25153 14458 1 16 . 1 1 75 75 LEU N N 75 118.316 118.316 119.478 -1.162 25153 14459 1 16 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.323 -0.038 25153 14460 1 16 . 1 1 75 75 LEU C C 75 176.820 176.820 175.876 0.944 25153 14461 1 16 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.624 -0.224 25153 14462 1 16 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.411 0.869 25153 14463 1 16 . 1 1 75 75 LEU H H 75 6.960 6.960 7.379 -0.419 25153 14464 1 16 . 1 1 76 76 ASN N N 76 123.045 123.045 117.899 5.146 25153 14465 1 16 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.805 0.085 25153 14466 1 16 . 1 1 76 76 ASN C C 76 174.950 174.950 174.716 0.234 25153 14467 1 16 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.626 -0.576 25153 14468 1 16 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.584 -1.084 25153 14469 1 16 . 1 1 76 76 ASN H H 76 9.890 9.890 8.748 1.142 25153 14470 1 16 . 1 1 77 77 LEU N N 77 123.494 123.494 123.267 0.227 25153 14471 1 16 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.562 -0.192 25153 14472 1 16 . 1 1 77 77 LEU C C 77 175.040 175.040 176.087 -1.047 25153 14473 1 16 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.313 -1.063 25153 14474 1 16 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.339 0.561 25153 14475 1 16 . 1 1 77 77 LEU H H 77 8.730 8.730 8.066 0.664 25153 14476 1 16 . 1 1 78 78 GLU N N 78 120.870 120.870 121.387 -0.517 25153 14477 1 16 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.314 -0.414 25153 14478 1 16 . 1 1 78 78 GLU C C 78 178.660 178.660 177.788 0.872 25153 14479 1 16 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.373 1.387 25153 14480 1 16 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.129 0.271 25153 14481 1 16 . 1 1 79 79 GLY N N 79 113.240 113.240 114.122 -0.882 25153 14482 1 16 . 1 1 79 79 GLY C C 79 174.460 174.460 174.513 -0.053 25153 14483 1 16 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.323 0.107 25153 14484 1 16 . 1 1 79 79 GLY H H 79 8.474 8.474 8.721 -0.247 25153 14485 1 16 . 1 1 80 80 LYS N N 80 120.295 120.295 119.752 0.543 25153 14486 1 16 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.382 -0.024 25153 14487 1 16 . 1 1 80 80 LYS C C 80 175.360 175.360 176.126 -0.766 25153 14488 1 16 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.060 0.910 25153 14489 1 16 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.965 -0.764 25153 14490 1 16 . 1 1 81 81 ILE N N 81 122.400 122.400 121.822 0.578 25153 14491 1 16 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.638 0.155 25153 14492 1 16 . 1 1 81 81 ILE C C 81 174.760 174.760 175.469 -0.709 25153 14493 1 16 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.532 -1.702 25153 14494 1 16 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.009 -0.309 25153 14495 1 16 . 1 1 81 81 ILE H H 81 7.400 7.400 7.850 -0.450 25153 14496 1 16 . 1 1 82 82 VAL N N 82 127.840 127.840 126.505 1.335 25153 14497 1 16 . 1 1 82 82 VAL HA H 82 5.262 5.262 4.884 0.378 25153 14498 1 16 . 1 1 82 82 VAL C C 82 172.724 172.724 174.289 -1.565 25153 14499 1 16 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.832 -0.422 25153 14500 1 16 . 1 1 82 82 VAL CB C 82 35.400 35.400 34.907 0.493 25153 14501 1 16 . 1 1 82 82 VAL H H 82 8.790 8.790 8.812 -0.022 25153 14502 1 16 . 1 1 83 83 ALA N N 83 131.347 131.347 130.771 0.576 25153 14503 1 16 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.246 0.136 25153 14504 1 16 . 1 1 83 83 ALA C C 83 175.750 175.750 176.364 -0.614 25153 14505 1 16 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.214 -0.344 25153 14506 1 16 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.069 3.381 25153 14507 1 16 . 1 1 83 83 ALA H H 83 9.300 9.300 8.859 0.441 25153 14508 1 16 . 1 1 84 84 LEU N N 84 124.200 124.200 126.768 -2.568 25153 14509 1 16 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.727 -0.207 25153 14510 1 16 . 1 1 84 84 LEU C C 84 175.760 175.760 176.943 -1.183 25153 14511 1 16 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.696 -0.196 25153 14512 1 16 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.289 1.611 25153 14513 1 16 . 1 1 84 84 LEU H H 84 10.287 10.287 8.922 1.365 25153 14514 1 16 . 1 1 85 85 TYR N N 85 115.912 115.912 119.262 -3.350 25153 14515 1 16 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.281 -0.321 25153 14516 1 16 . 1 1 85 85 TYR C C 85 172.372 172.372 173.730 -1.358 25153 14517 1 16 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.345 0.755 25153 14518 1 16 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.546 1.484 25153 14519 1 16 . 1 1 85 85 TYR H H 85 9.257 9.257 8.517 0.740 25153 14520 1 16 . 1 1 86 86 GLY N N 86 107.800 107.800 106.133 1.667 25153 14521 1 16 . 1 1 86 86 GLY C C 86 170.330 170.330 171.511 -1.181 25153 14522 1 16 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.648 -0.278 25153 14523 1 16 . 1 1 86 86 GLY H H 86 9.027 9.027 8.683 0.344 25153 14524 1 16 . 1 1 87 87 LEU N N 87 123.458 123.458 118.086 5.372 25153 14525 1 16 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.236 0.229 25153 14526 1 16 . 1 1 87 87 LEU C C 87 178.100 178.100 175.987 2.113 25153 14527 1 16 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.697 0.893 25153 14528 1 16 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.270 0.070 25153 14529 1 16 . 1 1 87 87 LEU H H 87 6.580 6.580 7.908 -1.328 25153 14530 1 16 . 1 1 88 88 GLY N N 88 108.966 108.966 106.991 1.975 25153 14531 1 16 . 1 1 88 88 GLY C C 88 172.820 172.820 171.232 1.588 25153 14532 1 16 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.645 1.015 25153 14533 1 16 . 1 1 88 88 GLY H H 88 8.070 8.070 8.127 -0.057 25153 14534 1 16 . 1 1 89 89 ASP N N 89 121.150 121.150 117.663 3.487 25153 14535 1 16 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.186 0.060 25153 14536 1 16 . 1 1 89 89 ASP C C 89 176.220 176.220 176.485 -0.265 25153 14537 1 16 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.230 0.240 25153 14538 1 16 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.484 -1.004 25153 14539 1 16 . 1 1 90 90 GLN N N 90 123.970 123.970 123.333 0.637 25153 14540 1 16 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.169 -0.681 25153 14541 1 16 . 1 1 90 90 GLN C C 90 173.646 173.646 176.096 -2.450 25153 14542 1 16 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.754 0.556 25153 14543 1 16 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.687 -0.477 25153 14544 1 16 . 1 1 90 90 GLN H H 90 8.623 8.623 8.751 -0.128 25153 14545 1 16 . 1 1 91 91 LEU N N 91 118.017 118.017 119.006 -0.989 25153 14546 1 16 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.222 0.153 25153 14547 1 16 . 1 1 91 91 LEU C C 91 180.160 180.160 178.772 1.388 25153 14548 1 16 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.231 -0.171 25153 14549 1 16 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.081 -0.531 25153 14550 1 16 . 1 1 91 91 LEU H H 91 7.046 7.046 8.664 -1.618 25153 14551 1 16 . 1 1 92 92 GLY N N 92 110.028 110.028 105.409 4.619 25153 14552 1 16 . 1 1 92 92 GLY C C 92 174.912 174.912 174.127 0.785 25153 14553 1 16 . 1 1 92 92 GLY CA C 92 46.180 46.180 46.091 0.089 25153 14554 1 16 . 1 1 92 92 GLY H H 92 9.238 9.238 8.852 0.386 25153 14555 1 16 . 1 1 93 93 TYR N N 93 115.910 115.910 119.291 -3.381 25153 14556 1 16 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.173 -0.164 25153 14557 1 16 . 1 1 93 93 TYR C C 93 176.850 176.850 178.134 -1.284 25153 14558 1 16 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.648 -1.918 25153 14559 1 16 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.197 -2.067 25153 14560 1 16 . 1 1 93 93 TYR H H 93 6.962 6.962 7.516 -0.554 25153 14561 1 16 . 1 1 94 94 GLY N N 94 111.630 111.630 106.966 4.664 25153 14562 1 16 . 1 1 94 94 GLY C C 94 177.777 177.777 176.538 1.239 25153 14563 1 16 . 1 1 94 94 GLY CA C 94 50.030 50.030 46.993 3.037 25153 14564 1 16 . 1 1 94 94 GLY H H 94 7.835 7.835 8.580 -0.745 25153 14565 1 16 . 1 1 95 95 GLU N N 95 122.450 122.450 121.861 0.589 25153 14566 1 16 . 1 1 95 95 GLU HA H 95 3.918 3.918 4.004 -0.086 25153 14567 1 16 . 1 1 95 95 GLU C C 95 175.300 175.300 176.595 -1.295 25153 14568 1 16 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.522 -0.422 25153 14569 1 16 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.113 -1.602 25153 14570 1 16 . 1 1 96 96 TRP N N 96 118.790 118.790 114.885 3.905 25153 14571 1 16 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.965 0.479 25153 14572 1 16 . 1 1 96 96 TRP C C 96 179.280 179.280 175.884 3.396 25153 14573 1 16 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.838 1.177 25153 14574 1 16 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.767 0.253 25153 14575 1 16 . 1 1 96 96 TRP H H 96 8.070 8.070 8.110 -0.040 25153 14576 1 16 . 1 1 97 97 PHE N N 97 128.067 128.067 123.841 4.226 25153 14577 1 16 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.255 1.050 25153 14578 1 16 . 1 1 97 97 PHE C C 97 173.227 173.227 176.139 -2.912 25153 14579 1 16 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.832 -3.112 25153 14580 1 16 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.274 0.666 25153 14581 1 16 . 1 1 97 97 PHE H H 97 7.165 7.165 8.006 -0.841 25153 14582 1 16 . 1 1 98 98 LEU N N 98 114.306 114.306 123.904 -9.598 25153 14583 1 16 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.684 -0.194 25153 14584 1 16 . 1 1 98 98 LEU C C 98 179.365 179.365 177.198 2.167 25153 14585 1 16 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.448 0.012 25153 14586 1 16 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.580 -0.349 25153 14587 1 16 . 1 1 98 98 LEU H H 98 7.453 7.453 8.502 -1.049 25153 14588 1 16 . 1 1 99 99 ASP N N 99 122.354 122.354 120.686 1.668 25153 14589 1 16 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.348 -0.415 25153 14590 1 16 . 1 1 99 99 ASP C C 99 178.800 178.800 177.192 1.608 25153 14591 1 16 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.550 1.630 25153 14592 1 16 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.328 -0.898 25153 14593 1 16 . 1 1 100 100 ALA N N 100 118.568 118.568 121.470 -2.902 25153 14594 1 16 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.082 -0.242 25153 14595 1 16 . 1 1 100 100 ALA C C 100 178.500 178.500 178.971 -0.471 25153 14596 1 16 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.849 0.067 25153 14597 1 16 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.582 1.077 25153 14598 1 16 . 1 1 100 100 ALA H H 100 8.682 8.682 7.712 0.970 25153 14599 1 16 . 1 1 101 101 LEU N N 101 118.815 118.815 120.660 -1.845 25153 14600 1 16 . 1 1 101 101 LEU HA H 101 3.680 3.680 4.007 -0.327 25153 14601 1 16 . 1 1 101 101 LEU C C 101 178.930 178.930 178.817 0.113 25153 14602 1 16 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.660 0.041 25153 14603 1 16 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.592 0.808 25153 14604 1 16 . 1 1 101 101 LEU H H 101 6.637 6.637 7.584 -0.947 25153 14605 1 16 . 1 1 102 102 GLY N N 102 103.700 103.700 106.498 -2.798 25153 14606 1 16 . 1 1 102 102 GLY C C 102 175.530 175.530 176.114 -0.584 25153 14607 1 16 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.328 0.672 25153 14608 1 16 . 1 1 102 102 GLY H H 102 7.330 7.330 7.928 -0.598 25153 14609 1 16 . 1 1 103 103 MET N N 103 120.330 120.330 121.498 -1.168 25153 14610 1 16 . 1 1 103 103 MET HA H 103 4.254 4.254 4.260 -0.006 25153 14611 1 16 . 1 1 103 103 MET C C 103 179.688 179.688 178.585 1.103 25153 14612 1 16 . 1 1 103 103 MET CA C 103 59.615 59.615 59.542 0.073 25153 14613 1 16 . 1 1 103 103 MET CB C 103 33.290 33.290 32.615 0.675 25153 14614 1 16 . 1 1 103 103 MET H H 103 8.407 8.407 7.754 0.653 25153 14615 1 16 . 1 1 104 104 LEU N N 104 123.450 123.450 120.316 3.134 25153 14616 1 16 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.650 0.546 25153 14617 1 16 . 1 1 104 104 LEU C C 104 177.620 177.620 178.813 -1.193 25153 14618 1 16 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.873 0.097 25153 14619 1 16 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.179 0.121 25153 14620 1 16 . 1 1 104 104 LEU H H 104 8.330 8.330 8.494 -0.164 25153 14621 1 16 . 1 1 105 105 HIS N N 105 119.040 119.040 119.109 -0.069 25153 14622 1 16 . 1 1 105 105 HIS HA H 105 3.877 3.877 3.994 -0.117 25153 14623 1 16 . 1 1 105 105 HIS C C 105 177.100 177.100 177.285 -0.185 25153 14624 1 16 . 1 1 105 105 HIS CA C 105 60.970 60.970 61.010 -0.040 25153 14625 1 16 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.840 -1.248 25153 14626 1 16 . 1 1 105 105 HIS H H 105 8.050 8.050 8.275 -0.225 25153 14627 1 16 . 1 1 106 106 ASP N N 106 119.950 119.950 119.160 0.790 25153 14628 1 16 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.427 -0.097 25153 14629 1 16 . 1 1 106 106 ASP C C 106 179.300 179.300 178.472 0.828 25153 14630 1 16 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.278 0.532 25153 14631 1 16 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.111 -0.711 25153 14632 1 16 . 1 1 107 107 LYS N N 107 122.060 122.060 119.997 2.063 25153 14633 1 16 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.051 0.082 25153 14634 1 16 . 1 1 107 107 LYS C C 107 178.100 178.100 179.424 -1.324 25153 14635 1 16 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.678 -0.478 25153 14636 1 16 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.133 0.227 25153 14637 1 16 . 1 1 108 108 LEU N N 108 115.610 115.610 117.921 -2.311 25153 14638 1 16 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.155 -0.087 25153 14639 1 16 . 1 1 108 108 LEU C C 108 178.866 178.866 178.315 0.551 25153 14640 1 16 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.751 -0.797 25153 14641 1 16 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.585 0.575 25153 14642 1 16 . 1 1 108 108 LEU H H 108 7.828 7.828 8.351 -0.523 25153 14643 1 16 . 1 1 109 109 SER N N 109 116.362 116.362 115.348 1.014 25153 14644 1 16 . 1 1 109 109 SER HA H 109 4.299 4.299 4.308 -0.009 25153 14645 1 16 . 1 1 109 109 SER C C 109 175.660 175.660 176.830 -1.170 25153 14646 1 16 . 1 1 109 109 SER CA C 109 62.350 62.350 61.364 0.986 25153 14647 1 16 . 1 1 109 109 SER CB C 109 62.815 62.815 63.147 -0.332 25153 14648 1 16 . 1 1 109 109 SER H H 109 8.278 8.278 8.743 -0.465 25153 14649 1 16 . 1 1 110 110 THR N N 110 110.230 110.230 116.300 -6.070 25153 14650 1 16 . 1 1 110 110 THR HA H 110 4.615 4.615 4.255 0.360 25153 14651 1 16 . 1 1 110 110 THR C C 110 175.990 175.990 175.487 0.503 25153 14652 1 16 . 1 1 110 110 THR CA C 110 62.090 62.090 64.534 -2.445 25153 14653 1 16 . 1 1 110 110 THR CB C 110 68.800 68.800 68.776 0.024 25153 14654 1 16 . 1 1 110 110 THR H H 110 7.211 7.211 7.822 -0.611 25153 14655 1 16 . 1 1 111 111 LYS N N 111 119.900 119.900 119.517 0.383 25153 14656 1 16 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.397 0.115 25153 14657 1 16 . 1 1 111 111 LYS C C 111 176.916 176.916 176.400 0.516 25153 14658 1 16 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.233 0.421 25153 14659 1 16 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.259 -1.416 25153 14660 1 16 . 1 1 112 112 GLY N N 112 107.910 107.910 108.239 -0.329 25153 14661 1 16 . 1 1 112 112 GLY C C 112 176.250 176.250 174.005 2.245 25153 14662 1 16 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.672 1.368 25153 14663 1 16 . 1 1 112 112 GLY H H 112 8.366 8.366 7.647 0.719 25153 14664 1 16 . 1 1 113 113 VAL N N 113 113.530 113.530 116.144 -2.614 25153 14665 1 16 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.505 -0.031 25153 14666 1 16 . 1 1 113 113 VAL C C 113 174.630 174.630 174.648 -0.018 25153 14667 1 16 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.568 -1.118 25153 14668 1 16 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.277 -0.727 25153 14669 1 16 . 1 1 113 113 VAL H H 113 6.903 6.903 6.940 -0.037 25153 14670 1 16 . 1 1 114 114 LYS N N 114 123.020 123.020 118.738 4.282 25153 14671 1 16 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.521 -0.016 25153 14672 1 16 . 1 1 114 114 LYS C C 114 175.000 175.000 175.043 -0.043 25153 14673 1 16 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.526 -0.327 25153 14674 1 16 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.515 -1.175 25153 14675 1 16 . 1 1 115 115 PHE N N 115 123.290 123.290 120.846 2.444 25153 14676 1 16 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.706 0.007 25153 14677 1 16 . 1 1 115 115 PHE C C 115 177.605 177.605 176.232 1.373 25153 14678 1 16 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.807 1.803 25153 14679 1 16 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.346 -0.346 25153 14680 1 16 . 1 1 115 115 PHE H H 115 8.494 8.494 8.562 -0.068 25153 14681 1 16 . 1 1 116 116 VAL N N 116 115.790 115.790 114.097 1.693 25153 14682 1 16 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.356 0.136 25153 14683 1 16 . 1 1 116 116 VAL C C 116 175.414 175.414 176.110 -0.696 25153 14684 1 16 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.139 -0.153 25153 14685 1 16 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.570 -0.470 25153 14686 1 16 . 1 1 116 116 VAL H H 116 8.889 8.889 7.978 0.911 25153 14687 1 16 . 1 1 117 117 GLY N N 117 108.300 108.300 108.087 0.213 25153 14688 1 16 . 1 1 117 117 GLY C C 117 176.180 176.180 174.586 1.594 25153 14689 1 16 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.375 2.425 25153 14690 1 16 . 1 1 117 117 GLY H H 117 9.810 9.810 8.566 1.244 25153 14691 1 16 . 1 1 118 118 TYR N N 118 120.050 120.050 119.411 0.639 25153 14692 1 16 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.716 0.238 25153 14693 1 16 . 1 1 118 118 TYR C C 118 177.450 177.450 175.905 1.545 25153 14694 1 16 . 1 1 118 118 TYR CA C 118 56.240 56.240 58.452 -2.212 25153 14695 1 16 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.288 -3.178 25153 14696 1 16 . 1 1 118 118 TYR H H 118 8.592 8.592 7.504 1.088 25153 14697 1 16 . 1 1 119 119 TRP N N 119 125.500 125.500 120.889 4.611 25153 14698 1 16 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.145 0.883 25153 14699 1 16 . 1 1 119 119 TRP C C 119 173.090 173.090 174.062 -0.972 25153 14700 1 16 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.452 -0.552 25153 14701 1 16 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.535 2.716 25153 14702 1 16 . 1 1 119 119 TRP H H 119 7.926 7.926 8.204 -0.278 25153 14703 1 16 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.821 -0.011 25153 14704 1 16 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.652 1.028 25153 14705 1 16 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.816 -0.566 25153 14706 1 16 . 1 1 121 121 THR N N 121 109.114 109.114 111.267 -2.153 25153 14707 1 16 . 1 1 121 121 THR HA H 121 4.142 4.142 3.409 0.733 25153 14708 1 16 . 1 1 121 121 THR C C 121 176.300 176.300 175.287 1.013 25153 14709 1 16 . 1 1 121 121 THR CA C 121 61.230 61.230 63.097 -1.867 25153 14710 1 16 . 1 1 121 121 THR CB C 121 69.890 69.890 68.263 1.627 25153 14711 1 16 . 1 1 121 121 THR H H 121 7.356 7.356 8.385 -1.029 25153 14712 1 16 . 1 1 122 122 GLU N N 122 123.980 123.980 121.500 2.480 25153 14713 1 16 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.023 0.215 25153 14714 1 16 . 1 1 122 122 GLU C C 122 177.830 177.830 178.042 -0.212 25153 14715 1 16 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.946 0.284 25153 14716 1 16 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.831 -0.061 25153 14717 1 16 . 1 1 123 123 GLY N N 123 114.570 114.570 112.967 1.603 25153 14718 1 16 . 1 1 123 123 GLY C C 123 173.700 173.700 173.608 0.092 25153 14719 1 16 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.237 0.163 25153 14720 1 16 . 1 1 123 123 GLY H H 123 9.181 9.181 8.955 0.226 25153 14721 1 16 . 1 1 124 124 TYR N N 124 118.923 118.923 120.115 -1.192 25153 14722 1 16 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.633 0.677 25153 14723 1 16 . 1 1 124 124 TYR C C 124 175.680 175.680 175.381 0.299 25153 14724 1 16 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.763 -2.292 25153 14725 1 16 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.091 0.909 25153 14726 1 16 . 1 1 124 124 TYR H H 124 7.877 7.877 7.737 0.140 25153 14727 1 16 . 1 1 125 125 GLU N N 125 124.890 124.890 121.105 3.785 25153 14728 1 16 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.612 0.088 25153 14729 1 16 . 1 1 125 125 GLU C C 125 172.880 172.880 175.421 -2.541 25153 14730 1 16 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.873 -0.443 25153 14731 1 16 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.916 -0.496 25153 14732 1 16 . 1 1 126 126 PHE N N 126 119.166 119.166 120.226 -1.060 25153 14733 1 16 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.466 0.343 25153 14734 1 16 . 1 1 126 126 PHE C C 126 173.750 173.750 174.618 -0.868 25153 14735 1 16 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.221 -1.431 25153 14736 1 16 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.084 0.966 25153 14737 1 16 . 1 1 126 126 PHE H H 126 7.716 7.716 8.016 -0.300 25153 14738 1 16 . 1 1 127 127 THR N N 127 106.800 106.800 115.556 -8.756 25153 14739 1 16 . 1 1 127 127 THR HA H 127 4.400 4.400 3.325 1.075 25153 14740 1 16 . 1 1 127 127 THR C C 127 175.300 175.300 174.188 1.112 25153 14741 1 16 . 1 1 127 127 THR CA C 127 61.100 61.100 63.270 -2.170 25153 14742 1 16 . 1 1 127 127 THR CB C 127 70.600 70.600 68.089 2.511 25153 14743 1 16 . 1 1 127 127 THR H H 127 7.220 7.220 6.499 0.721 25153 14744 1 16 . 1 1 128 128 SER N N 128 118.360 118.360 116.259 2.101 25153 14745 1 16 . 1 1 128 128 SER HA H 128 4.680 4.680 4.504 0.176 25153 14746 1 16 . 1 1 128 128 SER C C 128 175.720 175.720 173.918 1.802 25153 14747 1 16 . 1 1 128 128 SER CA C 128 56.250 56.250 57.405 -1.155 25153 14748 1 16 . 1 1 128 128 SER CB C 128 65.635 65.635 63.983 1.652 25153 14749 1 16 . 1 1 128 128 SER H H 128 7.411 7.411 7.949 -0.538 25153 14750 1 16 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.573 0.202 25153 14751 1 16 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.458 -1.958 25153 14752 1 16 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.336 0.064 25153 14753 1 16 . 1 1 130 130 LYS N N 130 122.014 122.014 119.683 2.331 25153 14754 1 16 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.372 -0.139 25153 14755 1 16 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.350 3.350 25153 14756 1 16 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.970 -0.400 25153 14757 1 16 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.565 -0.047 25153 14758 1 16 . 1 1 131 131 PRO C C 131 174.000 174.000 175.196 -1.196 25153 14759 1 16 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.327 2.373 25153 14760 1 16 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.404 0.796 25153 14761 1 16 . 1 1 132 132 VAL N N 132 113.260 113.260 117.567 -4.307 25153 14762 1 16 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.866 0.334 25153 14763 1 16 . 1 1 132 132 VAL C C 132 175.210 175.210 175.053 0.157 25153 14764 1 16 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.252 -0.632 25153 14765 1 16 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.007 -1.026 25153 14766 1 16 . 1 1 132 132 VAL H H 132 6.697 6.697 7.584 -0.887 25153 14767 1 16 . 1 1 133 133 ILE N N 133 119.940 119.940 118.190 1.750 25153 14768 1 16 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.464 -0.084 25153 14769 1 16 . 1 1 133 133 ILE C C 133 175.440 175.440 175.352 0.088 25153 14770 1 16 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.839 1.611 25153 14771 1 16 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.272 1.828 25153 14772 1 16 . 1 1 133 133 ILE H H 133 8.756 8.756 8.691 0.065 25153 14773 1 16 . 1 1 134 134 ALA N N 134 122.632 122.632 123.900 -1.268 25153 14774 1 16 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.871 0.089 25153 14775 1 16 . 1 1 134 134 ALA C C 134 178.312 178.312 177.202 1.110 25153 14776 1 16 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.574 -1.494 25153 14777 1 16 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.189 -0.353 25153 14778 1 16 . 1 1 134 134 ALA H H 134 8.523 8.523 8.447 0.076 25153 14779 1 16 . 1 1 135 135 ASP N N 135 117.366 117.366 122.674 -5.308 25153 14780 1 16 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.653 -0.401 25153 14781 1 16 . 1 1 135 135 ASP C C 135 176.387 176.387 176.631 -0.244 25153 14782 1 16 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.355 1.855 25153 14783 1 16 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.230 -1.530 25153 14784 1 16 . 1 1 136 136 GLY N N 136 104.310 104.310 108.047 -3.737 25153 14785 1 16 . 1 1 136 136 GLY C C 136 174.922 174.922 174.939 -0.017 25153 14786 1 16 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.370 -0.270 25153 14787 1 16 . 1 1 136 136 GLY H H 136 7.610 7.610 8.301 -0.691 25153 14788 1 16 . 1 1 137 137 GLN N N 137 118.784 118.784 117.776 1.008 25153 14789 1 16 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.421 -0.366 25153 14790 1 16 . 1 1 137 137 GLN C C 137 176.390 176.390 175.440 0.950 25153 14791 1 16 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.820 1.820 25153 14792 1 16 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.193 0.037 25153 14793 1 16 . 1 1 137 137 GLN H H 137 7.870 7.870 7.843 0.027 25153 14794 1 16 . 1 1 138 138 LEU N N 138 118.040 118.040 115.949 2.091 25153 14795 1 16 . 1 1 138 138 LEU HA H 138 4.987 4.987 4.994 -0.007 25153 14796 1 16 . 1 1 138 138 LEU C C 138 175.913 175.913 175.172 0.741 25153 14797 1 16 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.153 0.447 25153 14798 1 16 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.842 1.558 25153 14799 1 16 . 1 1 138 138 LEU H H 138 7.356 7.356 7.191 0.165 25153 14800 1 16 . 1 1 139 139 PHE N N 139 119.060 119.060 119.415 -0.355 25153 14801 1 16 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.946 0.364 25153 14802 1 16 . 1 1 139 139 PHE C C 139 178.780 178.780 177.729 1.051 25153 14803 1 16 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.797 -0.947 25153 14804 1 16 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.727 3.733 25153 14805 1 16 . 1 1 139 139 PHE H H 139 10.094 10.094 8.919 1.175 25153 14806 1 16 . 1 1 140 140 VAL N N 140 109.690 109.690 117.912 -8.222 25153 14807 1 16 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.908 -0.427 25153 14808 1 16 . 1 1 140 140 VAL C C 140 172.790 172.790 175.585 -2.795 25153 14809 1 16 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.236 -1.236 25153 14810 1 16 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.382 -0.832 25153 14811 1 16 . 1 1 140 140 VAL H H 140 7.470 7.470 8.430 -0.960 25153 14812 1 16 . 1 1 141 141 GLY N N 141 107.060 107.060 105.360 1.700 25153 14813 1 16 . 1 1 141 141 GLY C C 141 171.513 171.513 172.436 -0.923 25153 14814 1 16 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.724 0.706 25153 14815 1 16 . 1 1 141 141 GLY H H 141 7.137 7.137 7.388 -0.251 25153 14816 1 16 . 1 1 142 142 LEU N N 142 117.863 117.863 120.290 -2.427 25153 14817 1 16 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.293 -1.318 25153 14818 1 16 . 1 1 142 142 LEU C C 142 173.640 173.640 175.170 -1.530 25153 14819 1 16 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.698 1.222 25153 14820 1 16 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.511 -4.962 25153 14821 1 16 . 1 1 142 142 LEU H H 142 7.517 7.517 7.644 -0.127 25153 14822 1 16 . 1 1 143 143 ALA N N 143 126.990 126.990 129.301 -2.311 25153 14823 1 16 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.388 -0.111 25153 14824 1 16 . 1 1 143 143 ALA C C 143 175.730 175.730 175.886 -0.156 25153 14825 1 16 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.330 -0.890 25153 14826 1 16 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.202 4.108 25153 14827 1 16 . 1 1 143 143 ALA H H 143 5.186 5.186 8.233 -3.047 25153 14828 1 16 . 1 1 144 144 LEU N N 144 125.477 125.477 124.198 1.279 25153 14829 1 16 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.715 0.065 25153 14830 1 16 . 1 1 144 144 LEU C C 144 174.473 174.473 175.069 -0.596 25153 14831 1 16 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.615 -0.375 25153 14832 1 16 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.267 0.033 25153 14833 1 16 . 1 1 144 144 LEU H H 144 8.758 8.758 7.910 0.848 25153 14834 1 16 . 1 1 145 145 ASP N N 145 118.915 118.915 119.446 -0.531 25153 14835 1 16 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.158 0.374 25153 14836 1 16 . 1 1 145 145 ASP C C 145 176.470 176.470 175.661 0.809 25153 14837 1 16 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.778 -0.148 25153 14838 1 16 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.464 -0.464 25153 14839 1 16 . 1 1 146 146 GLU N N 146 124.813 124.813 123.034 1.779 25153 14840 1 16 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.605 -0.229 25153 14841 1 16 . 1 1 146 146 GLU C C 146 177.290 177.290 176.410 0.880 25153 14842 1 16 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.001 0.119 25153 14843 1 16 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.694 0.456 25153 14844 1 16 . 1 1 147 147 THR N N 147 118.328 118.328 113.270 5.058 25153 14845 1 16 . 1 1 147 147 THR HA H 147 4.200 4.200 4.508 -0.308 25153 14846 1 16 . 1 1 147 147 THR C C 147 175.683 175.683 174.759 0.924 25153 14847 1 16 . 1 1 147 147 THR CA C 147 66.250 66.250 63.446 2.804 25153 14848 1 16 . 1 1 147 147 THR CB C 147 69.600 69.600 70.023 -0.423 25153 14849 1 16 . 1 1 147 147 THR H H 147 8.562 8.562 8.834 -0.272 25153 14850 1 16 . 1 1 148 148 ASN N N 148 115.550 115.550 117.959 -2.409 25153 14851 1 16 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.879 0.108 25153 14852 1 16 . 1 1 148 148 ASN C C 148 175.870 175.870 175.291 0.579 25153 14853 1 16 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.549 -0.849 25153 14854 1 16 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.639 2.241 25153 14855 1 16 . 1 1 148 148 ASN H H 148 9.118 9.118 8.684 0.434 25153 14856 1 16 . 1 1 149 149 GLN N N 149 117.400 117.400 120.560 -3.160 25153 14857 1 16 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.212 0.631 25153 14858 1 16 . 1 1 149 149 GLN C C 149 177.780 177.780 176.295 1.485 25153 14859 1 16 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.980 -2.080 25153 14860 1 16 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.565 0.735 25153 14861 1 16 . 1 1 149 149 GLN H H 149 7.555 7.555 8.382 -0.827 25153 14862 1 16 . 1 1 150 150 TYR N N 150 120.674 120.674 116.869 3.805 25153 14863 1 16 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.469 0.059 25153 14864 1 16 . 1 1 150 150 TYR C C 150 177.830 177.830 176.667 1.163 25153 14865 1 16 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.116 0.371 25153 14866 1 16 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.924 -0.324 25153 14867 1 16 . 1 1 150 150 TYR H H 150 6.983 6.983 7.751 -0.768 25153 14868 1 16 . 1 1 151 151 ASP N N 151 120.810 120.810 119.668 1.142 25153 14869 1 16 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.686 -0.171 25153 14870 1 16 . 1 1 151 151 ASP C C 151 176.400 176.400 177.221 -0.821 25153 14871 1 16 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.988 -0.588 25153 14872 1 16 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.550 -2.470 25153 14873 1 16 . 1 1 152 152 LEU N N 152 118.083 118.083 113.914 4.169 25153 14874 1 16 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.755 -0.079 25153 14875 1 16 . 1 1 152 152 LEU C C 152 178.470 178.470 178.230 0.240 25153 14876 1 16 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.664 -1.065 25153 14877 1 16 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.504 -0.904 25153 14878 1 16 . 1 1 152 152 LEU H H 152 7.453 7.453 7.493 -0.040 25153 14879 1 16 . 1 1 153 153 SER N N 153 116.407 116.407 117.975 -1.568 25153 14880 1 16 . 1 1 153 153 SER HA H 153 3.960 3.960 4.011 -0.051 25153 14881 1 16 . 1 1 153 153 SER C C 153 174.590 174.590 175.858 -1.268 25153 14882 1 16 . 1 1 153 153 SER CA C 153 63.400 63.400 62.079 1.321 25153 14883 1 16 . 1 1 153 153 SER CB C 153 63.100 63.100 62.647 0.453 25153 14884 1 16 . 1 1 153 153 SER H H 153 7.360 7.360 8.527 -1.167 25153 14885 1 16 . 1 1 154 154 ASP N N 154 121.960 121.960 121.881 0.079 25153 14886 1 16 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.333 -0.023 25153 14887 1 16 . 1 1 154 154 ASP C C 154 178.640 178.640 177.829 0.811 25153 14888 1 16 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.383 1.617 25153 14889 1 16 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.965 -1.395 25153 14890 1 16 . 1 1 155 155 GLU N N 155 121.310 121.310 118.584 2.726 25153 14891 1 16 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.053 0.132 25153 14892 1 16 . 1 1 155 155 GLU C C 155 179.600 179.600 178.785 0.815 25153 14893 1 16 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.310 0.140 25153 14894 1 16 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.606 -0.206 25153 14895 1 16 . 1 1 156 156 ARG N N 156 121.394 121.394 119.496 1.898 25153 14896 1 16 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.288 0.012 25153 14897 1 16 . 1 1 156 156 ARG C C 156 177.330 177.330 178.994 -1.664 25153 14898 1 16 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.007 2.453 25153 14899 1 16 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.710 1.050 25153 14900 1 16 . 1 1 157 157 ILE N N 157 118.390 118.390 120.842 -2.452 25153 14901 1 16 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.815 -0.381 25153 14902 1 16 . 1 1 157 157 ILE C C 157 178.814 178.814 178.017 0.797 25153 14903 1 16 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.015 0.679 25153 14904 1 16 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.886 0.967 25153 14905 1 16 . 1 1 157 157 ILE H H 157 8.966 8.966 8.228 0.738 25153 14906 1 16 . 1 1 158 158 GLN N N 158 120.060 120.060 119.279 0.781 25153 14907 1 16 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.987 -0.031 25153 14908 1 16 . 1 1 158 158 GLN C C 158 178.843 178.843 178.449 0.394 25153 14909 1 16 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.262 1.338 25153 14910 1 16 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.201 0.189 25153 14911 1 16 . 1 1 158 158 GLN H H 158 8.394 8.394 7.959 0.435 25153 14912 1 16 . 1 1 159 159 SER N N 159 115.613 115.613 116.600 -0.987 25153 14913 1 16 . 1 1 159 159 SER HA H 159 4.455 4.455 4.342 0.113 25153 14914 1 16 . 1 1 159 159 SER C C 159 177.330 177.330 176.636 0.694 25153 14915 1 16 . 1 1 159 159 SER CA C 159 62.400 62.400 61.003 1.397 25153 14916 1 16 . 1 1 159 159 SER CB C 159 63.760 63.760 63.096 0.664 25153 14917 1 16 . 1 1 159 159 SER H H 159 8.460 8.460 8.190 0.270 25153 14918 1 16 . 1 1 160 160 TRP N N 160 126.820 126.820 124.992 1.828 25153 14919 1 16 . 1 1 160 160 TRP HA H 160 4.465 4.465 3.984 0.481 25153 14920 1 16 . 1 1 160 160 TRP C C 160 178.050 178.050 177.577 0.473 25153 14921 1 16 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.401 1.299 25153 14922 1 16 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.181 0.179 25153 14923 1 16 . 1 1 160 160 TRP H H 160 9.318 9.318 7.760 1.558 25153 14924 1 16 . 1 1 161 161 CYS N N 161 116.750 116.750 117.848 -1.098 25153 14925 1 16 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.765 0.118 25153 14926 1 16 . 1 1 161 161 CYS C C 161 176.270 176.270 176.800 -0.530 25153 14927 1 16 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.011 1.349 25153 14928 1 16 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.851 1.029 25153 14929 1 16 . 1 1 161 161 CYS H H 161 8.950 8.950 8.931 0.019 25153 14930 1 16 . 1 1 162 162 GLU N N 162 118.096 118.096 120.154 -2.058 25153 14931 1 16 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.119 -0.189 25153 14932 1 16 . 1 1 162 162 GLU C C 162 178.680 178.680 177.389 1.291 25153 14933 1 16 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.065 0.665 25153 14934 1 16 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.358 0.072 25153 14935 1 16 . 1 1 163 163 GLN N N 163 120.790 120.790 117.680 3.110 25153 14936 1 16 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.082 0.095 25153 14937 1 16 . 1 1 163 163 GLN C C 163 179.690 179.690 178.075 1.615 25153 14938 1 16 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.811 1.729 25153 14939 1 16 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.774 0.226 25153 14940 1 16 . 1 1 163 163 GLN H H 163 8.205 8.205 7.476 0.729 25153 14941 1 16 . 1 1 164 164 ILE N N 164 114.860 114.860 118.747 -3.887 25153 14942 1 16 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.854 0.189 25153 14943 1 16 . 1 1 164 164 ILE C C 164 178.680 178.680 177.304 1.376 25153 14944 1 16 . 1 1 164 164 ILE CA C 164 66.210 66.210 63.999 2.211 25153 14945 1 16 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.612 0.088 25153 14946 1 16 . 1 1 164 164 ILE H H 164 9.005 9.005 7.883 1.122 25153 14947 1 16 . 1 1 165 165 LEU N N 165 123.900 123.900 116.912 6.988 25153 14948 1 16 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.203 -0.053 25153 14949 1 16 . 1 1 165 165 LEU C C 165 180.520 180.520 177.592 2.928 25153 14950 1 16 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.232 1.068 25153 14951 1 16 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.339 -0.289 25153 14952 1 16 . 1 1 165 165 LEU H H 165 7.825 7.825 7.999 -0.174 25153 14953 1 16 . 1 1 166 166 ASN N N 166 120.112 120.112 118.670 1.442 25153 14954 1 16 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.640 -0.057 25153 14955 1 16 . 1 1 166 166 ASN C C 166 178.440 178.440 176.951 1.489 25153 14956 1 16 . 1 1 166 166 ASN CA C 166 56.420 56.420 56.000 0.420 25153 14957 1 16 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.538 -1.118 25153 14958 1 16 . 1 1 166 166 ASN H H 166 7.760 7.760 8.059 -0.299 25153 14959 1 16 . 1 1 167 167 GLU N N 167 121.370 121.370 121.880 -0.510 25153 14960 1 16 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.011 0.092 25153 14961 1 16 . 1 1 167 167 GLU C C 167 180.332 180.332 179.359 0.973 25153 14962 1 16 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.784 0.366 25153 14963 1 16 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.684 1.336 25153 14964 1 16 . 1 1 168 168 MET N N 168 118.532 118.532 117.588 0.944 25153 14965 1 16 . 1 1 168 168 MET HA H 168 4.015 4.015 4.278 -0.263 25153 14966 1 16 . 1 1 168 168 MET C C 168 176.600 176.600 178.204 -1.604 25153 14967 1 16 . 1 1 168 168 MET CA C 168 59.300 59.300 59.197 0.103 25153 14968 1 16 . 1 1 168 168 MET CB C 168 33.400 33.400 32.729 0.671 25153 14969 1 16 . 1 1 168 168 MET H H 168 8.718 8.718 8.398 0.320 25153 14970 1 16 . 1 1 169 169 ALA N N 169 121.922 121.922 122.572 -0.650 25153 14971 1 16 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.192 -0.018 25153 14972 1 16 . 1 1 169 169 ALA C C 169 179.410 179.410 179.478 -0.068 25153 14973 1 16 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.780 -0.380 25153 14974 1 16 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.396 0.014 25153 14975 1 16 . 1 1 169 169 ALA H H 169 7.448 7.448 8.148 -0.700 25153 14976 1 16 . 1 1 170 170 GLU N N 170 117.300 117.300 117.133 0.167 25153 14977 1 16 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.088 0.007 25153 14978 1 16 . 1 1 170 170 GLU C C 170 177.470 177.470 178.417 -0.947 25153 14979 1 16 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.545 -0.595 25153 14980 1 16 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.540 0.235 25153 14981 1 16 . 1 1 171 171 HIS N N 171 117.944 117.944 118.515 -0.571 25153 14982 1 16 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.316 0.184 25153 14983 1 16 . 1 1 171 171 HIS C C 171 175.120 175.120 177.067 -1.947 25153 14984 1 16 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.749 -1.549 25153 14985 1 16 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.924 0.676 25153 14986 1 16 . 1 1 171 171 HIS H H 171 7.788 7.788 7.806 -0.018 25153 14987 1 16 . 1 1 172 172 TYR N N 172 120.040 120.040 118.773 1.267 25153 14988 1 16 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.243 0.350 25153 14989 1 16 . 1 1 172 172 TYR C C 172 174.612 174.612 175.901 -1.289 25153 14990 1 16 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.561 -0.581 25153 14991 1 16 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.718 0.262 25153 14992 1 16 . 1 1 172 172 TYR H H 172 7.820 7.820 7.836 -0.016 25153 14993 1 17 . 1 1 2 2 ASN N N 2 123.320 123.320 119.827 3.493 25153 14994 1 17 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.098 0.110 25153 14995 1 17 . 1 1 2 2 ASN C C 2 174.590 174.590 174.487 0.103 25153 14996 1 17 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.814 0.186 25153 14997 1 17 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.260 -0.290 25153 14998 1 17 . 1 1 2 2 ASN H H 2 9.428 9.428 8.693 0.735 25153 14999 1 17 . 1 1 3 3 MET N N 3 120.920 120.920 118.774 2.146 25153 15000 1 17 . 1 1 3 3 MET HA H 3 5.530 5.530 5.287 0.243 25153 15001 1 17 . 1 1 3 3 MET C C 3 174.400 174.400 174.946 -0.546 25153 15002 1 17 . 1 1 3 3 MET CA C 3 54.643 54.643 54.294 0.349 25153 15003 1 17 . 1 1 3 3 MET CB C 3 34.637 34.637 37.658 -3.021 25153 15004 1 17 . 1 1 3 3 MET H H 3 8.751 8.751 9.110 -0.359 25153 15005 1 17 . 1 1 4 4 GLY N N 4 115.542 115.542 109.283 6.259 25153 15006 1 17 . 1 1 4 4 GLY C C 4 170.413 170.413 172.249 -1.836 25153 15007 1 17 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.841 -0.739 25153 15008 1 17 . 1 1 4 4 GLY H H 4 8.927 8.927 8.879 0.048 25153 15009 1 17 . 1 1 5 5 LEU N N 5 131.030 131.030 128.228 2.802 25153 15010 1 17 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.283 1.119 25153 15011 1 17 . 1 1 5 5 LEU C C 5 175.952 175.952 174.556 1.396 25153 15012 1 17 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.939 0.511 25153 15013 1 17 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.791 2.801 25153 15014 1 17 . 1 1 5 5 LEU H H 5 8.928 8.928 8.678 0.250 25153 15015 1 17 . 1 1 6 6 PHE N N 6 125.790 125.790 126.723 -0.933 25153 15016 1 17 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.823 -0.083 25153 15017 1 17 . 1 1 6 6 PHE C C 6 174.300 174.300 175.951 -1.651 25153 15018 1 17 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.464 -1.144 25153 15019 1 17 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.266 -0.036 25153 15020 1 17 . 1 1 6 6 PHE H H 6 9.237 9.237 9.440 -0.203 25153 15021 1 17 . 1 1 7 7 TYR N N 7 117.289 117.289 117.292 -0.003 25153 15022 1 17 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.996 -0.031 25153 15023 1 17 . 1 1 7 7 TYR C C 7 171.262 171.262 173.437 -2.175 25153 15024 1 17 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.211 -0.811 25153 15025 1 17 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.537 -0.297 25153 15026 1 17 . 1 1 7 7 TYR H H 7 8.125 8.125 8.179 -0.054 25153 15027 1 17 . 1 1 8 8 GLY N N 8 107.420 107.420 106.163 1.257 25153 15028 1 17 . 1 1 8 8 GLY C C 8 172.000 172.000 172.316 -0.316 25153 15029 1 17 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.414 -0.470 25153 15030 1 17 . 1 1 8 8 GLY H H 8 7.031 7.031 8.575 -1.544 25153 15031 1 17 . 1 1 9 9 SER N N 9 118.150 118.150 116.298 1.852 25153 15032 1 17 . 1 1 9 9 SER HA H 9 5.200 5.200 5.159 0.041 25153 15033 1 17 . 1 1 9 9 SER C C 9 175.000 175.000 174.005 0.995 25153 15034 1 17 . 1 1 9 9 SER CA C 9 57.570 57.570 57.915 -0.345 25153 15035 1 17 . 1 1 9 9 SER CB C 9 66.700 66.700 65.178 1.522 25153 15036 1 17 . 1 1 9 9 SER H H 9 9.604 9.604 8.512 1.092 25153 15037 1 17 . 1 1 10 10 SER N N 10 131.193 131.193 121.675 9.518 25153 15038 1 17 . 1 1 10 10 SER HA H 10 4.775 4.775 4.806 -0.031 25153 15039 1 17 . 1 1 10 10 SER C C 10 175.730 175.730 175.310 0.420 25153 15040 1 17 . 1 1 10 10 SER CA C 10 61.750 61.750 59.689 2.061 25153 15041 1 17 . 1 1 10 10 SER CB C 10 64.400 64.400 64.046 0.354 25153 15042 1 17 . 1 1 10 10 SER H H 10 11.636 11.636 9.532 2.104 25153 15043 1 17 . 1 1 11 11 THR N N 11 115.848 115.848 112.032 3.816 25153 15044 1 17 . 1 1 11 11 THR HA H 11 4.770 4.770 4.391 0.379 25153 15045 1 17 . 1 1 11 11 THR C C 11 173.700 173.700 174.410 -0.710 25153 15046 1 17 . 1 1 11 11 THR CA C 11 60.700 60.700 62.017 -1.317 25153 15047 1 17 . 1 1 11 11 THR CB C 11 67.430 67.430 69.761 -2.331 25153 15048 1 17 . 1 1 11 11 THR H H 11 9.550 9.550 8.407 1.143 25153 15049 1 17 . 1 1 12 12 CYS N N 12 109.780 109.780 118.113 -8.333 25153 15050 1 17 . 1 1 12 12 CYS HA H 12 4.070 4.070 3.929 0.141 25153 15051 1 17 . 1 1 12 12 CYS C C 12 176.220 176.220 175.897 0.323 25153 15052 1 17 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.554 3.046 25153 15053 1 17 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.783 0.617 25153 15054 1 17 . 1 1 12 12 CYS H H 12 7.437 7.437 7.879 -0.442 25153 15055 1 17 . 1 1 13 13 TYR N N 13 127.830 127.830 119.384 8.446 25153 15056 1 17 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.185 -0.082 25153 15057 1 17 . 1 1 13 13 TYR C C 13 180.880 180.880 177.870 3.010 25153 15058 1 17 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.941 3.159 25153 15059 1 17 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.560 -0.725 25153 15060 1 17 . 1 1 13 13 TYR H H 13 10.886 10.886 8.032 2.854 25153 15061 1 17 . 1 1 14 14 THR N N 14 124.428 124.428 113.477 10.951 25153 15062 1 17 . 1 1 14 14 THR HA H 14 4.160 4.160 4.129 0.031 25153 15063 1 17 . 1 1 14 14 THR C C 14 177.760 177.760 176.091 1.669 25153 15064 1 17 . 1 1 14 14 THR CA C 14 67.823 67.823 66.573 1.250 25153 15065 1 17 . 1 1 14 14 THR CB C 14 68.040 68.040 68.537 -0.497 25153 15066 1 17 . 1 1 14 14 THR H H 14 11.405 11.405 8.137 3.268 25153 15067 1 17 . 1 1 15 15 GLU N N 15 123.050 123.050 122.850 0.200 25153 15068 1 17 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.159 -0.269 25153 15069 1 17 . 1 1 15 15 GLU C C 15 176.392 176.392 178.168 -1.776 25153 15070 1 17 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.281 -0.080 25153 15071 1 17 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.280 1.170 25153 15072 1 17 . 1 1 16 16 MET N N 16 120.173 120.173 118.066 2.107 25153 15073 1 17 . 1 1 16 16 MET HA H 16 4.050 4.050 4.131 -0.081 25153 15074 1 17 . 1 1 16 16 MET C C 16 179.940 179.940 178.593 1.347 25153 15075 1 17 . 1 1 16 16 MET CA C 16 59.240 59.240 59.179 0.061 25153 15076 1 17 . 1 1 16 16 MET CB C 16 32.970 32.970 32.825 0.145 25153 15077 1 17 . 1 1 16 16 MET H H 16 8.469 8.469 8.348 0.121 25153 15078 1 17 . 1 1 17 17 ALA N N 17 121.930 121.930 121.716 0.214 25153 15079 1 17 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.852 -0.016 25153 15080 1 17 . 1 1 17 17 ALA C C 17 177.900 177.900 178.749 -0.849 25153 15081 1 17 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.034 0.166 25153 15082 1 17 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.087 -0.087 25153 15083 1 17 . 1 1 17 17 ALA H H 17 7.880 7.880 7.656 0.224 25153 15084 1 17 . 1 1 18 18 ALA N N 18 121.477 121.477 121.453 0.024 25153 15085 1 17 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.799 -0.062 25153 15086 1 17 . 1 1 18 18 ALA C C 18 179.380 179.380 179.532 -0.152 25153 15087 1 17 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.255 -0.255 25153 15088 1 17 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.772 1.058 25153 15089 1 17 . 1 1 18 18 ALA H H 18 7.374 7.374 8.082 -0.708 25153 15090 1 17 . 1 1 19 19 GLU N N 19 116.650 116.650 117.973 -1.323 25153 15091 1 17 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.843 -0.227 25153 15092 1 17 . 1 1 19 19 GLU C C 19 178.479 178.479 179.305 -0.826 25153 15093 1 17 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.472 0.258 25153 15094 1 17 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.367 -0.067 25153 15095 1 17 . 1 1 20 20 LYS N N 20 119.470 119.470 119.883 -0.413 25153 15096 1 17 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.016 0.034 25153 15097 1 17 . 1 1 20 20 LYS C C 20 179.116 179.116 179.050 0.066 25153 15098 1 17 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.434 0.396 25153 15099 1 17 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.426 0.424 25153 15100 1 17 . 1 1 21 21 ILE N N 21 121.030 121.030 120.785 0.245 25153 15101 1 17 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.683 -0.293 25153 15102 1 17 . 1 1 21 21 ILE C C 21 177.580 177.580 178.194 -0.614 25153 15103 1 17 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.769 0.051 25153 15104 1 17 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.903 0.445 25153 15105 1 17 . 1 1 21 21 ILE H H 21 8.100 8.100 8.601 -0.501 25153 15106 1 17 . 1 1 22 22 ARG N N 22 119.720 119.720 119.478 0.242 25153 15107 1 17 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.850 -0.295 25153 15108 1 17 . 1 1 22 22 ARG C C 22 177.320 177.320 178.120 -0.800 25153 15109 1 17 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.721 -0.001 25153 15110 1 17 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.721 -0.789 25153 15111 1 17 . 1 1 23 23 ASP N N 23 118.730 118.730 119.357 -0.627 25153 15112 1 17 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.410 -0.047 25153 15113 1 17 . 1 1 23 23 ASP C C 23 178.330 178.330 178.795 -0.465 25153 15114 1 17 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.368 -0.418 25153 15115 1 17 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.854 -0.614 25153 15116 1 17 . 1 1 24 24 ILE N N 24 121.090 121.090 119.440 1.650 25153 15117 1 17 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.792 0.004 25153 15118 1 17 . 1 1 24 24 ILE C C 24 178.250 178.250 177.915 0.335 25153 15119 1 17 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.765 -0.615 25153 15120 1 17 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.299 0.181 25153 15121 1 17 . 1 1 24 24 ILE H H 24 7.910 7.910 8.215 -0.305 25153 15122 1 17 . 1 1 25 25 ILE N N 25 121.406 121.406 117.352 4.054 25153 15123 1 17 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.865 -0.219 25153 15124 1 17 . 1 1 25 25 ILE C C 25 176.800 176.800 176.756 0.044 25153 15125 1 17 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.050 2.650 25153 15126 1 17 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.923 -0.733 25153 15127 1 17 . 1 1 25 25 ILE H H 25 8.476 8.476 8.068 0.408 25153 15128 1 17 . 1 1 26 26 GLY N N 26 108.900 108.900 105.149 3.751 25153 15129 1 17 . 1 1 26 26 GLY C C 26 173.710 173.710 172.266 1.444 25153 15130 1 17 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.644 -0.314 25153 15131 1 17 . 1 1 26 26 GLY H H 26 8.016 8.016 7.781 0.235 25153 15132 1 17 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.710 -0.372 25153 15133 1 17 . 1 1 27 27 PRO C C 27 177.200 177.200 177.180 0.020 25153 15134 1 17 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.511 1.175 25153 15135 1 17 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.026 0.174 25153 15136 1 17 . 1 1 28 28 GLU N N 28 116.295 116.295 118.257 -1.962 25153 15137 1 17 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.186 0.084 25153 15138 1 17 . 1 1 28 28 GLU C C 28 176.980 176.980 177.166 -0.186 25153 15139 1 17 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.497 -0.757 25153 15140 1 17 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.532 -0.862 25153 15141 1 17 . 1 1 29 29 LEU N N 29 120.250 120.250 111.904 8.346 25153 15142 1 17 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.656 -0.020 25153 15143 1 17 . 1 1 29 29 LEU C C 29 175.770 175.770 175.685 0.085 25153 15144 1 17 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.321 0.479 25153 15145 1 17 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.876 1.224 25153 15146 1 17 . 1 1 29 29 LEU H H 29 7.940 7.940 7.546 0.394 25153 15147 1 17 . 1 1 30 30 VAL N N 30 118.693 118.693 121.633 -2.940 25153 15148 1 17 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.831 -0.183 25153 15149 1 17 . 1 1 30 30 VAL C C 30 174.347 174.347 175.845 -1.498 25153 15150 1 17 . 1 1 30 30 VAL CA C 30 60.868 60.868 62.381 -1.513 25153 15151 1 17 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.812 1.768 25153 15152 1 17 . 1 1 30 30 VAL H H 30 7.434 7.434 8.006 -0.572 25153 15153 1 17 . 1 1 31 31 THR N N 31 123.800 123.800 122.446 1.354 25153 15154 1 17 . 1 1 31 31 THR HA H 31 4.362 4.362 4.546 -0.184 25153 15155 1 17 . 1 1 31 31 THR C C 31 172.964 172.964 173.193 -0.229 25153 15156 1 17 . 1 1 31 31 THR CA C 31 61.720 61.720 60.770 0.950 25153 15157 1 17 . 1 1 31 31 THR CB C 31 70.485 70.485 70.792 -0.307 25153 15158 1 17 . 1 1 31 31 THR H H 31 7.844 7.844 8.271 -0.427 25153 15159 1 17 . 1 1 32 32 LEU N N 32 127.800 127.800 127.231 0.569 25153 15160 1 17 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.511 0.173 25153 15161 1 17 . 1 1 32 32 LEU C C 32 176.600 176.600 176.550 0.050 25153 15162 1 17 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.130 0.025 25153 15163 1 17 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.648 1.202 25153 15164 1 17 . 1 1 32 32 LEU H H 32 8.660 8.660 8.576 0.084 25153 15165 1 17 . 1 1 33 33 HIS N N 33 119.670 119.670 119.822 -0.152 25153 15166 1 17 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.607 -0.207 25153 15167 1 17 . 1 1 33 33 HIS C C 33 171.667 171.667 173.201 -1.534 25153 15168 1 17 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.951 0.249 25153 15169 1 17 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.434 0.766 25153 15170 1 17 . 1 1 33 33 HIS H H 33 9.060 9.060 8.592 0.468 25153 15171 1 17 . 1 1 34 34 ASN N N 34 124.068 124.068 123.775 0.293 25153 15172 1 17 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.059 -0.625 25153 15173 1 17 . 1 1 34 34 ASN C C 34 178.000 178.000 175.385 2.615 25153 15174 1 17 . 1 1 34 34 ASN CA C 34 51.429 51.429 53.083 -1.654 25153 15175 1 17 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.208 -0.648 25153 15176 1 17 . 1 1 34 34 ASN H H 34 8.780 8.780 8.630 0.150 25153 15177 1 17 . 1 1 35 35 LEU N N 35 129.040 129.040 125.926 3.114 25153 15178 1 17 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.326 -0.011 25153 15179 1 17 . 1 1 35 35 LEU C C 35 177.700 177.700 177.626 0.074 25153 15180 1 17 . 1 1 35 35 LEU CA C 35 56.480 56.480 55.947 0.533 25153 15181 1 17 . 1 1 35 35 LEU CB C 35 42.300 42.300 41.462 0.838 25153 15182 1 17 . 1 1 35 35 LEU H H 35 8.821 8.821 8.281 0.540 25153 15183 1 17 . 1 1 36 36 LYS N N 36 121.043 121.043 117.654 3.389 25153 15184 1 17 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.058 -0.178 25153 15185 1 17 . 1 1 36 36 LYS C C 36 176.230 176.230 177.347 -1.117 25153 15186 1 17 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.530 0.890 25153 15187 1 17 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.394 0.876 25153 15188 1 17 . 1 1 37 37 ASP N N 37 114.965 114.965 119.280 -4.315 25153 15189 1 17 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.716 0.061 25153 15190 1 17 . 1 1 37 37 ASP C C 37 175.440 175.440 176.146 -0.706 25153 15191 1 17 . 1 1 37 37 ASP CA C 37 54.711 54.711 55.386 -0.675 25153 15192 1 17 . 1 1 37 37 ASP CB C 37 44.700 44.700 42.828 1.872 25153 15193 1 17 . 1 1 38 38 ASP N N 38 121.650 121.650 117.624 4.026 25153 15194 1 17 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.973 -0.103 25153 15195 1 17 . 1 1 38 38 ASP C C 38 174.852 174.852 174.843 0.009 25153 15196 1 17 . 1 1 38 38 ASP CA C 38 53.080 53.080 52.944 0.136 25153 15197 1 17 . 1 1 38 38 ASP CB C 38 42.110 42.110 44.469 -2.359 25153 15198 1 17 . 1 1 39 39 SER N N 39 115.207 115.207 115.055 0.152 25153 15199 1 17 . 1 1 39 39 SER HA H 39 4.585 4.585 4.777 -0.192 25153 15200 1 17 . 1 1 39 39 SER C C 39 175.040 175.040 173.911 1.129 25153 15201 1 17 . 1 1 39 39 SER CA C 39 54.960 54.960 56.385 -1.425 25153 15202 1 17 . 1 1 39 39 SER CB C 39 64.720 64.720 63.600 1.120 25153 15203 1 17 . 1 1 39 39 SER H H 39 8.351 8.351 8.448 -0.097 25153 15204 1 17 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.371 -0.366 25153 15205 1 17 . 1 1 40 40 PRO C C 40 176.730 176.730 177.817 -1.087 25153 15206 1 17 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.142 -0.242 25153 15207 1 17 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.945 -0.545 25153 15208 1 17 . 1 1 41 41 LYS N N 41 121.150 121.150 119.770 1.380 25153 15209 1 17 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.993 -0.081 25153 15210 1 17 . 1 1 41 41 LYS C C 41 179.600 179.600 178.435 1.165 25153 15211 1 17 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.536 -1.336 25153 15212 1 17 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.626 0.374 25153 15213 1 17 . 1 1 42 42 LEU N N 42 118.103 118.103 115.988 2.115 25153 15214 1 17 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.145 -0.108 25153 15215 1 17 . 1 1 42 42 LEU C C 42 178.760 178.760 178.722 0.038 25153 15216 1 17 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.275 -0.095 25153 15217 1 17 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.456 1.517 25153 15218 1 17 . 1 1 42 42 LEU H H 42 7.600 7.600 7.747 -0.147 25153 15219 1 17 . 1 1 43 43 MET N N 43 118.917 118.917 117.233 1.684 25153 15220 1 17 . 1 1 43 43 MET HA H 43 3.750 3.750 4.426 -0.676 25153 15221 1 17 . 1 1 43 43 MET C C 43 177.680 177.680 177.012 0.668 25153 15222 1 17 . 1 1 43 43 MET CA C 43 59.730 59.730 58.024 1.706 25153 15223 1 17 . 1 1 43 43 MET CB C 43 32.700 32.700 31.793 0.907 25153 15224 1 17 . 1 1 43 43 MET H H 43 8.202 8.202 8.021 0.181 25153 15225 1 17 . 1 1 44 44 GLU N N 44 110.924 110.924 118.104 -7.180 25153 15226 1 17 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.297 -0.557 25153 15227 1 17 . 1 1 44 44 GLU C C 44 178.130 178.130 178.860 -0.730 25153 15228 1 17 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.246 1.154 25153 15229 1 17 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.922 -0.372 25153 15230 1 17 . 1 1 45 45 GLN N N 45 115.756 115.756 118.702 -2.946 25153 15231 1 17 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.008 0.175 25153 15232 1 17 . 1 1 45 45 GLN C C 45 175.414 175.414 177.164 -1.750 25153 15233 1 17 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.615 -1.435 25153 15234 1 17 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.036 -0.436 25153 15235 1 17 . 1 1 45 45 GLN H H 45 7.516 7.516 7.449 0.067 25153 15236 1 17 . 1 1 46 46 TYR N N 46 117.860 117.860 118.697 -0.837 25153 15237 1 17 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.350 0.313 25153 15238 1 17 . 1 1 46 46 TYR C C 46 175.500 175.500 177.209 -1.709 25153 15239 1 17 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.415 -0.929 25153 15240 1 17 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.174 3.296 25153 15241 1 17 . 1 1 46 46 TYR H H 46 6.996 6.996 7.124 -0.128 25153 15242 1 17 . 1 1 47 47 ASP N N 47 121.683 121.683 121.502 0.181 25153 15243 1 17 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.624 0.076 25153 15244 1 17 . 1 1 47 47 ASP C C 47 175.610 175.610 175.222 0.388 25153 15245 1 17 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.329 -0.629 25153 15246 1 17 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.972 1.028 25153 15247 1 17 . 1 1 48 48 VAL N N 48 118.628 118.628 116.311 2.317 25153 15248 1 17 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.790 0.244 25153 15249 1 17 . 1 1 48 48 VAL C C 48 174.190 174.190 174.006 0.184 25153 15250 1 17 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.421 -1.231 25153 15251 1 17 . 1 1 48 48 VAL CB C 48 36.100 36.100 36.007 0.093 25153 15252 1 17 . 1 1 48 48 VAL H H 48 7.628 7.628 7.374 0.254 25153 15253 1 17 . 1 1 49 49 LEU N N 49 128.190 128.190 123.706 4.484 25153 15254 1 17 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.449 0.154 25153 15255 1 17 . 1 1 49 49 LEU C C 49 174.880 174.880 175.566 -0.686 25153 15256 1 17 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.543 -1.303 25153 15257 1 17 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.154 -0.814 25153 15258 1 17 . 1 1 49 49 LEU H H 49 9.407 9.407 9.094 0.313 25153 15259 1 17 . 1 1 50 50 ILE N N 50 124.550 124.550 120.884 3.666 25153 15260 1 17 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.074 0.626 25153 15261 1 17 . 1 1 50 50 ILE C C 50 175.300 175.300 174.639 0.661 25153 15262 1 17 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.914 -1.050 25153 15263 1 17 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.803 -0.553 25153 15264 1 17 . 1 1 50 50 ILE H H 50 9.238 9.238 9.214 0.024 25153 15265 1 17 . 1 1 51 51 LEU N N 51 127.460 127.460 128.336 -0.876 25153 15266 1 17 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.932 0.253 25153 15267 1 17 . 1 1 51 51 LEU C C 51 174.544 174.544 176.081 -1.537 25153 15268 1 17 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.353 -0.533 25153 15269 1 17 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.305 -2.668 25153 15270 1 17 . 1 1 51 51 LEU H H 51 9.228 9.228 9.125 0.103 25153 15271 1 17 . 1 1 52 52 GLY N N 52 107.760 107.760 109.634 -1.874 25153 15272 1 17 . 1 1 52 52 GLY C C 52 174.710 174.710 172.064 2.646 25153 15273 1 17 . 1 1 52 52 GLY CA C 52 43.870 43.870 44.528 -0.658 25153 15274 1 17 . 1 1 52 52 GLY H H 52 8.860 8.860 8.594 0.266 25153 15275 1 17 . 1 1 53 53 ILE N N 53 123.890 123.890 116.473 7.417 25153 15276 1 17 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.904 0.366 25153 15277 1 17 . 1 1 53 53 ILE C C 53 172.630 172.630 173.114 -0.484 25153 15278 1 17 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.884 -0.204 25153 15279 1 17 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.777 3.383 25153 15280 1 17 . 1 1 53 53 ILE H H 53 8.458 8.458 7.872 0.586 25153 15281 1 17 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.676 0.712 25153 15282 1 17 . 1 1 54 54 PRO C C 54 175.000 175.000 176.111 -1.111 25153 15283 1 17 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.905 -0.305 25153 15284 1 17 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.602 -0.302 25153 15285 1 17 . 1 1 55 55 THR N N 55 112.754 112.754 119.573 -6.819 25153 15286 1 17 . 1 1 55 55 THR HA H 55 4.452 4.452 4.630 -0.178 25153 15287 1 17 . 1 1 55 55 THR C C 55 172.480 172.480 174.369 -1.889 25153 15288 1 17 . 1 1 55 55 THR CA C 55 62.350 62.350 63.913 -1.563 25153 15289 1 17 . 1 1 55 55 THR CB C 55 70.230 70.230 69.442 0.788 25153 15290 1 17 . 1 1 55 55 THR H H 55 6.523 6.523 8.180 -1.657 25153 15291 1 17 . 1 1 56 56 TRP N N 56 130.044 130.044 127.903 2.141 25153 15292 1 17 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.573 -1.858 25153 15293 1 17 . 1 1 56 56 TRP C C 56 172.890 172.890 175.516 -2.626 25153 15294 1 17 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.660 -0.009 25153 15295 1 17 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.395 1.605 25153 15296 1 17 . 1 1 56 56 TRP H H 56 8.450 8.450 8.853 -0.403 25153 15297 1 17 . 1 1 57 57 ASP N N 57 115.275 115.275 121.557 -6.282 25153 15298 1 17 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.757 0.595 25153 15299 1 17 . 1 1 57 57 ASP C C 57 173.660 173.660 174.965 -1.305 25153 15300 1 17 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.017 1.213 25153 15301 1 17 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.745 0.425 25153 15302 1 17 . 1 1 58 58 PHE N N 58 112.840 112.840 117.602 -4.762 25153 15303 1 17 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.449 -0.125 25153 15304 1 17 . 1 1 58 58 PHE C C 58 175.730 175.730 176.256 -0.526 25153 15305 1 17 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.533 1.290 25153 15306 1 17 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.816 -2.062 25153 15307 1 17 . 1 1 58 58 PHE H H 58 7.640 7.640 7.689 -0.049 25153 15308 1 17 . 1 1 59 59 GLY N N 59 104.940 104.940 106.116 -1.176 25153 15309 1 17 . 1 1 59 59 GLY C C 59 173.750 173.750 173.687 0.063 25153 15310 1 17 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.154 1.135 25153 15311 1 17 . 1 1 59 59 GLY H H 59 8.024 8.024 8.545 -0.521 25153 15312 1 17 . 1 1 60 60 GLU N N 60 120.045 120.045 119.062 0.983 25153 15313 1 17 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.515 -0.102 25153 15314 1 17 . 1 1 60 60 GLU C C 60 176.050 176.050 175.397 0.653 25153 15315 1 17 . 1 1 60 60 GLU CA C 60 54.620 54.620 54.566 0.054 25153 15316 1 17 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.832 -1.222 25153 15317 1 17 . 1 1 61 61 ILE N N 61 120.790 120.790 121.942 -1.152 25153 15318 1 17 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.289 -0.822 25153 15319 1 17 . 1 1 61 61 ILE C C 61 175.130 175.130 176.146 -1.016 25153 15320 1 17 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.583 0.965 25153 15321 1 17 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.180 -0.330 25153 15322 1 17 . 1 1 61 61 ILE H H 61 8.200 8.200 8.315 -0.115 25153 15323 1 17 . 1 1 62 62 GLN N N 62 124.520 124.520 124.095 0.425 25153 15324 1 17 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.072 -0.116 25153 15325 1 17 . 1 1 62 62 GLN C C 62 177.160 177.160 177.274 -0.114 25153 15326 1 17 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.228 1.382 25153 15327 1 17 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.155 -2.505 25153 15328 1 17 . 1 1 62 62 GLN H H 62 5.667 5.667 8.888 -3.221 25153 15329 1 17 . 1 1 63 63 GLU N N 63 124.570 124.570 126.706 -2.136 25153 15330 1 17 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.133 -0.147 25153 15331 1 17 . 1 1 63 63 GLU C C 63 177.300 177.300 177.367 -0.067 25153 15332 1 17 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.068 1.652 25153 15333 1 17 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.201 0.919 25153 15334 1 17 . 1 1 64 64 ASP N N 64 119.060 119.060 119.132 -0.072 25153 15335 1 17 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.415 0.205 25153 15336 1 17 . 1 1 64 64 ASP C C 64 179.180 179.180 177.319 1.861 25153 15337 1 17 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.076 1.874 25153 15338 1 17 . 1 1 64 64 ASP CB C 64 40.950 40.950 39.804 1.146 25153 15339 1 17 . 1 1 65 65 TRP N N 65 121.070 121.070 121.747 -0.677 25153 15340 1 17 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.553 -0.213 25153 15341 1 17 . 1 1 65 65 TRP C C 65 178.970 178.970 178.753 0.217 25153 15342 1 17 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.150 0.670 25153 15343 1 17 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.334 0.066 25153 15344 1 17 . 1 1 65 65 TRP H H 65 7.350 7.350 7.725 -0.375 25153 15345 1 17 . 1 1 66 66 GLU N N 66 120.900 120.900 118.735 2.165 25153 15346 1 17 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.888 -0.048 25153 15347 1 17 . 1 1 66 66 GLU C C 66 178.750 178.750 179.137 -0.387 25153 15348 1 17 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.474 0.526 25153 15349 1 17 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.272 -0.412 25153 15350 1 17 . 1 1 67 67 ALA N N 67 119.130 119.130 119.908 -0.778 25153 15351 1 17 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.242 0.011 25153 15352 1 17 . 1 1 67 67 ALA C C 67 179.410 179.410 179.128 0.282 25153 15353 1 17 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.755 -0.175 25153 15354 1 17 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.833 -0.023 25153 15355 1 17 . 1 1 67 67 ALA H H 67 7.640 7.640 8.032 -0.392 25153 15356 1 17 . 1 1 68 68 VAL N N 68 106.845 106.845 111.571 -4.726 25153 15357 1 17 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.320 0.490 25153 15358 1 17 . 1 1 68 68 VAL C C 68 176.750 176.750 177.132 -0.382 25153 15359 1 17 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.785 -3.175 25153 15360 1 17 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.928 -0.308 25153 15361 1 17 . 1 1 68 68 VAL H H 68 7.219 7.219 7.448 -0.229 25153 15362 1 17 . 1 1 69 69 TRP N N 69 127.630 127.630 124.181 3.449 25153 15363 1 17 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.292 -0.054 25153 15364 1 17 . 1 1 69 69 TRP C C 69 178.670 178.670 177.117 1.553 25153 15365 1 17 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.677 -1.457 25153 15366 1 17 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.857 1.773 25153 15367 1 17 . 1 1 69 69 TRP H H 69 7.832 7.832 8.655 -0.823 25153 15368 1 17 . 1 1 70 70 ASP N N 70 114.544 114.544 118.343 -3.799 25153 15369 1 17 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.468 0.054 25153 15370 1 17 . 1 1 70 70 ASP C C 70 178.670 178.670 179.000 -0.330 25153 15371 1 17 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.301 -1.301 25153 15372 1 17 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.976 -1.126 25153 15373 1 17 . 1 1 71 71 GLN N N 71 120.040 120.040 119.524 0.516 25153 15374 1 17 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.127 0.057 25153 15375 1 17 . 1 1 71 71 GLN C C 71 178.910 178.910 178.799 0.111 25153 15376 1 17 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.379 -0.769 25153 15377 1 17 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.845 0.255 25153 15378 1 17 . 1 1 71 71 GLN H H 71 7.995 7.995 7.670 0.325 25153 15379 1 17 . 1 1 72 72 LEU N N 72 117.400 117.400 119.097 -1.697 25153 15380 1 17 . 1 1 72 72 LEU HA H 72 3.813 3.813 4.000 -0.187 25153 15381 1 17 . 1 1 72 72 LEU C C 72 178.650 178.650 178.336 0.314 25153 15382 1 17 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.334 -0.134 25153 15383 1 17 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.209 0.201 25153 15384 1 17 . 1 1 72 72 LEU H H 72 7.450 7.450 8.016 -0.566 25153 15385 1 17 . 1 1 73 73 ASP N N 73 115.750 115.750 118.412 -2.662 25153 15386 1 17 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.409 -0.241 25153 15387 1 17 . 1 1 73 73 ASP C C 73 177.560 177.560 177.598 -0.038 25153 15388 1 17 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.620 0.780 25153 15389 1 17 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.147 -1.047 25153 15390 1 17 . 1 1 74 74 ASP N N 74 117.223 117.223 119.914 -2.691 25153 15391 1 17 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.584 0.119 25153 15392 1 17 . 1 1 74 74 ASP C C 74 176.388 176.388 177.028 -0.640 25153 15393 1 17 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.125 -0.625 25153 15394 1 17 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.580 0.120 25153 15395 1 17 . 1 1 75 75 LEU N N 75 118.316 118.316 119.433 -1.117 25153 15396 1 17 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.390 -0.105 25153 15397 1 17 . 1 1 75 75 LEU C C 75 176.820 176.820 175.822 0.998 25153 15398 1 17 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.367 0.033 25153 15399 1 17 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.512 0.768 25153 15400 1 17 . 1 1 75 75 LEU H H 75 6.960 6.960 7.300 -0.340 25153 15401 1 17 . 1 1 76 76 ASN N N 76 123.045 123.045 118.173 4.872 25153 15402 1 17 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.771 0.119 25153 15403 1 17 . 1 1 76 76 ASN C C 76 174.950 174.950 174.820 0.130 25153 15404 1 17 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.675 -0.625 25153 15405 1 17 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.459 -0.959 25153 15406 1 17 . 1 1 76 76 ASN H H 76 9.890 9.890 8.825 1.065 25153 15407 1 17 . 1 1 77 77 LEU N N 77 123.494 123.494 123.300 0.194 25153 15408 1 17 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.533 -0.163 25153 15409 1 17 . 1 1 77 77 LEU C C 77 175.040 175.040 176.392 -1.352 25153 15410 1 17 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.881 -1.631 25153 15411 1 17 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.338 0.562 25153 15412 1 17 . 1 1 77 77 LEU H H 77 8.730 8.730 8.021 0.709 25153 15413 1 17 . 1 1 78 78 GLU N N 78 120.870 120.870 121.686 -0.816 25153 15414 1 17 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.367 -0.467 25153 15415 1 17 . 1 1 78 78 GLU C C 78 178.660 178.660 177.783 0.877 25153 15416 1 17 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.690 1.070 25153 15417 1 17 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.201 0.199 25153 15418 1 17 . 1 1 79 79 GLY N N 79 113.240 113.240 113.692 -0.452 25153 15419 1 17 . 1 1 79 79 GLY C C 79 174.460 174.460 174.561 -0.101 25153 15420 1 17 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.209 0.221 25153 15421 1 17 . 1 1 79 79 GLY H H 79 8.474 8.474 8.939 -0.465 25153 15422 1 17 . 1 1 80 80 LYS N N 80 120.295 120.295 121.198 -0.903 25153 15423 1 17 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.511 -0.153 25153 15424 1 17 . 1 1 80 80 LYS C C 80 175.360 175.360 176.043 -0.683 25153 15425 1 17 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.680 0.290 25153 15426 1 17 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.594 -0.394 25153 15427 1 17 . 1 1 81 81 ILE N N 81 122.400 122.400 121.978 0.422 25153 15428 1 17 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.671 0.122 25153 15429 1 17 . 1 1 81 81 ILE C C 81 174.760 174.760 175.469 -0.709 25153 15430 1 17 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.272 -1.442 25153 15431 1 17 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.994 -0.294 25153 15432 1 17 . 1 1 81 81 ILE H H 81 7.400 7.400 7.820 -0.420 25153 15433 1 17 . 1 1 82 82 VAL N N 82 127.840 127.840 125.517 2.323 25153 15434 1 17 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.066 0.196 25153 15435 1 17 . 1 1 82 82 VAL C C 82 172.724 172.724 174.416 -1.692 25153 15436 1 17 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.251 0.159 25153 15437 1 17 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.075 0.325 25153 15438 1 17 . 1 1 82 82 VAL H H 82 8.790 8.790 8.726 0.064 25153 15439 1 17 . 1 1 83 83 ALA N N 83 131.347 131.347 130.379 0.968 25153 15440 1 17 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.293 0.089 25153 15441 1 17 . 1 1 83 83 ALA C C 83 175.750 175.750 176.423 -0.673 25153 15442 1 17 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.178 -0.308 25153 15443 1 17 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.115 2.335 25153 15444 1 17 . 1 1 83 83 ALA H H 83 9.300 9.300 8.894 0.406 25153 15445 1 17 . 1 1 84 84 LEU N N 84 124.200 124.200 126.501 -2.301 25153 15446 1 17 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.750 -0.230 25153 15447 1 17 . 1 1 84 84 LEU C C 84 175.760 175.760 176.868 -1.108 25153 15448 1 17 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.800 -0.300 25153 15449 1 17 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.474 1.426 25153 15450 1 17 . 1 1 84 84 LEU H H 84 10.287 10.287 9.051 1.236 25153 15451 1 17 . 1 1 85 85 TYR N N 85 115.912 115.912 118.997 -3.085 25153 15452 1 17 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.334 -0.374 25153 15453 1 17 . 1 1 85 85 TYR C C 85 172.372 172.372 173.664 -1.292 25153 15454 1 17 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.265 0.835 25153 15455 1 17 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.430 1.600 25153 15456 1 17 . 1 1 85 85 TYR H H 85 9.257 9.257 8.618 0.639 25153 15457 1 17 . 1 1 86 86 GLY N N 86 107.800 107.800 105.894 1.906 25153 15458 1 17 . 1 1 86 86 GLY C C 86 170.330 170.330 171.540 -1.210 25153 15459 1 17 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.856 -0.486 25153 15460 1 17 . 1 1 86 86 GLY H H 86 9.027 9.027 8.630 0.397 25153 15461 1 17 . 1 1 87 87 LEU N N 87 123.458 123.458 118.775 4.683 25153 15462 1 17 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.203 0.262 25153 15463 1 17 . 1 1 87 87 LEU C C 87 178.100 178.100 176.064 2.036 25153 15464 1 17 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.887 0.703 25153 15465 1 17 . 1 1 87 87 LEU CB C 87 45.340 45.340 44.712 0.629 25153 15466 1 17 . 1 1 87 87 LEU H H 87 6.580 6.580 7.884 -1.304 25153 15467 1 17 . 1 1 88 88 GLY N N 88 108.966 108.966 108.192 0.774 25153 15468 1 17 . 1 1 88 88 GLY C C 88 172.820 172.820 171.616 1.204 25153 15469 1 17 . 1 1 88 88 GLY CA C 88 46.660 46.660 44.111 2.549 25153 15470 1 17 . 1 1 88 88 GLY H H 88 8.070 8.070 8.534 -0.464 25153 15471 1 17 . 1 1 89 89 ASP N N 89 121.150 121.150 116.415 4.735 25153 15472 1 17 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.111 0.135 25153 15473 1 17 . 1 1 89 89 ASP C C 89 176.220 176.220 176.197 0.023 25153 15474 1 17 . 1 1 89 89 ASP CA C 89 52.470 52.470 53.255 -0.785 25153 15475 1 17 . 1 1 89 89 ASP CB C 89 42.480 42.480 44.100 -1.620 25153 15476 1 17 . 1 1 90 90 GLN N N 90 123.970 123.970 123.156 0.814 25153 15477 1 17 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.390 -0.902 25153 15478 1 17 . 1 1 90 90 GLN C C 90 173.646 173.646 176.500 -2.854 25153 15479 1 17 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.682 0.628 25153 15480 1 17 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.916 -0.706 25153 15481 1 17 . 1 1 90 90 GLN H H 90 8.623 8.623 8.914 -0.291 25153 15482 1 17 . 1 1 91 91 LEU N N 91 118.017 118.017 120.306 -2.289 25153 15483 1 17 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.101 0.274 25153 15484 1 17 . 1 1 91 91 LEU C C 91 180.160 180.160 178.539 1.621 25153 15485 1 17 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.508 -0.448 25153 15486 1 17 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.983 -0.434 25153 15487 1 17 . 1 1 91 91 LEU H H 91 7.046 7.046 8.873 -1.827 25153 15488 1 17 . 1 1 92 92 GLY N N 92 110.028 110.028 104.107 5.921 25153 15489 1 17 . 1 1 92 92 GLY C C 92 174.912 174.912 174.552 0.360 25153 15490 1 17 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.049 1.131 25153 15491 1 17 . 1 1 92 92 GLY H H 92 9.238 9.238 8.699 0.539 25153 15492 1 17 . 1 1 93 93 TYR N N 93 115.910 115.910 119.246 -3.336 25153 15493 1 17 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.382 -0.373 25153 15494 1 17 . 1 1 93 93 TYR C C 93 176.850 176.850 176.862 -0.012 25153 15495 1 17 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.415 0.315 25153 15496 1 17 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.988 -0.858 25153 15497 1 17 . 1 1 93 93 TYR H H 93 6.962 6.962 7.749 -0.787 25153 15498 1 17 . 1 1 94 94 GLY N N 94 111.630 111.630 110.336 1.294 25153 15499 1 17 . 1 1 94 94 GLY C C 94 177.777 177.777 175.814 1.963 25153 15500 1 17 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.332 2.698 25153 15501 1 17 . 1 1 94 94 GLY H H 94 7.835 7.835 8.160 -0.325 25153 15502 1 17 . 1 1 95 95 GLU N N 95 122.450 122.450 120.221 2.229 25153 15503 1 17 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.931 -0.013 25153 15504 1 17 . 1 1 95 95 GLU C C 95 175.300 175.300 176.732 -1.432 25153 15505 1 17 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.275 -0.175 25153 15506 1 17 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.173 -0.662 25153 15507 1 17 . 1 1 96 96 TRP N N 96 118.790 118.790 117.520 1.270 25153 15508 1 17 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.936 0.508 25153 15509 1 17 . 1 1 96 96 TRP C C 96 179.280 179.280 175.924 3.356 25153 15510 1 17 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.886 1.129 25153 15511 1 17 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.904 0.116 25153 15512 1 17 . 1 1 96 96 TRP H H 96 8.070 8.070 8.198 -0.128 25153 15513 1 17 . 1 1 97 97 PHE N N 97 128.067 128.067 123.712 4.355 25153 15514 1 17 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.323 0.982 25153 15515 1 17 . 1 1 97 97 PHE C C 97 173.227 173.227 175.978 -2.751 25153 15516 1 17 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.641 -2.921 25153 15517 1 17 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.533 0.407 25153 15518 1 17 . 1 1 97 97 PHE H H 97 7.165 7.165 8.285 -1.120 25153 15519 1 17 . 1 1 98 98 LEU N N 98 114.306 114.306 124.346 -10.040 25153 15520 1 17 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.674 -0.184 25153 15521 1 17 . 1 1 98 98 LEU C C 98 179.365 179.365 177.547 1.818 25153 15522 1 17 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.735 -0.275 25153 15523 1 17 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.909 -0.679 25153 15524 1 17 . 1 1 98 98 LEU H H 98 7.453 7.453 8.646 -1.193 25153 15525 1 17 . 1 1 99 99 ASP N N 99 122.354 122.354 120.541 1.813 25153 15526 1 17 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.319 -0.386 25153 15527 1 17 . 1 1 99 99 ASP C C 99 178.800 178.800 177.157 1.643 25153 15528 1 17 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.857 1.323 25153 15529 1 17 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.435 -1.005 25153 15530 1 17 . 1 1 100 100 ALA N N 100 118.568 118.568 121.829 -3.261 25153 15531 1 17 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.082 -0.242 25153 15532 1 17 . 1 1 100 100 ALA C C 100 178.500 178.500 179.301 -0.801 25153 15533 1 17 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.981 -0.065 25153 15534 1 17 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.374 1.286 25153 15535 1 17 . 1 1 100 100 ALA H H 100 8.682 8.682 7.741 0.941 25153 15536 1 17 . 1 1 101 101 LEU N N 101 118.815 118.815 120.787 -1.972 25153 15537 1 17 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.982 -0.302 25153 15538 1 17 . 1 1 101 101 LEU C C 101 178.930 178.930 178.801 0.129 25153 15539 1 17 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.779 -0.079 25153 15540 1 17 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.565 0.836 25153 15541 1 17 . 1 1 101 101 LEU H H 101 6.637 6.637 7.548 -0.911 25153 15542 1 17 . 1 1 102 102 GLY N N 102 103.700 103.700 106.464 -2.764 25153 15543 1 17 . 1 1 102 102 GLY C C 102 175.530 175.530 176.135 -0.605 25153 15544 1 17 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.292 0.708 25153 15545 1 17 . 1 1 102 102 GLY H H 102 7.330 7.330 8.099 -0.769 25153 15546 1 17 . 1 1 103 103 MET N N 103 120.330 120.330 121.717 -1.387 25153 15547 1 17 . 1 1 103 103 MET HA H 103 4.254 4.254 4.230 0.024 25153 15548 1 17 . 1 1 103 103 MET C C 103 179.688 179.688 178.627 1.061 25153 15549 1 17 . 1 1 103 103 MET CA C 103 59.615 59.615 59.651 -0.036 25153 15550 1 17 . 1 1 103 103 MET CB C 103 33.290 33.290 32.608 0.682 25153 15551 1 17 . 1 1 103 103 MET H H 103 8.407 8.407 8.137 0.270 25153 15552 1 17 . 1 1 104 104 LEU N N 104 123.450 123.450 119.757 3.693 25153 15553 1 17 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.681 0.515 25153 15554 1 17 . 1 1 104 104 LEU C C 104 177.620 177.620 178.766 -1.146 25153 15555 1 17 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.930 0.040 25153 15556 1 17 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.279 0.021 25153 15557 1 17 . 1 1 104 104 LEU H H 104 8.330 8.330 8.579 -0.249 25153 15558 1 17 . 1 1 105 105 HIS N N 105 119.040 119.040 119.273 -0.233 25153 15559 1 17 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.063 -0.186 25153 15560 1 17 . 1 1 105 105 HIS C C 105 177.100 177.100 177.006 0.094 25153 15561 1 17 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.835 0.135 25153 15562 1 17 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.846 -1.253 25153 15563 1 17 . 1 1 105 105 HIS H H 105 8.050 8.050 8.468 -0.418 25153 15564 1 17 . 1 1 106 106 ASP N N 106 119.950 119.950 119.124 0.826 25153 15565 1 17 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.376 -0.046 25153 15566 1 17 . 1 1 106 106 ASP C C 106 179.300 179.300 178.425 0.875 25153 15567 1 17 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.298 0.512 25153 15568 1 17 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.145 -0.745 25153 15569 1 17 . 1 1 107 107 LYS N N 107 122.060 122.060 119.994 2.066 25153 15570 1 17 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.052 0.081 25153 15571 1 17 . 1 1 107 107 LYS C C 107 178.100 178.100 179.437 -1.337 25153 15572 1 17 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.695 -0.495 25153 15573 1 17 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.148 0.212 25153 15574 1 17 . 1 1 108 108 LEU N N 108 115.610 115.610 117.916 -2.306 25153 15575 1 17 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.130 -0.062 25153 15576 1 17 . 1 1 108 108 LEU C C 108 178.866 178.866 178.261 0.605 25153 15577 1 17 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.822 -0.868 25153 15578 1 17 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.560 0.600 25153 15579 1 17 . 1 1 108 108 LEU H H 108 7.828 7.828 8.422 -0.594 25153 15580 1 17 . 1 1 109 109 SER N N 109 116.362 116.362 115.222 1.140 25153 15581 1 17 . 1 1 109 109 SER HA H 109 4.299 4.299 4.306 -0.007 25153 15582 1 17 . 1 1 109 109 SER C C 109 175.660 175.660 176.831 -1.171 25153 15583 1 17 . 1 1 109 109 SER CA C 109 62.350 62.350 61.349 1.001 25153 15584 1 17 . 1 1 109 109 SER CB C 109 62.815 62.815 63.088 -0.273 25153 15585 1 17 . 1 1 109 109 SER H H 109 8.278 8.278 8.619 -0.341 25153 15586 1 17 . 1 1 110 110 THR N N 110 110.230 110.230 116.272 -6.042 25153 15587 1 17 . 1 1 110 110 THR HA H 110 4.615 4.615 4.255 0.360 25153 15588 1 17 . 1 1 110 110 THR C C 110 175.990 175.990 175.482 0.508 25153 15589 1 17 . 1 1 110 110 THR CA C 110 62.090 62.090 64.530 -2.440 25153 15590 1 17 . 1 1 110 110 THR CB C 110 68.800 68.800 68.782 0.018 25153 15591 1 17 . 1 1 110 110 THR H H 110 7.211 7.211 7.833 -0.622 25153 15592 1 17 . 1 1 111 111 LYS N N 111 119.900 119.900 119.598 0.302 25153 15593 1 17 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.376 0.136 25153 15594 1 17 . 1 1 111 111 LYS C C 111 176.916 176.916 176.437 0.479 25153 15595 1 17 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.312 0.342 25153 15596 1 17 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.221 -1.378 25153 15597 1 17 . 1 1 112 112 GLY N N 112 107.910 107.910 108.027 -0.117 25153 15598 1 17 . 1 1 112 112 GLY C C 112 176.250 176.250 174.089 2.161 25153 15599 1 17 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.597 1.443 25153 15600 1 17 . 1 1 112 112 GLY H H 112 8.366 8.366 7.643 0.723 25153 15601 1 17 . 1 1 113 113 VAL N N 113 113.530 113.530 114.863 -1.333 25153 15602 1 17 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.486 -0.012 25153 15603 1 17 . 1 1 113 113 VAL C C 113 174.630 174.630 174.745 -0.115 25153 15604 1 17 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.862 -1.412 25153 15605 1 17 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.824 -0.274 25153 15606 1 17 . 1 1 113 113 VAL H H 113 6.903 6.903 6.991 -0.088 25153 15607 1 17 . 1 1 114 114 LYS N N 114 123.020 123.020 119.419 3.601 25153 15608 1 17 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.502 0.003 25153 15609 1 17 . 1 1 114 114 LYS C C 114 175.000 175.000 174.308 0.692 25153 15610 1 17 . 1 1 114 114 LYS CA C 114 54.200 54.200 53.972 0.228 25153 15611 1 17 . 1 1 114 114 LYS CB C 114 33.340 33.340 35.122 -1.782 25153 15612 1 17 . 1 1 115 115 PHE N N 115 123.290 123.290 119.081 4.209 25153 15613 1 17 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.698 0.015 25153 15614 1 17 . 1 1 115 115 PHE C C 115 177.605 177.605 176.365 1.240 25153 15615 1 17 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.956 1.654 25153 15616 1 17 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.981 -0.981 25153 15617 1 17 . 1 1 115 115 PHE H H 115 8.494 8.494 8.496 -0.002 25153 15618 1 17 . 1 1 116 116 VAL N N 116 115.790 115.790 115.252 0.538 25153 15619 1 17 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.386 0.106 25153 15620 1 17 . 1 1 116 116 VAL C C 116 175.414 175.414 176.015 -0.601 25153 15621 1 17 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.686 -0.700 25153 15622 1 17 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.444 -0.344 25153 15623 1 17 . 1 1 116 116 VAL H H 116 8.889 8.889 8.419 0.470 25153 15624 1 17 . 1 1 117 117 GLY N N 117 108.300 108.300 107.258 1.042 25153 15625 1 17 . 1 1 117 117 GLY C C 117 176.180 176.180 174.759 1.421 25153 15626 1 17 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.562 2.238 25153 15627 1 17 . 1 1 117 117 GLY H H 117 9.810 9.810 8.600 1.210 25153 15628 1 17 . 1 1 118 118 TYR N N 118 120.050 120.050 119.577 0.473 25153 15629 1 17 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.799 0.155 25153 15630 1 17 . 1 1 118 118 TYR C C 118 177.450 177.450 176.071 1.379 25153 15631 1 17 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.524 -1.284 25153 15632 1 17 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.051 -2.941 25153 15633 1 17 . 1 1 118 118 TYR H H 118 8.592 8.592 7.464 1.128 25153 15634 1 17 . 1 1 119 119 TRP N N 119 125.500 125.500 122.052 3.448 25153 15635 1 17 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.150 0.878 25153 15636 1 17 . 1 1 119 119 TRP C C 119 173.090 173.090 174.270 -1.180 25153 15637 1 17 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.390 -0.490 25153 15638 1 17 . 1 1 119 119 TRP CB C 119 36.250 36.250 32.927 3.323 25153 15639 1 17 . 1 1 119 119 TRP H H 119 7.926 7.926 8.229 -0.303 25153 15640 1 17 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.741 0.069 25153 15641 1 17 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.902 0.778 25153 15642 1 17 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.234 0.016 25153 15643 1 17 . 1 1 121 121 THR N N 121 109.114 109.114 112.448 -3.334 25153 15644 1 17 . 1 1 121 121 THR HA H 121 4.142 4.142 3.433 0.709 25153 15645 1 17 . 1 1 121 121 THR C C 121 176.300 176.300 175.107 1.193 25153 15646 1 17 . 1 1 121 121 THR CA C 121 61.230 61.230 62.478 -1.248 25153 15647 1 17 . 1 1 121 121 THR CB C 121 69.890 69.890 68.424 1.466 25153 15648 1 17 . 1 1 121 121 THR H H 121 7.356 7.356 8.330 -0.974 25153 15649 1 17 . 1 1 122 122 GLU N N 122 123.980 123.980 121.367 2.613 25153 15650 1 17 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.014 0.224 25153 15651 1 17 . 1 1 122 122 GLU C C 122 177.830 177.830 178.030 -0.200 25153 15652 1 17 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.717 0.513 25153 15653 1 17 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.876 -0.106 25153 15654 1 17 . 1 1 123 123 GLY N N 123 114.570 114.570 112.921 1.649 25153 15655 1 17 . 1 1 123 123 GLY C C 123 173.700 173.700 173.585 0.115 25153 15656 1 17 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.246 0.154 25153 15657 1 17 . 1 1 123 123 GLY H H 123 9.181 9.181 8.956 0.225 25153 15658 1 17 . 1 1 124 124 TYR N N 124 118.923 118.923 120.576 -1.653 25153 15659 1 17 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.633 0.677 25153 15660 1 17 . 1 1 124 124 TYR C C 124 175.680 175.680 175.367 0.313 25153 15661 1 17 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.908 -2.438 25153 15662 1 17 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.218 0.782 25153 15663 1 17 . 1 1 124 124 TYR H H 124 7.877 7.877 7.707 0.170 25153 15664 1 17 . 1 1 125 125 GLU N N 125 124.890 124.890 121.212 3.678 25153 15665 1 17 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.610 0.090 25153 15666 1 17 . 1 1 125 125 GLU C C 125 172.880 172.880 175.164 -2.284 25153 15667 1 17 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.868 -0.438 25153 15668 1 17 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.033 -0.613 25153 15669 1 17 . 1 1 126 126 PHE N N 126 119.166 119.166 120.491 -1.325 25153 15670 1 17 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.361 0.448 25153 15671 1 17 . 1 1 126 126 PHE C C 126 173.750 173.750 174.498 -0.748 25153 15672 1 17 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.142 -1.351 25153 15673 1 17 . 1 1 126 126 PHE CB C 126 40.050 40.050 38.584 1.466 25153 15674 1 17 . 1 1 126 126 PHE H H 126 7.716 7.716 7.970 -0.254 25153 15675 1 17 . 1 1 127 127 THR N N 127 106.800 106.800 114.728 -7.928 25153 15676 1 17 . 1 1 127 127 THR HA H 127 4.400 4.400 3.329 1.071 25153 15677 1 17 . 1 1 127 127 THR C C 127 175.300 175.300 174.050 1.250 25153 15678 1 17 . 1 1 127 127 THR CA C 127 61.100 61.100 62.852 -1.752 25153 15679 1 17 . 1 1 127 127 THR CB C 127 70.600 70.600 67.731 2.869 25153 15680 1 17 . 1 1 127 127 THR H H 127 7.220 7.220 6.307 0.913 25153 15681 1 17 . 1 1 128 128 SER N N 128 118.360 118.360 115.846 2.514 25153 15682 1 17 . 1 1 128 128 SER HA H 128 4.680 4.680 4.482 0.198 25153 15683 1 17 . 1 1 128 128 SER C C 128 175.720 175.720 174.195 1.525 25153 15684 1 17 . 1 1 128 128 SER CA C 128 56.250 56.250 56.462 -0.213 25153 15685 1 17 . 1 1 128 128 SER CB C 128 65.635 65.635 64.504 1.131 25153 15686 1 17 . 1 1 128 128 SER H H 128 7.411 7.411 8.106 -0.695 25153 15687 1 17 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.617 0.158 25153 15688 1 17 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.305 -1.805 25153 15689 1 17 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.240 0.160 25153 15690 1 17 . 1 1 130 130 LYS N N 130 122.014 122.014 120.025 1.989 25153 15691 1 17 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.372 -0.139 25153 15692 1 17 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.405 3.295 25153 15693 1 17 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.135 -0.565 25153 15694 1 17 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.561 -0.043 25153 15695 1 17 . 1 1 131 131 PRO C C 131 174.000 174.000 175.194 -1.194 25153 15696 1 17 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.300 2.400 25153 15697 1 17 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.376 0.824 25153 15698 1 17 . 1 1 132 132 VAL N N 132 113.260 113.260 117.657 -4.397 25153 15699 1 17 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.806 0.394 25153 15700 1 17 . 1 1 132 132 VAL C C 132 175.210 175.210 175.044 0.166 25153 15701 1 17 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.253 -0.633 25153 15702 1 17 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.964 -0.984 25153 15703 1 17 . 1 1 132 132 VAL H H 132 6.697 6.697 7.553 -0.856 25153 15704 1 17 . 1 1 133 133 ILE N N 133 119.940 119.940 118.355 1.585 25153 15705 1 17 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.425 -0.045 25153 15706 1 17 . 1 1 133 133 ILE C C 133 175.440 175.440 175.323 0.117 25153 15707 1 17 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.811 1.639 25153 15708 1 17 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.128 1.972 25153 15709 1 17 . 1 1 133 133 ILE H H 133 8.756 8.756 8.597 0.159 25153 15710 1 17 . 1 1 134 134 ALA N N 134 122.632 122.632 123.914 -1.282 25153 15711 1 17 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.901 0.059 25153 15712 1 17 . 1 1 134 134 ALA C C 134 178.312 178.312 177.234 1.078 25153 15713 1 17 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.590 -1.510 25153 15714 1 17 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.215 -0.379 25153 15715 1 17 . 1 1 134 134 ALA H H 134 8.523 8.523 8.459 0.064 25153 15716 1 17 . 1 1 135 135 ASP N N 135 117.366 117.366 122.668 -5.302 25153 15717 1 17 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.657 -0.405 25153 15718 1 17 . 1 1 135 135 ASP C C 135 176.387 176.387 176.636 -0.249 25153 15719 1 17 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.359 1.851 25153 15720 1 17 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.217 -1.517 25153 15721 1 17 . 1 1 136 136 GLY N N 136 104.310 104.310 108.035 -3.725 25153 15722 1 17 . 1 1 136 136 GLY C C 136 174.922 174.922 174.916 0.006 25153 15723 1 17 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.368 -0.269 25153 15724 1 17 . 1 1 136 136 GLY H H 136 7.610 7.610 8.311 -0.701 25153 15725 1 17 . 1 1 137 137 GLN N N 137 118.784 118.784 117.730 1.054 25153 15726 1 17 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.418 -0.363 25153 15727 1 17 . 1 1 137 137 GLN C C 137 176.390 176.390 175.437 0.953 25153 15728 1 17 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.824 1.816 25153 15729 1 17 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.228 0.002 25153 15730 1 17 . 1 1 137 137 GLN H H 137 7.870 7.870 7.888 -0.018 25153 15731 1 17 . 1 1 138 138 LEU N N 138 118.040 118.040 115.801 2.239 25153 15732 1 17 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.044 -0.057 25153 15733 1 17 . 1 1 138 138 LEU C C 138 175.913 175.913 175.050 0.863 25153 15734 1 17 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.204 0.396 25153 15735 1 17 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.935 1.465 25153 15736 1 17 . 1 1 138 138 LEU H H 138 7.356 7.356 7.175 0.181 25153 15737 1 17 . 1 1 139 139 PHE N N 139 119.060 119.060 119.295 -0.235 25153 15738 1 17 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.954 0.356 25153 15739 1 17 . 1 1 139 139 PHE C C 139 178.780 178.780 177.361 1.419 25153 15740 1 17 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.526 -0.676 25153 15741 1 17 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.902 3.558 25153 15742 1 17 . 1 1 139 139 PHE H H 139 10.094 10.094 8.942 1.152 25153 15743 1 17 . 1 1 140 140 VAL N N 140 109.690 109.690 116.379 -6.689 25153 15744 1 17 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.493 -0.012 25153 15745 1 17 . 1 1 140 140 VAL C C 140 172.790 172.790 175.488 -2.698 25153 15746 1 17 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.033 -1.033 25153 15747 1 17 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.451 -0.901 25153 15748 1 17 . 1 1 140 140 VAL H H 140 7.470 7.470 8.167 -0.697 25153 15749 1 17 . 1 1 141 141 GLY N N 141 107.060 107.060 104.972 2.088 25153 15750 1 17 . 1 1 141 141 GLY C C 141 171.513 171.513 172.616 -1.103 25153 15751 1 17 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.577 0.853 25153 15752 1 17 . 1 1 141 141 GLY H H 141 7.137 7.137 7.309 -0.172 25153 15753 1 17 . 1 1 142 142 LEU N N 142 117.863 117.863 120.310 -2.447 25153 15754 1 17 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.257 -1.282 25153 15755 1 17 . 1 1 142 142 LEU C C 142 173.640 173.640 175.189 -1.549 25153 15756 1 17 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.743 1.177 25153 15757 1 17 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.451 -4.901 25153 15758 1 17 . 1 1 142 142 LEU H H 142 7.517 7.517 7.640 -0.123 25153 15759 1 17 . 1 1 143 143 ALA N N 143 126.990 126.990 129.787 -2.797 25153 15760 1 17 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.381 -0.104 25153 15761 1 17 . 1 1 143 143 ALA C C 143 175.730 175.730 176.036 -0.306 25153 15762 1 17 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.209 -0.769 25153 15763 1 17 . 1 1 143 143 ALA CB C 143 23.310 23.310 18.685 4.625 25153 15764 1 17 . 1 1 143 143 ALA H H 143 5.186 5.186 8.266 -3.080 25153 15765 1 17 . 1 1 144 144 LEU N N 144 125.477 125.477 124.859 0.618 25153 15766 1 17 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.537 0.243 25153 15767 1 17 . 1 1 144 144 LEU C C 144 174.473 174.473 175.277 -0.804 25153 15768 1 17 . 1 1 144 144 LEU CA C 144 53.240 53.240 54.059 -0.819 25153 15769 1 17 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.845 1.455 25153 15770 1 17 . 1 1 144 144 LEU H H 144 8.758 8.758 8.505 0.253 25153 15771 1 17 . 1 1 145 145 ASP N N 145 118.915 118.915 118.937 -0.022 25153 15772 1 17 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.131 0.401 25153 15773 1 17 . 1 1 145 145 ASP C C 145 176.470 176.470 176.160 0.310 25153 15774 1 17 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.163 -0.533 25153 15775 1 17 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.954 -0.954 25153 15776 1 17 . 1 1 146 146 GLU N N 146 124.813 124.813 124.596 0.217 25153 15777 1 17 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.490 -0.114 25153 15778 1 17 . 1 1 146 146 GLU C C 146 177.290 177.290 176.005 1.285 25153 15779 1 17 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.028 0.092 25153 15780 1 17 . 1 1 146 146 GLU CB C 146 30.150 30.150 28.462 1.688 25153 15781 1 17 . 1 1 147 147 THR N N 147 118.328 118.328 112.762 5.566 25153 15782 1 17 . 1 1 147 147 THR HA H 147 4.200 4.200 4.335 -0.135 25153 15783 1 17 . 1 1 147 147 THR C C 147 175.683 175.683 174.503 1.180 25153 15784 1 17 . 1 1 147 147 THR CA C 147 66.250 66.250 62.760 3.490 25153 15785 1 17 . 1 1 147 147 THR CB C 147 69.600 69.600 70.004 -0.404 25153 15786 1 17 . 1 1 147 147 THR H H 147 8.562 8.562 8.533 0.029 25153 15787 1 17 . 1 1 148 148 ASN N N 148 115.550 115.550 119.193 -3.643 25153 15788 1 17 . 1 1 148 148 ASN HA H 148 4.987 4.987 5.165 -0.178 25153 15789 1 17 . 1 1 148 148 ASN C C 148 175.870 175.870 176.185 -0.315 25153 15790 1 17 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.399 -0.699 25153 15791 1 17 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.835 2.045 25153 15792 1 17 . 1 1 148 148 ASN H H 148 9.118 9.118 9.066 0.052 25153 15793 1 17 . 1 1 149 149 GLN N N 149 117.400 117.400 119.724 -2.324 25153 15794 1 17 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.276 0.567 25153 15795 1 17 . 1 1 149 149 GLN C C 149 177.780 177.780 177.489 0.291 25153 15796 1 17 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.305 -2.405 25153 15797 1 17 . 1 1 149 149 GLN CB C 149 29.300 29.300 27.939 1.361 25153 15798 1 17 . 1 1 149 149 GLN H H 149 7.555 7.555 8.662 -1.107 25153 15799 1 17 . 1 1 150 150 TYR N N 150 120.674 120.674 118.344 2.330 25153 15800 1 17 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.253 0.275 25153 15801 1 17 . 1 1 150 150 TYR C C 150 177.830 177.830 176.004 1.826 25153 15802 1 17 . 1 1 150 150 TYR CA C 150 58.487 58.487 59.399 -0.912 25153 15803 1 17 . 1 1 150 150 TYR CB C 150 36.600 36.600 37.021 -0.421 25153 15804 1 17 . 1 1 150 150 TYR H H 150 6.983 6.983 7.875 -0.892 25153 15805 1 17 . 1 1 151 151 ASP N N 151 120.810 120.810 119.127 1.683 25153 15806 1 17 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.217 0.298 25153 15807 1 17 . 1 1 151 151 ASP C C 151 176.400 176.400 176.939 -0.539 25153 15808 1 17 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.132 0.268 25153 15809 1 17 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.324 -2.244 25153 15810 1 17 . 1 1 152 152 LEU N N 152 118.083 118.083 113.196 4.887 25153 15811 1 17 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.649 0.027 25153 15812 1 17 . 1 1 152 152 LEU C C 152 178.470 178.470 178.153 0.317 25153 15813 1 17 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.607 -1.007 25153 15814 1 17 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.043 -0.443 25153 15815 1 17 . 1 1 152 152 LEU H H 152 7.453 7.453 7.650 -0.197 25153 15816 1 17 . 1 1 153 153 SER N N 153 116.407 116.407 119.552 -3.145 25153 15817 1 17 . 1 1 153 153 SER HA H 153 3.960 3.960 3.960 -0.000 25153 15818 1 17 . 1 1 153 153 SER C C 153 174.590 174.590 175.767 -1.177 25153 15819 1 17 . 1 1 153 153 SER CA C 153 63.400 63.400 63.499 -0.099 25153 15820 1 17 . 1 1 153 153 SER CB C 153 63.100 63.100 62.657 0.443 25153 15821 1 17 . 1 1 153 153 SER H H 153 7.360 7.360 8.586 -1.226 25153 15822 1 17 . 1 1 154 154 ASP N N 154 121.960 121.960 120.666 1.294 25153 15823 1 17 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.329 -0.019 25153 15824 1 17 . 1 1 154 154 ASP C C 154 178.640 178.640 177.831 0.809 25153 15825 1 17 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.453 1.547 25153 15826 1 17 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.780 -1.210 25153 15827 1 17 . 1 1 155 155 GLU N N 155 121.310 121.310 119.121 2.189 25153 15828 1 17 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.076 0.109 25153 15829 1 17 . 1 1 155 155 GLU C C 155 179.600 179.600 178.943 0.657 25153 15830 1 17 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.070 0.380 25153 15831 1 17 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.658 -0.258 25153 15832 1 17 . 1 1 156 156 ARG N N 156 121.394 121.394 120.225 1.169 25153 15833 1 17 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.342 -0.042 25153 15834 1 17 . 1 1 156 156 ARG C C 156 177.330 177.330 179.044 -1.714 25153 15835 1 17 . 1 1 156 156 ARG CA C 156 60.460 60.460 57.386 3.074 25153 15836 1 17 . 1 1 156 156 ARG CB C 156 30.760 30.760 29.619 1.141 25153 15837 1 17 . 1 1 157 157 ILE N N 157 118.390 118.390 121.492 -3.102 25153 15838 1 17 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.767 -0.333 25153 15839 1 17 . 1 1 157 157 ILE C C 157 178.814 178.814 177.583 1.231 25153 15840 1 17 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.383 0.311 25153 15841 1 17 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.864 0.989 25153 15842 1 17 . 1 1 157 157 ILE H H 157 8.966 8.966 8.520 0.446 25153 15843 1 17 . 1 1 158 158 GLN N N 158 120.060 120.060 119.113 0.947 25153 15844 1 17 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.984 -0.028 25153 15845 1 17 . 1 1 158 158 GLN C C 158 178.843 178.843 178.510 0.333 25153 15846 1 17 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.400 1.200 25153 15847 1 17 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.240 0.150 25153 15848 1 17 . 1 1 158 158 GLN H H 158 8.394 8.394 8.016 0.378 25153 15849 1 17 . 1 1 159 159 SER N N 159 115.613 115.613 117.010 -1.397 25153 15850 1 17 . 1 1 159 159 SER HA H 159 4.455 4.455 4.397 0.058 25153 15851 1 17 . 1 1 159 159 SER C C 159 177.330 177.330 176.486 0.844 25153 15852 1 17 . 1 1 159 159 SER CA C 159 62.400 62.400 62.363 0.037 25153 15853 1 17 . 1 1 159 159 SER CB C 159 63.760 63.760 63.151 0.609 25153 15854 1 17 . 1 1 159 159 SER H H 159 8.460 8.460 8.395 0.065 25153 15855 1 17 . 1 1 160 160 TRP N N 160 126.820 126.820 124.805 2.015 25153 15856 1 17 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.122 0.343 25153 15857 1 17 . 1 1 160 160 TRP C C 160 178.050 178.050 177.381 0.669 25153 15858 1 17 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.689 1.011 25153 15859 1 17 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.293 0.067 25153 15860 1 17 . 1 1 160 160 TRP H H 160 9.318 9.318 8.061 1.257 25153 15861 1 17 . 1 1 161 161 CYS N N 161 116.750 116.750 117.945 -1.195 25153 15862 1 17 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.730 0.153 25153 15863 1 17 . 1 1 161 161 CYS C C 161 176.270 176.270 177.055 -0.785 25153 15864 1 17 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.284 1.076 25153 15865 1 17 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.969 0.911 25153 15866 1 17 . 1 1 161 161 CYS H H 161 8.950 8.950 9.044 -0.094 25153 15867 1 17 . 1 1 162 162 GLU N N 162 118.096 118.096 118.968 -0.872 25153 15868 1 17 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.058 -0.128 25153 15869 1 17 . 1 1 162 162 GLU C C 162 178.680 178.680 177.772 0.908 25153 15870 1 17 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.066 0.664 25153 15871 1 17 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.544 -0.114 25153 15872 1 17 . 1 1 163 163 GLN N N 163 120.790 120.790 118.017 2.773 25153 15873 1 17 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.128 0.049 25153 15874 1 17 . 1 1 163 163 GLN C C 163 179.690 179.690 178.015 1.675 25153 15875 1 17 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.178 1.362 25153 15876 1 17 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.959 0.042 25153 15877 1 17 . 1 1 163 163 GLN H H 163 8.205 8.205 7.538 0.667 25153 15878 1 17 . 1 1 164 164 ILE N N 164 114.860 114.860 119.004 -4.144 25153 15879 1 17 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.868 0.175 25153 15880 1 17 . 1 1 164 164 ILE C C 164 178.680 178.680 177.359 1.321 25153 15881 1 17 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.037 2.173 25153 15882 1 17 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.600 0.100 25153 15883 1 17 . 1 1 164 164 ILE H H 164 9.005 9.005 8.023 0.982 25153 15884 1 17 . 1 1 165 165 LEU N N 165 123.900 123.900 116.185 7.715 25153 15885 1 17 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.208 -0.058 25153 15886 1 17 . 1 1 165 165 LEU C C 165 180.520 180.520 177.352 3.168 25153 15887 1 17 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.228 1.072 25153 15888 1 17 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.277 -0.227 25153 15889 1 17 . 1 1 165 165 LEU H H 165 7.825 7.825 8.028 -0.203 25153 15890 1 17 . 1 1 166 166 ASN N N 166 120.112 120.112 117.804 2.308 25153 15891 1 17 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.771 -0.188 25153 15892 1 17 . 1 1 166 166 ASN C C 166 178.440 178.440 177.145 1.295 25153 15893 1 17 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.809 0.611 25153 15894 1 17 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.794 -1.374 25153 15895 1 17 . 1 1 166 166 ASN H H 166 7.760 7.760 7.931 -0.171 25153 15896 1 17 . 1 1 167 167 GLU N N 167 121.370 121.370 122.093 -0.723 25153 15897 1 17 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.978 0.125 25153 15898 1 17 . 1 1 167 167 GLU C C 167 180.332 180.332 179.313 1.019 25153 15899 1 17 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.914 0.236 25153 15900 1 17 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.686 1.334 25153 15901 1 17 . 1 1 168 168 MET N N 168 118.532 118.532 117.323 1.209 25153 15902 1 17 . 1 1 168 168 MET HA H 168 4.015 4.015 4.228 -0.213 25153 15903 1 17 . 1 1 168 168 MET C C 168 176.600 176.600 178.169 -1.569 25153 15904 1 17 . 1 1 168 168 MET CA C 168 59.300 59.300 59.584 -0.284 25153 15905 1 17 . 1 1 168 168 MET CB C 168 33.400 33.400 32.709 0.691 25153 15906 1 17 . 1 1 168 168 MET H H 168 8.718 8.718 8.479 0.239 25153 15907 1 17 . 1 1 169 169 ALA N N 169 121.922 121.922 122.094 -0.172 25153 15908 1 17 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.155 0.019 25153 15909 1 17 . 1 1 169 169 ALA C C 169 179.410 179.410 179.645 -0.235 25153 15910 1 17 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.811 -0.411 25153 15911 1 17 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.442 -0.032 25153 15912 1 17 . 1 1 169 169 ALA H H 169 7.448 7.448 7.824 -0.376 25153 15913 1 17 . 1 1 170 170 GLU N N 170 117.300 117.300 116.622 0.678 25153 15914 1 17 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.071 0.024 25153 15915 1 17 . 1 1 170 170 GLU C C 170 177.470 177.470 179.334 -1.864 25153 15916 1 17 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.905 -0.955 25153 15917 1 17 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.380 0.395 25153 15918 1 17 . 1 1 171 171 HIS N N 171 117.944 117.944 119.571 -1.627 25153 15919 1 17 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.341 0.159 25153 15920 1 17 . 1 1 171 171 HIS C C 171 175.120 175.120 176.788 -1.668 25153 15921 1 17 . 1 1 171 171 HIS CA C 171 57.200 57.200 59.129 -1.929 25153 15922 1 17 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.194 0.406 25153 15923 1 17 . 1 1 171 171 HIS H H 171 7.788 7.788 7.778 0.010 25153 15924 1 17 . 1 1 172 172 TYR N N 172 120.040 120.040 117.754 2.286 25153 15925 1 17 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.521 0.072 25153 15926 1 17 . 1 1 172 172 TYR C C 172 174.612 174.612 175.299 -0.687 25153 15927 1 17 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.393 -0.413 25153 15928 1 17 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.603 0.377 25153 15929 1 17 . 1 1 172 172 TYR H H 172 7.820 7.820 8.084 -0.264 25153 15930 1 18 . 1 1 2 2 ASN N N 2 123.320 123.320 118.484 4.836 25153 15931 1 18 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.090 0.118 25153 15932 1 18 . 1 1 2 2 ASN C C 2 174.590 174.590 173.984 0.606 25153 15933 1 18 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.285 0.715 25153 15934 1 18 . 1 1 2 2 ASN CB C 2 39.970 39.970 41.186 -1.216 25153 15935 1 18 . 1 1 2 2 ASN H H 2 9.428 9.428 8.351 1.077 25153 15936 1 18 . 1 1 3 3 MET N N 3 120.920 120.920 118.830 2.090 25153 15937 1 18 . 1 1 3 3 MET HA H 3 5.530 5.530 5.293 0.237 25153 15938 1 18 . 1 1 3 3 MET C C 3 174.400 174.400 175.209 -0.809 25153 15939 1 18 . 1 1 3 3 MET CA C 3 54.643 54.643 54.114 0.529 25153 15940 1 18 . 1 1 3 3 MET CB C 3 34.637 34.637 36.842 -2.204 25153 15941 1 18 . 1 1 3 3 MET H H 3 8.751 8.751 9.136 -0.385 25153 15942 1 18 . 1 1 4 4 GLY N N 4 115.542 115.542 109.196 6.346 25153 15943 1 18 . 1 1 4 4 GLY C C 4 170.413 170.413 172.201 -1.788 25153 15944 1 18 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.795 -0.693 25153 15945 1 18 . 1 1 4 4 GLY H H 4 8.927 8.927 8.929 -0.002 25153 15946 1 18 . 1 1 5 5 LEU N N 5 131.030 131.030 127.876 3.154 25153 15947 1 18 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.358 1.044 25153 15948 1 18 . 1 1 5 5 LEU C C 5 175.952 175.952 174.520 1.432 25153 15949 1 18 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.045 0.405 25153 15950 1 18 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.195 2.397 25153 15951 1 18 . 1 1 5 5 LEU H H 5 8.928 8.928 8.693 0.235 25153 15952 1 18 . 1 1 6 6 PHE N N 6 125.790 125.790 126.218 -0.428 25153 15953 1 18 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.569 0.171 25153 15954 1 18 . 1 1 6 6 PHE C C 6 174.300 174.300 175.730 -1.430 25153 15955 1 18 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.539 -1.219 25153 15956 1 18 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.967 -0.737 25153 15957 1 18 . 1 1 6 6 PHE H H 6 9.237 9.237 9.563 -0.326 25153 15958 1 18 . 1 1 7 7 TYR N N 7 117.289 117.289 116.674 0.615 25153 15959 1 18 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.973 -0.008 25153 15960 1 18 . 1 1 7 7 TYR C C 7 171.262 171.262 173.388 -2.126 25153 15961 1 18 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.279 -0.878 25153 15962 1 18 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.134 0.106 25153 15963 1 18 . 1 1 7 7 TYR H H 7 8.125 8.125 8.204 -0.079 25153 15964 1 18 . 1 1 8 8 GLY N N 8 107.420 107.420 106.939 0.481 25153 15965 1 18 . 1 1 8 8 GLY C C 8 172.000 172.000 172.268 -0.268 25153 15966 1 18 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.439 -0.495 25153 15967 1 18 . 1 1 8 8 GLY H H 8 7.031 7.031 8.453 -1.422 25153 15968 1 18 . 1 1 9 9 SER N N 9 118.150 118.150 116.058 2.092 25153 15969 1 18 . 1 1 9 9 SER HA H 9 5.200 5.200 5.133 0.067 25153 15970 1 18 . 1 1 9 9 SER C C 9 175.000 175.000 174.068 0.932 25153 15971 1 18 . 1 1 9 9 SER CA C 9 57.570 57.570 57.369 0.201 25153 15972 1 18 . 1 1 9 9 SER CB C 9 66.700 66.700 65.641 1.059 25153 15973 1 18 . 1 1 9 9 SER H H 9 9.604 9.604 8.131 1.473 25153 15974 1 18 . 1 1 10 10 SER N N 10 131.193 131.193 120.659 10.534 25153 15975 1 18 . 1 1 10 10 SER HA H 10 4.775 4.775 4.475 0.300 25153 15976 1 18 . 1 1 10 10 SER C C 10 175.730 175.730 175.886 -0.156 25153 15977 1 18 . 1 1 10 10 SER CA C 10 61.750 61.750 60.711 1.039 25153 15978 1 18 . 1 1 10 10 SER CB C 10 64.400 64.400 63.774 0.626 25153 15979 1 18 . 1 1 10 10 SER H H 10 11.636 11.636 9.101 2.535 25153 15980 1 18 . 1 1 11 11 THR N N 11 115.848 115.848 114.947 0.901 25153 15981 1 18 . 1 1 11 11 THR HA H 11 4.770 4.770 4.311 0.459 25153 15982 1 18 . 1 1 11 11 THR C C 11 173.700 173.700 174.857 -1.157 25153 15983 1 18 . 1 1 11 11 THR CA C 11 60.700 60.700 62.630 -1.930 25153 15984 1 18 . 1 1 11 11 THR CB C 11 67.430 67.430 69.819 -2.389 25153 15985 1 18 . 1 1 11 11 THR H H 11 9.550 9.550 8.561 0.989 25153 15986 1 18 . 1 1 12 12 CYS N N 12 109.780 109.780 114.681 -4.901 25153 15987 1 18 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.758 -0.688 25153 15988 1 18 . 1 1 12 12 CYS C C 12 176.220 176.220 175.148 1.072 25153 15989 1 18 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.393 5.207 25153 15990 1 18 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.983 -1.583 25153 15991 1 18 . 1 1 12 12 CYS H H 12 7.437 7.437 7.695 -0.258 25153 15992 1 18 . 1 1 13 13 TYR N N 13 127.830 127.830 122.830 5.000 25153 15993 1 18 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.266 -0.163 25153 15994 1 18 . 1 1 13 13 TYR C C 13 180.880 180.880 178.005 2.875 25153 15995 1 18 . 1 1 13 13 TYR CA C 13 65.100 65.100 62.768 2.332 25153 15996 1 18 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.941 -1.105 25153 15997 1 18 . 1 1 13 13 TYR H H 13 10.886 10.886 7.191 3.695 25153 15998 1 18 . 1 1 14 14 THR N N 14 124.428 124.428 113.988 10.440 25153 15999 1 18 . 1 1 14 14 THR HA H 14 4.160 4.160 4.095 0.065 25153 16000 1 18 . 1 1 14 14 THR C C 14 177.760 177.760 176.178 1.582 25153 16001 1 18 . 1 1 14 14 THR CA C 14 67.823 67.823 67.243 0.580 25153 16002 1 18 . 1 1 14 14 THR CB C 14 68.040 68.040 68.211 -0.171 25153 16003 1 18 . 1 1 14 14 THR H H 14 11.405 11.405 8.700 2.705 25153 16004 1 18 . 1 1 15 15 GLU N N 15 123.050 123.050 122.901 0.149 25153 16005 1 18 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.188 -0.298 25153 16006 1 18 . 1 1 15 15 GLU C C 15 176.392 176.392 178.023 -1.631 25153 16007 1 18 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.580 -0.379 25153 16008 1 18 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.354 1.096 25153 16009 1 18 . 1 1 16 16 MET N N 16 120.173 120.173 118.484 1.689 25153 16010 1 18 . 1 1 16 16 MET HA H 16 4.050 4.050 4.132 -0.082 25153 16011 1 18 . 1 1 16 16 MET C C 16 179.940 179.940 178.671 1.269 25153 16012 1 18 . 1 1 16 16 MET CA C 16 59.240 59.240 59.221 0.019 25153 16013 1 18 . 1 1 16 16 MET CB C 16 32.970 32.970 32.902 0.068 25153 16014 1 18 . 1 1 16 16 MET H H 16 8.469 8.469 8.366 0.103 25153 16015 1 18 . 1 1 17 17 ALA N N 17 121.930 121.930 121.754 0.176 25153 16016 1 18 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.840 -0.004 25153 16017 1 18 . 1 1 17 17 ALA C C 17 177.900 177.900 178.729 -0.829 25153 16018 1 18 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.130 0.070 25153 16019 1 18 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.091 -0.091 25153 16020 1 18 . 1 1 17 17 ALA H H 17 7.880 7.880 8.471 -0.591 25153 16021 1 18 . 1 1 18 18 ALA N N 18 121.477 121.477 121.335 0.142 25153 16022 1 18 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.759 -0.022 25153 16023 1 18 . 1 1 18 18 ALA C C 18 179.380 179.380 179.362 0.018 25153 16024 1 18 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.176 -0.176 25153 16025 1 18 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.855 0.975 25153 16026 1 18 . 1 1 18 18 ALA H H 18 7.374 7.374 8.178 -0.804 25153 16027 1 18 . 1 1 19 19 GLU N N 19 116.650 116.650 118.079 -1.429 25153 16028 1 18 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.841 -0.225 25153 16029 1 18 . 1 1 19 19 GLU C C 19 178.479 178.479 179.295 -0.816 25153 16030 1 18 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.508 0.222 25153 16031 1 18 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.372 -0.072 25153 16032 1 18 . 1 1 20 20 LYS N N 20 119.470 119.470 119.869 -0.399 25153 16033 1 18 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.015 0.035 25153 16034 1 18 . 1 1 20 20 LYS C C 20 179.116 179.116 179.040 0.076 25153 16035 1 18 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.447 0.383 25153 16036 1 18 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.432 0.418 25153 16037 1 18 . 1 1 21 21 ILE N N 21 121.030 121.030 120.744 0.286 25153 16038 1 18 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.671 -0.281 25153 16039 1 18 . 1 1 21 21 ILE C C 21 177.580 177.580 178.195 -0.615 25153 16040 1 18 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.765 0.055 25153 16041 1 18 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.893 0.455 25153 16042 1 18 . 1 1 21 21 ILE H H 21 8.100 8.100 8.606 -0.506 25153 16043 1 18 . 1 1 22 22 ARG N N 22 119.720 119.720 119.456 0.264 25153 16044 1 18 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.838 -0.283 25153 16045 1 18 . 1 1 22 22 ARG C C 22 177.320 177.320 178.085 -0.765 25153 16046 1 18 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.739 -0.019 25153 16047 1 18 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.732 -0.800 25153 16048 1 18 . 1 1 23 23 ASP N N 23 118.730 118.730 119.321 -0.591 25153 16049 1 18 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.411 -0.048 25153 16050 1 18 . 1 1 23 23 ASP C C 23 178.330 178.330 178.788 -0.458 25153 16051 1 18 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.345 -0.395 25153 16052 1 18 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.867 -0.627 25153 16053 1 18 . 1 1 24 24 ILE N N 24 121.090 121.090 119.425 1.665 25153 16054 1 18 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.781 0.015 25153 16055 1 18 . 1 1 24 24 ILE C C 24 178.250 178.250 177.865 0.385 25153 16056 1 18 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.769 -0.619 25153 16057 1 18 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.265 0.215 25153 16058 1 18 . 1 1 24 24 ILE H H 24 7.910 7.910 8.214 -0.304 25153 16059 1 18 . 1 1 25 25 ILE N N 25 121.406 121.406 117.368 4.038 25153 16060 1 18 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.860 -0.214 25153 16061 1 18 . 1 1 25 25 ILE C C 25 176.800 176.800 176.772 0.028 25153 16062 1 18 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.027 2.673 25153 16063 1 18 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.947 -0.757 25153 16064 1 18 . 1 1 25 25 ILE H H 25 8.476 8.476 8.065 0.411 25153 16065 1 18 . 1 1 26 26 GLY N N 26 108.900 108.900 105.133 3.767 25153 16066 1 18 . 1 1 26 26 GLY C C 26 173.710 173.710 172.259 1.451 25153 16067 1 18 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.666 -0.336 25153 16068 1 18 . 1 1 26 26 GLY H H 26 8.016 8.016 7.798 0.218 25153 16069 1 18 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.694 -0.356 25153 16070 1 18 . 1 1 27 27 PRO C C 27 177.200 177.200 177.107 0.093 25153 16071 1 18 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.496 1.190 25153 16072 1 18 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.022 0.178 25153 16073 1 18 . 1 1 28 28 GLU N N 28 116.295 116.295 118.240 -1.945 25153 16074 1 18 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.187 0.083 25153 16075 1 18 . 1 1 28 28 GLU C C 28 176.980 176.980 177.201 -0.221 25153 16076 1 18 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.444 -0.704 25153 16077 1 18 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.492 -0.822 25153 16078 1 18 . 1 1 29 29 LEU N N 29 120.250 120.250 112.616 7.634 25153 16079 1 18 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.643 -0.007 25153 16080 1 18 . 1 1 29 29 LEU C C 29 175.770 175.770 175.971 -0.201 25153 16081 1 18 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.483 0.318 25153 16082 1 18 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.818 1.282 25153 16083 1 18 . 1 1 29 29 LEU H H 29 7.940 7.940 7.535 0.405 25153 16084 1 18 . 1 1 30 30 VAL N N 30 118.693 118.693 120.994 -2.301 25153 16085 1 18 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.803 -0.155 25153 16086 1 18 . 1 1 30 30 VAL C C 30 174.347 174.347 175.722 -1.375 25153 16087 1 18 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.574 -0.706 25153 16088 1 18 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.136 1.444 25153 16089 1 18 . 1 1 30 30 VAL H H 30 7.434 7.434 7.926 -0.492 25153 16090 1 18 . 1 1 31 31 THR N N 31 123.800 123.800 121.785 2.015 25153 16091 1 18 . 1 1 31 31 THR HA H 31 4.362 4.362 4.546 -0.184 25153 16092 1 18 . 1 1 31 31 THR C C 31 172.964 172.964 173.329 -0.365 25153 16093 1 18 . 1 1 31 31 THR CA C 31 61.720 61.720 60.947 0.774 25153 16094 1 18 . 1 1 31 31 THR CB C 31 70.485 70.485 70.814 -0.329 25153 16095 1 18 . 1 1 31 31 THR H H 31 7.844 7.844 8.201 -0.357 25153 16096 1 18 . 1 1 32 32 LEU N N 32 127.800 127.800 126.196 1.604 25153 16097 1 18 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.544 0.140 25153 16098 1 18 . 1 1 32 32 LEU C C 32 176.600 176.600 176.325 0.275 25153 16099 1 18 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.107 0.048 25153 16100 1 18 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.562 1.288 25153 16101 1 18 . 1 1 32 32 LEU H H 32 8.660 8.660 8.519 0.141 25153 16102 1 18 . 1 1 33 33 HIS N N 33 119.670 119.670 119.805 -0.135 25153 16103 1 18 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.589 -0.189 25153 16104 1 18 . 1 1 33 33 HIS C C 33 171.667 171.667 173.385 -1.718 25153 16105 1 18 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.786 0.414 25153 16106 1 18 . 1 1 33 33 HIS CB C 33 32.200 32.200 32.442 -0.242 25153 16107 1 18 . 1 1 33 33 HIS H H 33 9.060 9.060 8.666 0.394 25153 16108 1 18 . 1 1 34 34 ASN N N 34 124.068 124.068 124.203 -0.135 25153 16109 1 18 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.088 -0.654 25153 16110 1 18 . 1 1 34 34 ASN C C 34 178.000 178.000 175.959 2.041 25153 16111 1 18 . 1 1 34 34 ASN CA C 34 51.429 51.429 53.439 -2.010 25153 16112 1 18 . 1 1 34 34 ASN CB C 34 38.560 38.560 38.406 0.154 25153 16113 1 18 . 1 1 34 34 ASN H H 34 8.780 8.780 8.841 -0.061 25153 16114 1 18 . 1 1 35 35 LEU N N 35 129.040 129.040 124.688 4.352 25153 16115 1 18 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.137 0.178 25153 16116 1 18 . 1 1 35 35 LEU C C 35 177.700 177.700 177.764 -0.064 25153 16117 1 18 . 1 1 35 35 LEU CA C 35 56.480 56.480 57.080 -0.600 25153 16118 1 18 . 1 1 35 35 LEU CB C 35 42.300 42.300 41.245 1.055 25153 16119 1 18 . 1 1 35 35 LEU H H 35 8.821 8.821 7.652 1.169 25153 16120 1 18 . 1 1 36 36 LYS N N 36 121.043 121.043 114.146 6.897 25153 16121 1 18 . 1 1 36 36 LYS HA H 36 3.880 3.880 3.993 -0.113 25153 16122 1 18 . 1 1 36 36 LYS C C 36 176.230 176.230 176.925 -0.695 25153 16123 1 18 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.017 1.403 25153 16124 1 18 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.050 1.220 25153 16125 1 18 . 1 1 37 37 ASP N N 37 114.965 114.965 119.153 -4.188 25153 16126 1 18 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.759 0.018 25153 16127 1 18 . 1 1 37 37 ASP C C 37 175.440 175.440 175.912 -0.472 25153 16128 1 18 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.928 -0.217 25153 16129 1 18 . 1 1 37 37 ASP CB C 37 44.700 44.700 42.941 1.759 25153 16130 1 18 . 1 1 38 38 ASP N N 38 121.650 121.650 118.367 3.283 25153 16131 1 18 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.988 -0.118 25153 16132 1 18 . 1 1 38 38 ASP C C 38 174.852 174.852 174.928 -0.076 25153 16133 1 18 . 1 1 38 38 ASP CA C 38 53.080 53.080 52.861 0.219 25153 16134 1 18 . 1 1 38 38 ASP CB C 38 42.110 42.110 44.501 -2.391 25153 16135 1 18 . 1 1 39 39 SER N N 39 115.207 115.207 115.486 -0.279 25153 16136 1 18 . 1 1 39 39 SER HA H 39 4.585 4.585 4.795 -0.210 25153 16137 1 18 . 1 1 39 39 SER C C 39 175.040 175.040 173.869 1.171 25153 16138 1 18 . 1 1 39 39 SER CA C 39 54.960 54.960 56.288 -1.328 25153 16139 1 18 . 1 1 39 39 SER CB C 39 64.720 64.720 63.680 1.040 25153 16140 1 18 . 1 1 39 39 SER H H 39 8.351 8.351 8.459 -0.108 25153 16141 1 18 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.416 -0.411 25153 16142 1 18 . 1 1 40 40 PRO C C 40 176.730 176.730 177.957 -1.227 25153 16143 1 18 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.583 0.317 25153 16144 1 18 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.736 -0.336 25153 16145 1 18 . 1 1 41 41 LYS N N 41 121.150 121.150 119.976 1.174 25153 16146 1 18 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.020 -0.108 25153 16147 1 18 . 1 1 41 41 LYS C C 41 179.600 179.600 178.426 1.174 25153 16148 1 18 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.343 -1.143 25153 16149 1 18 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.739 0.261 25153 16150 1 18 . 1 1 42 42 LEU N N 42 118.103 118.103 116.771 1.332 25153 16151 1 18 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.206 -0.169 25153 16152 1 18 . 1 1 42 42 LEU C C 42 178.760 178.760 178.849 -0.089 25153 16153 1 18 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.094 0.085 25153 16154 1 18 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.725 1.248 25153 16155 1 18 . 1 1 42 42 LEU H H 42 7.600 7.600 7.525 0.075 25153 16156 1 18 . 1 1 43 43 MET N N 43 118.917 118.917 118.401 0.516 25153 16157 1 18 . 1 1 43 43 MET HA H 43 3.750 3.750 4.298 -0.548 25153 16158 1 18 . 1 1 43 43 MET C C 43 177.680 177.680 176.766 0.914 25153 16159 1 18 . 1 1 43 43 MET CA C 43 59.730 59.730 58.040 1.690 25153 16160 1 18 . 1 1 43 43 MET CB C 43 32.700 32.700 32.081 0.619 25153 16161 1 18 . 1 1 43 43 MET H H 43 8.202 8.202 8.055 0.147 25153 16162 1 18 . 1 1 44 44 GLU N N 44 110.924 110.924 116.580 -5.656 25153 16163 1 18 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.269 -0.529 25153 16164 1 18 . 1 1 44 44 GLU C C 44 178.130 178.130 178.967 -0.837 25153 16165 1 18 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.272 1.129 25153 16166 1 18 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.945 -0.395 25153 16167 1 18 . 1 1 45 45 GLN N N 45 115.756 115.756 118.872 -3.116 25153 16168 1 18 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.016 0.167 25153 16169 1 18 . 1 1 45 45 GLN C C 45 175.414 175.414 177.082 -1.668 25153 16170 1 18 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.641 -1.461 25153 16171 1 18 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.046 -0.446 25153 16172 1 18 . 1 1 45 45 GLN H H 45 7.516 7.516 7.483 0.033 25153 16173 1 18 . 1 1 46 46 TYR N N 46 117.860 117.860 118.468 -0.608 25153 16174 1 18 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.437 0.226 25153 16175 1 18 . 1 1 46 46 TYR C C 46 175.500 175.500 176.987 -1.487 25153 16176 1 18 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.126 -0.640 25153 16177 1 18 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.153 3.317 25153 16178 1 18 . 1 1 46 46 TYR H H 46 6.996 6.996 7.145 -0.149 25153 16179 1 18 . 1 1 47 47 ASP N N 47 121.683 121.683 123.132 -1.449 25153 16180 1 18 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.832 -0.132 25153 16181 1 18 . 1 1 47 47 ASP C C 47 175.610 175.610 174.892 0.718 25153 16182 1 18 . 1 1 47 47 ASP CA C 47 56.700 56.700 55.180 1.520 25153 16183 1 18 . 1 1 47 47 ASP CB C 47 43.000 43.000 42.002 0.998 25153 16184 1 18 . 1 1 48 48 VAL N N 48 118.628 118.628 116.966 1.662 25153 16185 1 18 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.904 0.130 25153 16186 1 18 . 1 1 48 48 VAL C C 48 174.190 174.190 174.070 0.120 25153 16187 1 18 . 1 1 48 48 VAL CA C 48 60.190 60.190 60.755 -0.565 25153 16188 1 18 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.290 0.810 25153 16189 1 18 . 1 1 48 48 VAL H H 48 7.628 7.628 7.398 0.230 25153 16190 1 18 . 1 1 49 49 LEU N N 49 128.190 128.190 124.519 3.671 25153 16191 1 18 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.404 0.199 25153 16192 1 18 . 1 1 49 49 LEU C C 49 174.880 174.880 175.483 -0.603 25153 16193 1 18 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.895 -1.655 25153 16194 1 18 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.292 -0.952 25153 16195 1 18 . 1 1 49 49 LEU H H 49 9.407 9.407 9.078 0.329 25153 16196 1 18 . 1 1 50 50 ILE N N 50 124.550 124.550 121.142 3.408 25153 16197 1 18 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.167 0.533 25153 16198 1 18 . 1 1 50 50 ILE C C 50 175.300 175.300 174.650 0.650 25153 16199 1 18 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.862 -0.998 25153 16200 1 18 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.977 -0.727 25153 16201 1 18 . 1 1 50 50 ILE H H 50 9.238 9.238 9.251 -0.013 25153 16202 1 18 . 1 1 51 51 LEU N N 51 127.460 127.460 128.144 -0.684 25153 16203 1 18 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.903 0.282 25153 16204 1 18 . 1 1 51 51 LEU C C 51 174.544 174.544 176.072 -1.528 25153 16205 1 18 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.375 -0.555 25153 16206 1 18 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.408 -2.771 25153 16207 1 18 . 1 1 51 51 LEU H H 51 9.228 9.228 9.077 0.151 25153 16208 1 18 . 1 1 52 52 GLY N N 52 107.760 107.760 109.256 -1.496 25153 16209 1 18 . 1 1 52 52 GLY C C 52 174.710 174.710 172.074 2.636 25153 16210 1 18 . 1 1 52 52 GLY CA C 52 43.870 43.870 44.507 -0.637 25153 16211 1 18 . 1 1 52 52 GLY H H 52 8.860 8.860 8.540 0.320 25153 16212 1 18 . 1 1 53 53 ILE N N 53 123.890 123.890 116.531 7.359 25153 16213 1 18 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.892 0.378 25153 16214 1 18 . 1 1 53 53 ILE C C 53 172.630 172.630 173.087 -0.457 25153 16215 1 18 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.860 -0.180 25153 16216 1 18 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.794 3.366 25153 16217 1 18 . 1 1 53 53 ILE H H 53 8.458 8.458 7.888 0.570 25153 16218 1 18 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.921 0.467 25153 16219 1 18 . 1 1 54 54 PRO C C 54 175.000 175.000 176.266 -1.266 25153 16220 1 18 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.589 0.011 25153 16221 1 18 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.840 -0.540 25153 16222 1 18 . 1 1 55 55 THR N N 55 112.754 112.754 118.819 -6.065 25153 16223 1 18 . 1 1 55 55 THR HA H 55 4.452 4.452 4.583 -0.131 25153 16224 1 18 . 1 1 55 55 THR C C 55 172.480 172.480 174.167 -1.687 25153 16225 1 18 . 1 1 55 55 THR CA C 55 62.350 62.350 63.091 -0.741 25153 16226 1 18 . 1 1 55 55 THR CB C 55 70.230 70.230 69.666 0.564 25153 16227 1 18 . 1 1 55 55 THR H H 55 6.523 6.523 8.084 -1.561 25153 16228 1 18 . 1 1 56 56 TRP N N 56 130.044 130.044 128.007 2.037 25153 16229 1 18 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.494 -1.779 25153 16230 1 18 . 1 1 56 56 TRP C C 56 172.890 172.890 175.719 -2.829 25153 16231 1 18 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.778 -0.128 25153 16232 1 18 . 1 1 56 56 TRP CB C 56 33.000 33.000 30.806 2.194 25153 16233 1 18 . 1 1 56 56 TRP H H 56 8.450 8.450 8.803 -0.353 25153 16234 1 18 . 1 1 57 57 ASP N N 57 115.275 115.275 121.181 -5.906 25153 16235 1 18 . 1 1 57 57 ASP HA H 57 4.352 4.352 3.901 0.451 25153 16236 1 18 . 1 1 57 57 ASP C C 57 173.660 173.660 174.855 -1.195 25153 16237 1 18 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.191 1.039 25153 16238 1 18 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.768 0.402 25153 16239 1 18 . 1 1 58 58 PHE N N 58 112.840 112.840 117.305 -4.465 25153 16240 1 18 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.659 -0.335 25153 16241 1 18 . 1 1 58 58 PHE C C 58 175.730 175.730 176.058 -0.328 25153 16242 1 18 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.031 0.792 25153 16243 1 18 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.013 -2.259 25153 16244 1 18 . 1 1 58 58 PHE H H 58 7.640 7.640 7.607 0.033 25153 16245 1 18 . 1 1 59 59 GLY N N 59 104.940 104.940 106.216 -1.276 25153 16246 1 18 . 1 1 59 59 GLY C C 59 173.750 173.750 174.615 -0.865 25153 16247 1 18 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.156 1.134 25153 16248 1 18 . 1 1 59 59 GLY H H 59 8.024 8.024 8.796 -0.772 25153 16249 1 18 . 1 1 60 60 GLU N N 60 120.045 120.045 119.611 0.434 25153 16250 1 18 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.473 -0.060 25153 16251 1 18 . 1 1 60 60 GLU C C 60 176.050 176.050 176.142 -0.092 25153 16252 1 18 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.684 -1.064 25153 16253 1 18 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.051 -0.441 25153 16254 1 18 . 1 1 61 61 ILE N N 61 120.790 120.790 121.625 -0.835 25153 16255 1 18 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.042 -0.575 25153 16256 1 18 . 1 1 61 61 ILE C C 61 175.130 175.130 176.177 -1.047 25153 16257 1 18 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.481 0.066 25153 16258 1 18 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.775 0.075 25153 16259 1 18 . 1 1 61 61 ILE H H 61 8.200 8.200 8.468 -0.268 25153 16260 1 18 . 1 1 62 62 GLN N N 62 124.520 124.520 123.149 1.371 25153 16261 1 18 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.321 -0.365 25153 16262 1 18 . 1 1 62 62 GLN C C 62 177.160 177.160 177.180 -0.020 25153 16263 1 18 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.697 0.913 25153 16264 1 18 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.146 -2.496 25153 16265 1 18 . 1 1 62 62 GLN H H 62 5.667 5.667 8.704 -3.037 25153 16266 1 18 . 1 1 63 63 GLU N N 63 124.570 124.570 126.268 -1.698 25153 16267 1 18 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.300 -0.314 25153 16268 1 18 . 1 1 63 63 GLU C C 63 177.300 177.300 177.509 -0.209 25153 16269 1 18 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.763 1.957 25153 16270 1 18 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.372 0.748 25153 16271 1 18 . 1 1 64 64 ASP N N 64 119.060 119.060 120.210 -1.150 25153 16272 1 18 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.575 0.045 25153 16273 1 18 . 1 1 64 64 ASP C C 64 179.180 179.180 178.010 1.170 25153 16274 1 18 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.250 1.700 25153 16275 1 18 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.944 0.006 25153 16276 1 18 . 1 1 65 65 TRP N N 65 121.070 121.070 121.948 -0.878 25153 16277 1 18 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.409 -0.069 25153 16278 1 18 . 1 1 65 65 TRP C C 65 178.970 178.970 178.187 0.783 25153 16279 1 18 . 1 1 65 65 TRP CA C 65 60.820 60.820 61.444 -0.624 25153 16280 1 18 . 1 1 65 65 TRP CB C 65 30.400 30.400 29.922 0.478 25153 16281 1 18 . 1 1 65 65 TRP H H 65 7.350 7.350 7.889 -0.539 25153 16282 1 18 . 1 1 66 66 GLU N N 66 120.900 120.900 118.103 2.797 25153 16283 1 18 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.874 -0.034 25153 16284 1 18 . 1 1 66 66 GLU C C 66 178.750 178.750 179.065 -0.315 25153 16285 1 18 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.399 0.601 25153 16286 1 18 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.219 -0.359 25153 16287 1 18 . 1 1 67 67 ALA N N 67 119.130 119.130 119.706 -0.576 25153 16288 1 18 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.271 -0.018 25153 16289 1 18 . 1 1 67 67 ALA C C 67 179.410 179.410 179.092 0.318 25153 16290 1 18 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.637 -0.057 25153 16291 1 18 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.941 -0.131 25153 16292 1 18 . 1 1 67 67 ALA H H 67 7.640 7.640 7.616 0.024 25153 16293 1 18 . 1 1 68 68 VAL N N 68 106.845 106.845 112.051 -5.206 25153 16294 1 18 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.502 0.308 25153 16295 1 18 . 1 1 68 68 VAL C C 68 176.750 176.750 176.903 -0.153 25153 16296 1 18 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.549 -2.939 25153 16297 1 18 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.587 0.033 25153 16298 1 18 . 1 1 68 68 VAL H H 68 7.219 7.219 7.554 -0.335 25153 16299 1 18 . 1 1 69 69 TRP N N 69 127.630 127.630 124.020 3.610 25153 16300 1 18 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.254 -0.016 25153 16301 1 18 . 1 1 69 69 TRP C C 69 178.670 178.670 177.079 1.591 25153 16302 1 18 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.588 -1.368 25153 16303 1 18 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.856 1.774 25153 16304 1 18 . 1 1 69 69 TRP H H 69 7.832 7.832 8.444 -0.612 25153 16305 1 18 . 1 1 70 70 ASP N N 70 114.544 114.544 118.334 -3.790 25153 16306 1 18 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.447 0.075 25153 16307 1 18 . 1 1 70 70 ASP C C 70 178.670 178.670 178.989 -0.319 25153 16308 1 18 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.245 -1.245 25153 16309 1 18 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.967 -1.117 25153 16310 1 18 . 1 1 71 71 GLN N N 71 120.040 120.040 119.317 0.723 25153 16311 1 18 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.132 0.052 25153 16312 1 18 . 1 1 71 71 GLN C C 71 178.910 178.910 178.828 0.082 25153 16313 1 18 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.344 -0.734 25153 16314 1 18 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.884 0.216 25153 16315 1 18 . 1 1 71 71 GLN H H 71 7.995 7.995 7.743 0.252 25153 16316 1 18 . 1 1 72 72 LEU N N 72 117.400 117.400 118.874 -1.474 25153 16317 1 18 . 1 1 72 72 LEU HA H 72 3.813 3.813 4.012 -0.199 25153 16318 1 18 . 1 1 72 72 LEU C C 72 178.650 178.650 178.308 0.342 25153 16319 1 18 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.278 -0.078 25153 16320 1 18 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.284 0.126 25153 16321 1 18 . 1 1 72 72 LEU H H 72 7.450 7.450 7.696 -0.246 25153 16322 1 18 . 1 1 73 73 ASP N N 73 115.750 115.750 118.560 -2.810 25153 16323 1 18 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.427 -0.259 25153 16324 1 18 . 1 1 73 73 ASP C C 73 177.560 177.560 177.335 0.225 25153 16325 1 18 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.726 0.674 25153 16326 1 18 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.210 -1.110 25153 16327 1 18 . 1 1 74 74 ASP N N 74 117.223 117.223 119.846 -2.623 25153 16328 1 18 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.588 0.115 25153 16329 1 18 . 1 1 74 74 ASP C C 74 176.388 176.388 177.037 -0.649 25153 16330 1 18 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.004 -0.504 25153 16331 1 18 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.579 0.121 25153 16332 1 18 . 1 1 75 75 LEU N N 75 118.316 118.316 119.524 -1.208 25153 16333 1 18 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.371 -0.086 25153 16334 1 18 . 1 1 75 75 LEU C C 75 176.820 176.820 175.867 0.953 25153 16335 1 18 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.453 -0.053 25153 16336 1 18 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.467 0.813 25153 16337 1 18 . 1 1 75 75 LEU H H 75 6.960 6.960 7.281 -0.321 25153 16338 1 18 . 1 1 76 76 ASN N N 76 123.045 123.045 118.239 4.806 25153 16339 1 18 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.771 0.119 25153 16340 1 18 . 1 1 76 76 ASN C C 76 174.950 174.950 174.768 0.182 25153 16341 1 18 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.732 -0.682 25153 16342 1 18 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.496 -0.996 25153 16343 1 18 . 1 1 76 76 ASN H H 76 9.890 9.890 8.788 1.102 25153 16344 1 18 . 1 1 77 77 LEU N N 77 123.494 123.494 123.434 0.060 25153 16345 1 18 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.540 -0.170 25153 16346 1 18 . 1 1 77 77 LEU C C 77 175.040 175.040 176.328 -1.288 25153 16347 1 18 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.859 -1.609 25153 16348 1 18 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.405 0.495 25153 16349 1 18 . 1 1 77 77 LEU H H 77 8.730 8.730 8.108 0.622 25153 16350 1 18 . 1 1 78 78 GLU N N 78 120.870 120.870 121.496 -0.626 25153 16351 1 18 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.376 -0.476 25153 16352 1 18 . 1 1 78 78 GLU C C 78 178.660 178.660 177.824 0.836 25153 16353 1 18 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.652 1.108 25153 16354 1 18 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.274 0.126 25153 16355 1 18 . 1 1 79 79 GLY N N 79 113.240 113.240 113.965 -0.725 25153 16356 1 18 . 1 1 79 79 GLY C C 79 174.460 174.460 174.551 -0.091 25153 16357 1 18 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.311 0.119 25153 16358 1 18 . 1 1 79 79 GLY H H 79 8.474 8.474 8.778 -0.304 25153 16359 1 18 . 1 1 80 80 LYS N N 80 120.295 120.295 120.056 0.239 25153 16360 1 18 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.482 -0.124 25153 16361 1 18 . 1 1 80 80 LYS C C 80 175.360 175.360 176.250 -0.890 25153 16362 1 18 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.243 0.727 25153 16363 1 18 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.759 -0.559 25153 16364 1 18 . 1 1 81 81 ILE N N 81 122.400 122.400 122.946 -0.546 25153 16365 1 18 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.619 0.174 25153 16366 1 18 . 1 1 81 81 ILE C C 81 174.760 174.760 175.503 -0.743 25153 16367 1 18 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.547 -1.716 25153 16368 1 18 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.817 -0.117 25153 16369 1 18 . 1 1 81 81 ILE H H 81 7.400 7.400 7.924 -0.524 25153 16370 1 18 . 1 1 82 82 VAL N N 82 127.840 127.840 125.684 2.156 25153 16371 1 18 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.094 0.168 25153 16372 1 18 . 1 1 82 82 VAL C C 82 172.724 172.724 174.317 -1.593 25153 16373 1 18 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.196 0.214 25153 16374 1 18 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.285 0.115 25153 16375 1 18 . 1 1 82 82 VAL H H 82 8.790 8.790 8.865 -0.075 25153 16376 1 18 . 1 1 83 83 ALA N N 83 131.347 131.347 129.870 1.477 25153 16377 1 18 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.344 0.038 25153 16378 1 18 . 1 1 83 83 ALA C C 83 175.750 175.750 176.338 -0.588 25153 16379 1 18 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.123 -0.253 25153 16380 1 18 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.519 1.931 25153 16381 1 18 . 1 1 83 83 ALA H H 83 9.300 9.300 9.003 0.297 25153 16382 1 18 . 1 1 84 84 LEU N N 84 124.200 124.200 126.283 -2.083 25153 16383 1 18 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.704 -0.184 25153 16384 1 18 . 1 1 84 84 LEU C C 84 175.760 175.760 176.797 -1.037 25153 16385 1 18 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.778 -0.278 25153 16386 1 18 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.448 1.452 25153 16387 1 18 . 1 1 84 84 LEU H H 84 10.287 10.287 9.079 1.208 25153 16388 1 18 . 1 1 85 85 TYR N N 85 115.912 115.912 118.842 -2.930 25153 16389 1 18 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.264 -0.304 25153 16390 1 18 . 1 1 85 85 TYR C C 85 172.372 172.372 173.635 -1.263 25153 16391 1 18 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.203 0.897 25153 16392 1 18 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.400 1.630 25153 16393 1 18 . 1 1 85 85 TYR H H 85 9.257 9.257 8.628 0.629 25153 16394 1 18 . 1 1 86 86 GLY N N 86 107.800 107.800 105.895 1.905 25153 16395 1 18 . 1 1 86 86 GLY C C 86 170.330 170.330 171.523 -1.193 25153 16396 1 18 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.665 -0.295 25153 16397 1 18 . 1 1 86 86 GLY H H 86 9.027 9.027 8.615 0.412 25153 16398 1 18 . 1 1 87 87 LEU N N 87 123.458 123.458 117.846 5.612 25153 16399 1 18 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.197 0.268 25153 16400 1 18 . 1 1 87 87 LEU C C 87 178.100 178.100 175.996 2.104 25153 16401 1 18 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.714 0.876 25153 16402 1 18 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.257 0.083 25153 16403 1 18 . 1 1 87 87 LEU H H 87 6.580 6.580 7.870 -1.290 25153 16404 1 18 . 1 1 88 88 GLY N N 88 108.966 108.966 107.131 1.835 25153 16405 1 18 . 1 1 88 88 GLY C C 88 172.820 172.820 171.790 1.030 25153 16406 1 18 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.594 1.066 25153 16407 1 18 . 1 1 88 88 GLY H H 88 8.070 8.070 7.921 0.149 25153 16408 1 18 . 1 1 89 89 ASP N N 89 121.150 121.150 117.144 4.006 25153 16409 1 18 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.240 0.006 25153 16410 1 18 . 1 1 89 89 ASP C C 89 176.220 176.220 176.194 0.026 25153 16411 1 18 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.958 -0.488 25153 16412 1 18 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.963 -1.483 25153 16413 1 18 . 1 1 90 90 GLN N N 90 123.970 123.970 123.015 0.955 25153 16414 1 18 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.058 -0.570 25153 16415 1 18 . 1 1 90 90 GLN C C 90 173.646 173.646 176.122 -2.476 25153 16416 1 18 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.561 0.749 25153 16417 1 18 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.525 -0.315 25153 16418 1 18 . 1 1 90 90 GLN H H 90 8.623 8.623 8.686 -0.063 25153 16419 1 18 . 1 1 91 91 LEU N N 91 118.017 118.017 119.268 -1.251 25153 16420 1 18 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.152 0.223 25153 16421 1 18 . 1 1 91 91 LEU C C 91 180.160 180.160 178.473 1.687 25153 16422 1 18 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.336 -0.276 25153 16423 1 18 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.067 -0.517 25153 16424 1 18 . 1 1 91 91 LEU H H 91 7.046 7.046 8.809 -1.763 25153 16425 1 18 . 1 1 92 92 GLY N N 92 110.028 110.028 104.671 5.357 25153 16426 1 18 . 1 1 92 92 GLY C C 92 174.912 174.912 174.436 0.476 25153 16427 1 18 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.500 0.680 25153 16428 1 18 . 1 1 92 92 GLY H H 92 9.238 9.238 8.900 0.338 25153 16429 1 18 . 1 1 93 93 TYR N N 93 115.910 115.910 119.105 -3.195 25153 16430 1 18 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.399 -0.390 25153 16431 1 18 . 1 1 93 93 TYR C C 93 176.850 176.850 176.803 0.047 25153 16432 1 18 . 1 1 93 93 TYR CA C 93 56.730 56.730 56.100 0.630 25153 16433 1 18 . 1 1 93 93 TYR CB C 93 38.130 38.130 38.255 -0.124 25153 16434 1 18 . 1 1 93 93 TYR H H 93 6.962 6.962 7.685 -0.723 25153 16435 1 18 . 1 1 94 94 GLY N N 94 111.630 111.630 110.753 0.877 25153 16436 1 18 . 1 1 94 94 GLY C C 94 177.777 177.777 175.767 2.010 25153 16437 1 18 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.486 2.544 25153 16438 1 18 . 1 1 94 94 GLY H H 94 7.835 7.835 8.062 -0.227 25153 16439 1 18 . 1 1 95 95 GLU N N 95 122.450 122.450 119.946 2.504 25153 16440 1 18 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.893 0.025 25153 16441 1 18 . 1 1 95 95 GLU C C 95 175.300 175.300 176.738 -1.438 25153 16442 1 18 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.717 -0.617 25153 16443 1 18 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.064 -0.553 25153 16444 1 18 . 1 1 96 96 TRP N N 96 118.790 118.790 116.884 1.906 25153 16445 1 18 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.937 0.507 25153 16446 1 18 . 1 1 96 96 TRP C C 96 179.280 179.280 175.948 3.332 25153 16447 1 18 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.873 1.142 25153 16448 1 18 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.308 -0.288 25153 16449 1 18 . 1 1 96 96 TRP H H 96 8.070 8.070 8.097 -0.027 25153 16450 1 18 . 1 1 97 97 PHE N N 97 128.067 128.067 123.613 4.454 25153 16451 1 18 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.348 0.957 25153 16452 1 18 . 1 1 97 97 PHE C C 97 173.227 173.227 176.029 -2.802 25153 16453 1 18 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.411 -2.691 25153 16454 1 18 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.483 0.458 25153 16455 1 18 . 1 1 97 97 PHE H H 97 7.165 7.165 8.329 -1.164 25153 16456 1 18 . 1 1 98 98 LEU N N 98 114.306 114.306 124.339 -10.033 25153 16457 1 18 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.637 -0.147 25153 16458 1 18 . 1 1 98 98 LEU C C 98 179.365 179.365 177.209 2.156 25153 16459 1 18 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.457 0.003 25153 16460 1 18 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.811 -0.581 25153 16461 1 18 . 1 1 98 98 LEU H H 98 7.453 7.453 8.703 -1.250 25153 16462 1 18 . 1 1 99 99 ASP N N 99 122.354 122.354 120.834 1.520 25153 16463 1 18 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.347 -0.414 25153 16464 1 18 . 1 1 99 99 ASP C C 99 178.800 178.800 177.242 1.558 25153 16465 1 18 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.614 1.566 25153 16466 1 18 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.348 -0.918 25153 16467 1 18 . 1 1 100 100 ALA N N 100 118.568 118.568 121.698 -3.130 25153 16468 1 18 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.063 -0.223 25153 16469 1 18 . 1 1 100 100 ALA C C 100 178.500 178.500 179.109 -0.609 25153 16470 1 18 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.071 -0.155 25153 16471 1 18 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.506 1.154 25153 16472 1 18 . 1 1 100 100 ALA H H 100 8.682 8.682 7.862 0.820 25153 16473 1 18 . 1 1 101 101 LEU N N 101 118.815 118.815 120.634 -1.819 25153 16474 1 18 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.942 -0.262 25153 16475 1 18 . 1 1 101 101 LEU C C 101 178.930 178.930 178.784 0.146 25153 16476 1 18 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.783 -0.083 25153 16477 1 18 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.520 0.880 25153 16478 1 18 . 1 1 101 101 LEU H H 101 6.637 6.637 7.315 -0.678 25153 16479 1 18 . 1 1 102 102 GLY N N 102 103.700 103.700 106.329 -2.629 25153 16480 1 18 . 1 1 102 102 GLY C C 102 175.530 175.530 176.159 -0.629 25153 16481 1 18 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.265 0.735 25153 16482 1 18 . 1 1 102 102 GLY H H 102 7.330 7.330 7.978 -0.648 25153 16483 1 18 . 1 1 103 103 MET N N 103 120.330 120.330 121.497 -1.167 25153 16484 1 18 . 1 1 103 103 MET HA H 103 4.254 4.254 4.221 0.033 25153 16485 1 18 . 1 1 103 103 MET C C 103 179.688 179.688 178.638 1.050 25153 16486 1 18 . 1 1 103 103 MET CA C 103 59.615 59.615 59.462 0.153 25153 16487 1 18 . 1 1 103 103 MET CB C 103 33.290 33.290 32.629 0.661 25153 16488 1 18 . 1 1 103 103 MET H H 103 8.407 8.407 7.955 0.452 25153 16489 1 18 . 1 1 104 104 LEU N N 104 123.450 123.450 120.113 3.337 25153 16490 1 18 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.727 0.469 25153 16491 1 18 . 1 1 104 104 LEU C C 104 177.620 177.620 178.801 -1.181 25153 16492 1 18 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.828 0.142 25153 16493 1 18 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.429 -0.129 25153 16494 1 18 . 1 1 104 104 LEU H H 104 8.330 8.330 8.561 -0.231 25153 16495 1 18 . 1 1 105 105 HIS N N 105 119.040 119.040 119.091 -0.051 25153 16496 1 18 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.057 -0.180 25153 16497 1 18 . 1 1 105 105 HIS C C 105 177.100 177.100 177.037 0.063 25153 16498 1 18 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.628 0.342 25153 16499 1 18 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.689 -1.095 25153 16500 1 18 . 1 1 105 105 HIS H H 105 8.050 8.050 8.410 -0.360 25153 16501 1 18 . 1 1 106 106 ASP N N 106 119.950 119.950 119.588 0.362 25153 16502 1 18 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.484 -0.154 25153 16503 1 18 . 1 1 106 106 ASP C C 106 179.300 179.300 178.413 0.887 25153 16504 1 18 . 1 1 106 106 ASP CA C 106 57.810 57.810 56.725 1.085 25153 16505 1 18 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.208 -0.808 25153 16506 1 18 . 1 1 107 107 LYS N N 107 122.060 122.060 120.046 2.014 25153 16507 1 18 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.067 0.066 25153 16508 1 18 . 1 1 107 107 LYS C C 107 178.100 178.100 178.262 -0.162 25153 16509 1 18 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.483 -0.283 25153 16510 1 18 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.197 0.163 25153 16511 1 18 . 1 1 108 108 LEU N N 108 115.610 115.610 115.522 0.088 25153 16512 1 18 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.430 -0.362 25153 16513 1 18 . 1 1 108 108 LEU C C 108 178.866 178.866 177.979 0.887 25153 16514 1 18 . 1 1 108 108 LEU CA C 108 55.954 55.954 55.547 0.407 25153 16515 1 18 . 1 1 108 108 LEU CB C 108 42.160 42.160 42.508 -0.348 25153 16516 1 18 . 1 1 108 108 LEU H H 108 7.828 7.828 8.123 -0.295 25153 16517 1 18 . 1 1 109 109 SER N N 109 116.362 116.362 116.271 0.091 25153 16518 1 18 . 1 1 109 109 SER HA H 109 4.299 4.299 4.279 0.020 25153 16519 1 18 . 1 1 109 109 SER C C 109 175.660 175.660 176.622 -0.962 25153 16520 1 18 . 1 1 109 109 SER CA C 109 62.350 62.350 61.243 1.107 25153 16521 1 18 . 1 1 109 109 SER CB C 109 62.815 62.815 63.000 -0.185 25153 16522 1 18 . 1 1 109 109 SER H H 109 8.278 8.278 8.570 -0.292 25153 16523 1 18 . 1 1 110 110 THR N N 110 110.230 110.230 116.156 -5.926 25153 16524 1 18 . 1 1 110 110 THR HA H 110 4.615 4.615 4.246 0.369 25153 16525 1 18 . 1 1 110 110 THR C C 110 175.990 175.990 175.508 0.482 25153 16526 1 18 . 1 1 110 110 THR CA C 110 62.090 62.090 64.045 -1.955 25153 16527 1 18 . 1 1 110 110 THR CB C 110 68.800 68.800 68.967 -0.167 25153 16528 1 18 . 1 1 110 110 THR H H 110 7.211 7.211 7.773 -0.562 25153 16529 1 18 . 1 1 111 111 LYS N N 111 119.900 119.900 119.787 0.113 25153 16530 1 18 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.341 0.171 25153 16531 1 18 . 1 1 111 111 LYS C C 111 176.916 176.916 176.478 0.438 25153 16532 1 18 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.477 0.177 25153 16533 1 18 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.166 -1.323 25153 16534 1 18 . 1 1 112 112 GLY N N 112 107.910 107.910 107.955 -0.045 25153 16535 1 18 . 1 1 112 112 GLY C C 112 176.250 176.250 173.989 2.261 25153 16536 1 18 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.598 1.442 25153 16537 1 18 . 1 1 112 112 GLY H H 112 8.366 8.366 7.646 0.720 25153 16538 1 18 . 1 1 113 113 VAL N N 113 113.530 113.530 116.190 -2.660 25153 16539 1 18 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.523 -0.049 25153 16540 1 18 . 1 1 113 113 VAL C C 113 174.630 174.630 174.719 -0.089 25153 16541 1 18 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.657 -1.206 25153 16542 1 18 . 1 1 113 113 VAL CB C 113 32.550 32.550 33.239 -0.689 25153 16543 1 18 . 1 1 113 113 VAL H H 113 6.903 6.903 6.930 -0.027 25153 16544 1 18 . 1 1 114 114 LYS N N 114 123.020 123.020 119.222 3.798 25153 16545 1 18 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.497 0.008 25153 16546 1 18 . 1 1 114 114 LYS C C 114 175.000 175.000 174.908 0.092 25153 16547 1 18 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.382 -0.182 25153 16548 1 18 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.600 -1.260 25153 16549 1 18 . 1 1 115 115 PHE N N 115 123.290 123.290 120.773 2.517 25153 16550 1 18 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.725 -0.012 25153 16551 1 18 . 1 1 115 115 PHE C C 115 177.605 177.605 176.446 1.159 25153 16552 1 18 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.793 1.817 25153 16553 1 18 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.557 -0.557 25153 16554 1 18 . 1 1 115 115 PHE H H 115 8.494 8.494 8.414 0.080 25153 16555 1 18 . 1 1 116 116 VAL N N 116 115.790 115.790 115.438 0.352 25153 16556 1 18 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.372 0.120 25153 16557 1 18 . 1 1 116 116 VAL C C 116 175.414 175.414 175.979 -0.565 25153 16558 1 18 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.390 -0.404 25153 16559 1 18 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.497 -0.397 25153 16560 1 18 . 1 1 116 116 VAL H H 116 8.889 8.889 8.551 0.338 25153 16561 1 18 . 1 1 117 117 GLY N N 117 108.300 108.300 107.982 0.318 25153 16562 1 18 . 1 1 117 117 GLY C C 117 176.180 176.180 174.697 1.483 25153 16563 1 18 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.496 2.304 25153 16564 1 18 . 1 1 117 117 GLY H H 117 9.810 9.810 8.638 1.172 25153 16565 1 18 . 1 1 118 118 TYR N N 118 120.050 120.050 119.488 0.562 25153 16566 1 18 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.781 0.173 25153 16567 1 18 . 1 1 118 118 TYR C C 118 177.450 177.450 176.030 1.420 25153 16568 1 18 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.371 -1.131 25153 16569 1 18 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.096 -2.986 25153 16570 1 18 . 1 1 118 118 TYR H H 118 8.592 8.592 7.523 1.069 25153 16571 1 18 . 1 1 119 119 TRP N N 119 125.500 125.500 121.817 3.683 25153 16572 1 18 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.118 0.910 25153 16573 1 18 . 1 1 119 119 TRP C C 119 173.090 173.090 174.199 -1.109 25153 16574 1 18 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.350 -0.450 25153 16575 1 18 . 1 1 119 119 TRP CB C 119 36.250 36.250 32.996 3.254 25153 16576 1 18 . 1 1 119 119 TRP H H 119 7.926 7.926 8.175 -0.249 25153 16577 1 18 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.715 0.095 25153 16578 1 18 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.661 1.019 25153 16579 1 18 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.741 -0.491 25153 16580 1 18 . 1 1 121 121 THR N N 121 109.114 109.114 110.723 -1.609 25153 16581 1 18 . 1 1 121 121 THR HA H 121 4.142 4.142 3.581 0.561 25153 16582 1 18 . 1 1 121 121 THR C C 121 176.300 176.300 175.525 0.775 25153 16583 1 18 . 1 1 121 121 THR CA C 121 61.230 61.230 62.836 -1.606 25153 16584 1 18 . 1 1 121 121 THR CB C 121 69.890 69.890 68.681 1.209 25153 16585 1 18 . 1 1 121 121 THR H H 121 7.356 7.356 8.336 -0.980 25153 16586 1 18 . 1 1 122 122 GLU N N 122 123.980 123.980 122.546 1.434 25153 16587 1 18 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.128 0.110 25153 16588 1 18 . 1 1 122 122 GLU C C 122 177.830 177.830 177.832 -0.002 25153 16589 1 18 . 1 1 122 122 GLU CA C 122 58.230 58.230 58.395 -0.165 25153 16590 1 18 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.943 -0.173 25153 16591 1 18 . 1 1 123 123 GLY N N 123 114.570 114.570 112.671 1.899 25153 16592 1 18 . 1 1 123 123 GLY C C 123 173.700 173.700 174.297 -0.597 25153 16593 1 18 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.382 0.019 25153 16594 1 18 . 1 1 123 123 GLY H H 123 9.181 9.181 8.810 0.371 25153 16595 1 18 . 1 1 124 124 TYR N N 124 118.923 118.923 119.816 -0.893 25153 16596 1 18 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.698 0.612 25153 16597 1 18 . 1 1 124 124 TYR C C 124 175.680 175.680 174.907 0.773 25153 16598 1 18 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.006 -1.536 25153 16599 1 18 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.332 0.668 25153 16600 1 18 . 1 1 124 124 TYR H H 124 7.877 7.877 7.767 0.110 25153 16601 1 18 . 1 1 125 125 GLU N N 125 124.890 124.890 122.819 2.071 25153 16602 1 18 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.597 0.103 25153 16603 1 18 . 1 1 125 125 GLU C C 125 172.880 172.880 175.269 -2.389 25153 16604 1 18 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.601 -0.171 25153 16605 1 18 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.681 -0.261 25153 16606 1 18 . 1 1 126 126 PHE N N 126 119.166 119.166 120.433 -1.267 25153 16607 1 18 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.547 0.262 25153 16608 1 18 . 1 1 126 126 PHE C C 126 173.750 173.750 174.687 -0.937 25153 16609 1 18 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.248 -1.458 25153 16610 1 18 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.170 0.880 25153 16611 1 18 . 1 1 126 126 PHE H H 126 7.716 7.716 8.032 -0.316 25153 16612 1 18 . 1 1 127 127 THR N N 127 106.800 106.800 115.598 -8.798 25153 16613 1 18 . 1 1 127 127 THR HA H 127 4.400 4.400 3.416 0.984 25153 16614 1 18 . 1 1 127 127 THR C C 127 175.300 175.300 174.018 1.282 25153 16615 1 18 . 1 1 127 127 THR CA C 127 61.100 61.100 62.542 -1.442 25153 16616 1 18 . 1 1 127 127 THR CB C 127 70.600 70.600 67.891 2.709 25153 16617 1 18 . 1 1 127 127 THR H H 127 7.220 7.220 6.478 0.742 25153 16618 1 18 . 1 1 128 128 SER N N 128 118.360 118.360 115.658 2.702 25153 16619 1 18 . 1 1 128 128 SER HA H 128 4.680 4.680 4.536 0.144 25153 16620 1 18 . 1 1 128 128 SER C C 128 175.720 175.720 174.060 1.660 25153 16621 1 18 . 1 1 128 128 SER CA C 128 56.250 56.250 57.029 -0.778 25153 16622 1 18 . 1 1 128 128 SER CB C 128 65.635 65.635 64.208 1.427 25153 16623 1 18 . 1 1 128 128 SER H H 128 7.411 7.411 8.150 -0.739 25153 16624 1 18 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.572 0.203 25153 16625 1 18 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.212 -1.712 25153 16626 1 18 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.189 0.211 25153 16627 1 18 . 1 1 130 130 LYS N N 130 122.014 122.014 119.557 2.457 25153 16628 1 18 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.398 -0.165 25153 16629 1 18 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.264 3.436 25153 16630 1 18 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.016 -0.446 25153 16631 1 18 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.494 0.024 25153 16632 1 18 . 1 1 131 131 PRO C C 131 174.000 174.000 175.127 -1.127 25153 16633 1 18 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.569 2.131 25153 16634 1 18 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.120 1.080 25153 16635 1 18 . 1 1 132 132 VAL N N 132 113.260 113.260 116.682 -3.422 25153 16636 1 18 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.878 0.322 25153 16637 1 18 . 1 1 132 132 VAL C C 132 175.210 175.210 174.851 0.359 25153 16638 1 18 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.235 -0.615 25153 16639 1 18 . 1 1 132 132 VAL CB C 132 34.980 34.980 36.082 -1.102 25153 16640 1 18 . 1 1 132 132 VAL H H 132 6.697 6.697 7.519 -0.822 25153 16641 1 18 . 1 1 133 133 ILE N N 133 119.940 119.940 118.193 1.747 25153 16642 1 18 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.504 -0.124 25153 16643 1 18 . 1 1 133 133 ILE C C 133 175.440 175.440 175.242 0.198 25153 16644 1 18 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.970 1.480 25153 16645 1 18 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.050 2.050 25153 16646 1 18 . 1 1 133 133 ILE H H 133 8.756 8.756 8.650 0.106 25153 16647 1 18 . 1 1 134 134 ALA N N 134 122.632 122.632 123.926 -1.294 25153 16648 1 18 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.920 0.040 25153 16649 1 18 . 1 1 134 134 ALA C C 134 178.312 178.312 177.238 1.074 25153 16650 1 18 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.610 -1.530 25153 16651 1 18 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.241 -0.405 25153 16652 1 18 . 1 1 134 134 ALA H H 134 8.523 8.523 8.508 0.015 25153 16653 1 18 . 1 1 135 135 ASP N N 135 117.366 117.366 122.729 -5.363 25153 16654 1 18 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.670 -0.418 25153 16655 1 18 . 1 1 135 135 ASP C C 135 176.387 176.387 176.642 -0.255 25153 16656 1 18 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.364 1.846 25153 16657 1 18 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.257 -1.556 25153 16658 1 18 . 1 1 136 136 GLY N N 136 104.310 104.310 108.071 -3.761 25153 16659 1 18 . 1 1 136 136 GLY C C 136 174.922 174.922 174.973 -0.051 25153 16660 1 18 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.370 -0.270 25153 16661 1 18 . 1 1 136 136 GLY H H 136 7.610 7.610 8.314 -0.704 25153 16662 1 18 . 1 1 137 137 GLN N N 137 118.784 118.784 117.826 0.958 25153 16663 1 18 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.451 -0.396 25153 16664 1 18 . 1 1 137 137 GLN C C 137 176.390 176.390 175.463 0.927 25153 16665 1 18 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.798 1.842 25153 16666 1 18 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.241 -0.011 25153 16667 1 18 . 1 1 137 137 GLN H H 137 7.870 7.870 7.868 0.002 25153 16668 1 18 . 1 1 138 138 LEU N N 138 118.040 118.040 115.875 2.165 25153 16669 1 18 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.032 -0.045 25153 16670 1 18 . 1 1 138 138 LEU C C 138 175.913 175.913 175.038 0.875 25153 16671 1 18 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.207 0.393 25153 16672 1 18 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.967 1.433 25153 16673 1 18 . 1 1 138 138 LEU H H 138 7.356 7.356 7.189 0.167 25153 16674 1 18 . 1 1 139 139 PHE N N 139 119.060 119.060 119.512 -0.452 25153 16675 1 18 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.911 0.399 25153 16676 1 18 . 1 1 139 139 PHE C C 139 178.780 178.780 177.498 1.282 25153 16677 1 18 . 1 1 139 139 PHE CA C 139 56.850 56.850 56.977 -0.127 25153 16678 1 18 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.948 3.512 25153 16679 1 18 . 1 1 139 139 PHE H H 139 10.094 10.094 8.897 1.197 25153 16680 1 18 . 1 1 140 140 VAL N N 140 109.690 109.690 114.528 -4.838 25153 16681 1 18 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.402 0.079 25153 16682 1 18 . 1 1 140 140 VAL C C 140 172.790 172.790 175.445 -2.655 25153 16683 1 18 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.395 -1.395 25153 16684 1 18 . 1 1 140 140 VAL CB C 140 30.550 30.550 30.912 -0.362 25153 16685 1 18 . 1 1 140 140 VAL H H 140 7.470 7.470 8.089 -0.619 25153 16686 1 18 . 1 1 141 141 GLY N N 141 107.060 107.060 105.295 1.765 25153 16687 1 18 . 1 1 141 141 GLY C C 141 171.513 171.513 172.450 -0.937 25153 16688 1 18 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.533 0.897 25153 16689 1 18 . 1 1 141 141 GLY H H 141 7.137 7.137 7.297 -0.160 25153 16690 1 18 . 1 1 142 142 LEU N N 142 117.863 117.863 120.529 -2.666 25153 16691 1 18 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.040 -1.065 25153 16692 1 18 . 1 1 142 142 LEU C C 142 173.640 173.640 175.106 -1.466 25153 16693 1 18 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.512 1.408 25153 16694 1 18 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.270 -4.720 25153 16695 1 18 . 1 1 142 142 LEU H H 142 7.517 7.517 7.659 -0.142 25153 16696 1 18 . 1 1 143 143 ALA N N 143 126.990 126.990 128.941 -1.951 25153 16697 1 18 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.332 -0.055 25153 16698 1 18 . 1 1 143 143 ALA C C 143 175.730 175.730 175.830 -0.100 25153 16699 1 18 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.280 -0.840 25153 16700 1 18 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.395 3.915 25153 16701 1 18 . 1 1 143 143 ALA H H 143 5.186 5.186 8.155 -2.969 25153 16702 1 18 . 1 1 144 144 LEU N N 144 125.477 125.477 123.549 1.928 25153 16703 1 18 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.581 0.199 25153 16704 1 18 . 1 1 144 144 LEU C C 144 174.473 174.473 174.982 -0.509 25153 16705 1 18 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.711 -0.471 25153 16706 1 18 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.257 0.043 25153 16707 1 18 . 1 1 144 144 LEU H H 144 8.758 8.758 8.218 0.540 25153 16708 1 18 . 1 1 145 145 ASP N N 145 118.915 118.915 118.782 0.133 25153 16709 1 18 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.164 0.368 25153 16710 1 18 . 1 1 145 145 ASP C C 145 176.470 176.470 176.249 0.221 25153 16711 1 18 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.236 -0.606 25153 16712 1 18 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.014 -1.014 25153 16713 1 18 . 1 1 146 146 GLU N N 146 124.813 124.813 125.034 -0.221 25153 16714 1 18 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.522 -0.146 25153 16715 1 18 . 1 1 146 146 GLU C C 146 177.290 177.290 176.519 0.771 25153 16716 1 18 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.911 0.209 25153 16717 1 18 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.191 0.959 25153 16718 1 18 . 1 1 147 147 THR N N 147 118.328 118.328 113.633 4.695 25153 16719 1 18 . 1 1 147 147 THR HA H 147 4.200 4.200 4.586 -0.386 25153 16720 1 18 . 1 1 147 147 THR C C 147 175.683 175.683 174.437 1.246 25153 16721 1 18 . 1 1 147 147 THR CA C 147 66.250 66.250 62.872 3.378 25153 16722 1 18 . 1 1 147 147 THR CB C 147 69.600 69.600 69.621 -0.021 25153 16723 1 18 . 1 1 147 147 THR H H 147 8.562 8.562 8.993 -0.431 25153 16724 1 18 . 1 1 148 148 ASN N N 148 115.550 115.550 118.331 -2.781 25153 16725 1 18 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.828 0.159 25153 16726 1 18 . 1 1 148 148 ASN C C 148 175.870 175.870 175.593 0.277 25153 16727 1 18 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.069 -0.369 25153 16728 1 18 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.842 2.038 25153 16729 1 18 . 1 1 148 148 ASN H H 148 9.118 9.118 8.470 0.648 25153 16730 1 18 . 1 1 149 149 GLN N N 149 117.400 117.400 119.824 -2.424 25153 16731 1 18 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.252 0.591 25153 16732 1 18 . 1 1 149 149 GLN C C 149 177.780 177.780 177.162 0.618 25153 16733 1 18 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.785 -1.885 25153 16734 1 18 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.105 1.195 25153 16735 1 18 . 1 1 149 149 GLN H H 149 7.555 7.555 8.444 -0.889 25153 16736 1 18 . 1 1 150 150 TYR N N 150 120.674 120.674 116.003 4.671 25153 16737 1 18 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.258 0.270 25153 16738 1 18 . 1 1 150 150 TYR C C 150 177.830 177.830 176.679 1.151 25153 16739 1 18 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.689 -0.202 25153 16740 1 18 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.721 -0.121 25153 16741 1 18 . 1 1 150 150 TYR H H 150 6.983 6.983 7.665 -0.682 25153 16742 1 18 . 1 1 151 151 ASP N N 151 120.810 120.810 119.802 1.008 25153 16743 1 18 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.678 -0.163 25153 16744 1 18 . 1 1 151 151 ASP C C 151 176.400 176.400 177.283 -0.883 25153 16745 1 18 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.987 -0.587 25153 16746 1 18 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.548 -2.468 25153 16747 1 18 . 1 1 152 152 LEU N N 152 118.083 118.083 112.429 5.654 25153 16748 1 18 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.734 -0.058 25153 16749 1 18 . 1 1 152 152 LEU C C 152 178.470 178.470 177.807 0.663 25153 16750 1 18 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.598 -0.998 25153 16751 1 18 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.130 -0.530 25153 16752 1 18 . 1 1 152 152 LEU H H 152 7.453 7.453 7.692 -0.239 25153 16753 1 18 . 1 1 153 153 SER N N 153 116.407 116.407 118.760 -2.353 25153 16754 1 18 . 1 1 153 153 SER HA H 153 3.960 3.960 3.959 0.001 25153 16755 1 18 . 1 1 153 153 SER C C 153 174.590 174.590 175.823 -1.233 25153 16756 1 18 . 1 1 153 153 SER CA C 153 63.400 63.400 63.222 0.178 25153 16757 1 18 . 1 1 153 153 SER CB C 153 63.100 63.100 62.866 0.234 25153 16758 1 18 . 1 1 153 153 SER H H 153 7.360 7.360 8.550 -1.190 25153 16759 1 18 . 1 1 154 154 ASP N N 154 121.960 121.960 120.386 1.574 25153 16760 1 18 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.348 -0.037 25153 16761 1 18 . 1 1 154 154 ASP C C 154 178.640 178.640 177.780 0.860 25153 16762 1 18 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.406 1.594 25153 16763 1 18 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.918 -1.348 25153 16764 1 18 . 1 1 155 155 GLU N N 155 121.310 121.310 118.832 2.478 25153 16765 1 18 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.111 0.074 25153 16766 1 18 . 1 1 155 155 GLU C C 155 179.600 179.600 178.895 0.705 25153 16767 1 18 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.890 0.560 25153 16768 1 18 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.630 -0.230 25153 16769 1 18 . 1 1 156 156 ARG N N 156 121.394 121.394 120.048 1.346 25153 16770 1 18 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.261 0.039 25153 16771 1 18 . 1 1 156 156 ARG C C 156 177.330 177.330 178.968 -1.638 25153 16772 1 18 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.955 1.505 25153 16773 1 18 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.381 0.379 25153 16774 1 18 . 1 1 157 157 ILE N N 157 118.390 118.390 120.893 -2.503 25153 16775 1 18 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.718 -0.284 25153 16776 1 18 . 1 1 157 157 ILE C C 157 178.814 178.814 177.574 1.240 25153 16777 1 18 . 1 1 157 157 ILE CA C 157 66.694 66.694 66.264 0.430 25153 16778 1 18 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.964 0.889 25153 16779 1 18 . 1 1 157 157 ILE H H 157 8.966 8.966 8.388 0.578 25153 16780 1 18 . 1 1 158 158 GLN N N 158 120.060 120.060 118.909 1.151 25153 16781 1 18 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.969 -0.013 25153 16782 1 18 . 1 1 158 158 GLN C C 158 178.843 178.843 178.531 0.312 25153 16783 1 18 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.330 1.270 25153 16784 1 18 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.201 0.189 25153 16785 1 18 . 1 1 158 158 GLN H H 158 8.394 8.394 7.923 0.471 25153 16786 1 18 . 1 1 159 159 SER N N 159 115.613 115.613 117.014 -1.401 25153 16787 1 18 . 1 1 159 159 SER HA H 159 4.455 4.455 4.329 0.126 25153 16788 1 18 . 1 1 159 159 SER C C 159 177.330 177.330 176.703 0.627 25153 16789 1 18 . 1 1 159 159 SER CA C 159 62.400 62.400 61.109 1.291 25153 16790 1 18 . 1 1 159 159 SER CB C 159 63.760 63.760 63.280 0.480 25153 16791 1 18 . 1 1 159 159 SER H H 159 8.460 8.460 7.931 0.529 25153 16792 1 18 . 1 1 160 160 TRP N N 160 126.820 126.820 124.852 1.968 25153 16793 1 18 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.148 0.317 25153 16794 1 18 . 1 1 160 160 TRP C C 160 178.050 178.050 177.481 0.569 25153 16795 1 18 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.777 0.923 25153 16796 1 18 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.339 0.021 25153 16797 1 18 . 1 1 160 160 TRP H H 160 9.318 9.318 8.380 0.938 25153 16798 1 18 . 1 1 161 161 CYS N N 161 116.750 116.750 117.898 -1.148 25153 16799 1 18 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.712 0.171 25153 16800 1 18 . 1 1 161 161 CYS C C 161 176.270 176.270 177.030 -0.760 25153 16801 1 18 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.302 1.058 25153 16802 1 18 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.986 0.894 25153 16803 1 18 . 1 1 161 161 CYS H H 161 8.950 8.950 9.055 -0.105 25153 16804 1 18 . 1 1 162 162 GLU N N 162 118.096 118.096 118.859 -0.763 25153 16805 1 18 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.045 -0.115 25153 16806 1 18 . 1 1 162 162 GLU C C 162 178.680 178.680 177.826 0.854 25153 16807 1 18 . 1 1 162 162 GLU CA C 162 59.730 59.730 58.861 0.869 25153 16808 1 18 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.500 -0.070 25153 16809 1 18 . 1 1 163 163 GLN N N 163 120.790 120.790 117.968 2.822 25153 16810 1 18 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.125 0.051 25153 16811 1 18 . 1 1 163 163 GLN C C 163 179.690 179.690 177.994 1.696 25153 16812 1 18 . 1 1 163 163 GLN CA C 163 59.540 59.540 58.166 1.374 25153 16813 1 18 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.971 0.029 25153 16814 1 18 . 1 1 163 163 GLN H H 163 8.205 8.205 7.532 0.673 25153 16815 1 18 . 1 1 164 164 ILE N N 164 114.860 114.860 119.020 -4.160 25153 16816 1 18 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.849 0.194 25153 16817 1 18 . 1 1 164 164 ILE C C 164 178.680 178.680 177.317 1.363 25153 16818 1 18 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.026 2.184 25153 16819 1 18 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.616 0.084 25153 16820 1 18 . 1 1 164 164 ILE H H 164 9.005 9.005 7.968 1.037 25153 16821 1 18 . 1 1 165 165 LEU N N 165 123.900 123.900 116.072 7.828 25153 16822 1 18 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.186 -0.036 25153 16823 1 18 . 1 1 165 165 LEU C C 165 180.520 180.520 177.436 3.084 25153 16824 1 18 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.249 1.051 25153 16825 1 18 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.209 -0.159 25153 16826 1 18 . 1 1 165 165 LEU H H 165 7.825 7.825 8.117 -0.292 25153 16827 1 18 . 1 1 166 166 ASN N N 166 120.112 120.112 118.069 2.043 25153 16828 1 18 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.742 -0.159 25153 16829 1 18 . 1 1 166 166 ASN C C 166 178.440 178.440 177.200 1.240 25153 16830 1 18 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.977 0.443 25153 16831 1 18 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.676 -1.256 25153 16832 1 18 . 1 1 166 166 ASN H H 166 7.760 7.760 7.947 -0.187 25153 16833 1 18 . 1 1 167 167 GLU N N 167 121.370 121.370 121.725 -0.355 25153 16834 1 18 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.009 0.094 25153 16835 1 18 . 1 1 167 167 GLU C C 167 180.332 180.332 179.370 0.962 25153 16836 1 18 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.697 0.453 25153 16837 1 18 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.674 1.346 25153 16838 1 18 . 1 1 168 168 MET N N 168 118.532 118.532 117.582 0.950 25153 16839 1 18 . 1 1 168 168 MET HA H 168 4.015 4.015 4.264 -0.249 25153 16840 1 18 . 1 1 168 168 MET C C 168 176.600 176.600 178.002 -1.402 25153 16841 1 18 . 1 1 168 168 MET CA C 168 59.300 59.300 59.462 -0.162 25153 16842 1 18 . 1 1 168 168 MET CB C 168 33.400 33.400 32.795 0.605 25153 16843 1 18 . 1 1 168 168 MET H H 168 8.718 8.718 8.445 0.273 25153 16844 1 18 . 1 1 169 169 ALA N N 169 121.922 121.922 122.255 -0.333 25153 16845 1 18 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.165 0.009 25153 16846 1 18 . 1 1 169 169 ALA C C 169 179.410 179.410 179.730 -0.320 25153 16847 1 18 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.886 -0.486 25153 16848 1 18 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.429 -0.019 25153 16849 1 18 . 1 1 169 169 ALA H H 169 7.448 7.448 7.940 -0.492 25153 16850 1 18 . 1 1 170 170 GLU N N 170 117.300 117.300 116.928 0.372 25153 16851 1 18 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.126 -0.031 25153 16852 1 18 . 1 1 170 170 GLU C C 170 177.470 177.470 178.308 -0.838 25153 16853 1 18 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.486 -0.536 25153 16854 1 18 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.561 0.214 25153 16855 1 18 . 1 1 171 171 HIS N N 171 117.944 117.944 118.164 -0.220 25153 16856 1 18 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.360 0.140 25153 16857 1 18 . 1 1 171 171 HIS C C 171 175.120 175.120 177.076 -1.956 25153 16858 1 18 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.667 -1.468 25153 16859 1 18 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.074 0.526 25153 16860 1 18 . 1 1 171 171 HIS H H 171 7.788 7.788 7.860 -0.072 25153 16861 1 18 . 1 1 172 172 TYR N N 172 120.040 120.040 119.060 0.980 25153 16862 1 18 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.244 0.349 25153 16863 1 18 . 1 1 172 172 TYR C C 172 174.612 174.612 176.346 -1.734 25153 16864 1 18 . 1 1 172 172 TYR CA C 172 57.980 57.980 59.652 -1.672 25153 16865 1 18 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.907 0.073 25153 16866 1 18 . 1 1 172 172 TYR H H 172 7.820 7.820 8.083 -0.263 25153 16867 1 19 . 1 1 2 2 ASN N N 2 123.320 123.320 119.495 3.825 25153 16868 1 19 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.114 0.094 25153 16869 1 19 . 1 1 2 2 ASN C C 2 174.590 174.590 174.481 0.109 25153 16870 1 19 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.789 0.211 25153 16871 1 19 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.293 -0.323 25153 16872 1 19 . 1 1 2 2 ASN H H 2 9.428 9.428 8.688 0.740 25153 16873 1 19 . 1 1 3 3 MET N N 3 120.920 120.920 118.700 2.220 25153 16874 1 19 . 1 1 3 3 MET HA H 3 5.530 5.530 5.256 0.274 25153 16875 1 19 . 1 1 3 3 MET C C 3 174.400 174.400 174.903 -0.503 25153 16876 1 19 . 1 1 3 3 MET CA C 3 54.643 54.643 54.324 0.319 25153 16877 1 19 . 1 1 3 3 MET CB C 3 34.637 34.637 37.655 -3.018 25153 16878 1 19 . 1 1 3 3 MET H H 3 8.751 8.751 9.165 -0.414 25153 16879 1 19 . 1 1 4 4 GLY N N 4 115.542 115.542 109.343 6.199 25153 16880 1 19 . 1 1 4 4 GLY C C 4 170.413 170.413 172.206 -1.793 25153 16881 1 19 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.736 -0.634 25153 16882 1 19 . 1 1 4 4 GLY H H 4 8.927 8.927 8.840 0.087 25153 16883 1 19 . 1 1 5 5 LEU N N 5 131.030 131.030 128.138 2.892 25153 16884 1 19 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.354 1.048 25153 16885 1 19 . 1 1 5 5 LEU C C 5 175.952 175.952 174.535 1.417 25153 16886 1 19 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.058 0.392 25153 16887 1 19 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.130 2.462 25153 16888 1 19 . 1 1 5 5 LEU H H 5 8.928 8.928 8.606 0.322 25153 16889 1 19 . 1 1 6 6 PHE N N 6 125.790 125.790 126.042 -0.252 25153 16890 1 19 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.763 -0.023 25153 16891 1 19 . 1 1 6 6 PHE C C 6 174.300 174.300 175.805 -1.505 25153 16892 1 19 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.296 -0.976 25153 16893 1 19 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.829 -0.599 25153 16894 1 19 . 1 1 6 6 PHE H H 6 9.237 9.237 9.484 -0.247 25153 16895 1 19 . 1 1 7 7 TYR N N 7 117.289 117.289 117.100 0.189 25153 16896 1 19 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.974 -0.009 25153 16897 1 19 . 1 1 7 7 TYR C C 7 171.262 171.262 173.334 -2.072 25153 16898 1 19 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.318 -0.918 25153 16899 1 19 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.193 0.047 25153 16900 1 19 . 1 1 7 7 TYR H H 7 8.125 8.125 8.460 -0.335 25153 16901 1 19 . 1 1 8 8 GLY N N 8 107.420 107.420 106.335 1.085 25153 16902 1 19 . 1 1 8 8 GLY C C 8 172.000 172.000 172.191 -0.191 25153 16903 1 19 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.354 -0.410 25153 16904 1 19 . 1 1 8 8 GLY H H 8 7.031 7.031 8.519 -1.488 25153 16905 1 19 . 1 1 9 9 SER N N 9 118.150 118.150 116.580 1.570 25153 16906 1 19 . 1 1 9 9 SER HA H 9 5.200 5.200 5.057 0.143 25153 16907 1 19 . 1 1 9 9 SER C C 9 175.000 175.000 174.524 0.476 25153 16908 1 19 . 1 1 9 9 SER CA C 9 57.570 57.570 57.558 0.012 25153 16909 1 19 . 1 1 9 9 SER CB C 9 66.700 66.700 66.234 0.466 25153 16910 1 19 . 1 1 9 9 SER H H 9 9.604 9.604 8.500 1.104 25153 16911 1 19 . 1 1 10 10 SER N N 10 131.193 131.193 117.272 13.921 25153 16912 1 19 . 1 1 10 10 SER HA H 10 4.775 4.775 4.593 0.182 25153 16913 1 19 . 1 1 10 10 SER C C 10 175.730 175.730 176.151 -0.421 25153 16914 1 19 . 1 1 10 10 SER CA C 10 61.750 61.750 60.147 1.603 25153 16915 1 19 . 1 1 10 10 SER CB C 10 64.400 64.400 64.113 0.287 25153 16916 1 19 . 1 1 10 10 SER H H 10 11.636 11.636 8.876 2.760 25153 16917 1 19 . 1 1 11 11 THR N N 11 115.848 115.848 113.241 2.607 25153 16918 1 19 . 1 1 11 11 THR HA H 11 4.770 4.770 4.253 0.517 25153 16919 1 19 . 1 1 11 11 THR C C 11 173.700 173.700 174.165 -0.465 25153 16920 1 19 . 1 1 11 11 THR CA C 11 60.700 60.700 62.676 -1.976 25153 16921 1 19 . 1 1 11 11 THR CB C 11 67.430 67.430 68.113 -0.683 25153 16922 1 19 . 1 1 11 11 THR H H 11 9.550 9.550 8.394 1.156 25153 16923 1 19 . 1 1 12 12 CYS N N 12 109.780 109.780 115.636 -5.856 25153 16924 1 19 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.181 -0.111 25153 16925 1 19 . 1 1 12 12 CYS C C 12 176.220 176.220 175.262 0.958 25153 16926 1 19 . 1 1 12 12 CYS CA C 12 63.600 63.600 60.601 2.999 25153 16927 1 19 . 1 1 12 12 CYS CB C 12 26.400 26.400 25.360 1.040 25153 16928 1 19 . 1 1 12 12 CYS H H 12 7.437 7.437 8.082 -0.645 25153 16929 1 19 . 1 1 13 13 TYR N N 13 127.830 127.830 120.281 7.549 25153 16930 1 19 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.219 -0.116 25153 16931 1 19 . 1 1 13 13 TYR C C 13 180.880 180.880 177.929 2.951 25153 16932 1 19 . 1 1 13 13 TYR CA C 13 65.100 65.100 59.805 5.295 25153 16933 1 19 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.551 -0.716 25153 16934 1 19 . 1 1 13 13 TYR H H 13 10.886 10.886 7.551 3.335 25153 16935 1 19 . 1 1 14 14 THR N N 14 124.428 124.428 112.849 11.579 25153 16936 1 19 . 1 1 14 14 THR HA H 14 4.160 4.160 4.090 0.070 25153 16937 1 19 . 1 1 14 14 THR C C 14 177.760 177.760 176.300 1.460 25153 16938 1 19 . 1 1 14 14 THR CA C 14 67.823 67.823 66.430 1.393 25153 16939 1 19 . 1 1 14 14 THR CB C 14 68.040 68.040 68.127 -0.087 25153 16940 1 19 . 1 1 14 14 THR H H 14 11.405 11.405 8.734 2.671 25153 16941 1 19 . 1 1 15 15 GLU N N 15 123.050 123.050 123.258 -0.208 25153 16942 1 19 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.101 -0.211 25153 16943 1 19 . 1 1 15 15 GLU C C 15 176.392 176.392 178.248 -1.856 25153 16944 1 19 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.620 -0.420 25153 16945 1 19 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.285 1.165 25153 16946 1 19 . 1 1 16 16 MET N N 16 120.173 120.173 118.258 1.915 25153 16947 1 19 . 1 1 16 16 MET HA H 16 4.050 4.050 4.125 -0.075 25153 16948 1 19 . 1 1 16 16 MET C C 16 179.940 179.940 178.716 1.224 25153 16949 1 19 . 1 1 16 16 MET CA C 16 59.240 59.240 59.222 0.018 25153 16950 1 19 . 1 1 16 16 MET CB C 16 32.970 32.970 32.764 0.207 25153 16951 1 19 . 1 1 16 16 MET H H 16 8.469 8.469 8.227 0.242 25153 16952 1 19 . 1 1 17 17 ALA N N 17 121.930 121.930 121.804 0.126 25153 16953 1 19 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.856 -0.020 25153 16954 1 19 . 1 1 17 17 ALA C C 17 177.900 177.900 178.780 -0.880 25153 16955 1 19 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.096 0.104 25153 16956 1 19 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.125 -0.125 25153 16957 1 19 . 1 1 17 17 ALA H H 17 7.880 7.880 8.146 -0.266 25153 16958 1 19 . 1 1 18 18 ALA N N 18 121.477 121.477 121.486 -0.009 25153 16959 1 19 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.837 -0.100 25153 16960 1 19 . 1 1 18 18 ALA C C 18 179.380 179.380 179.579 -0.199 25153 16961 1 19 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.223 -0.223 25153 16962 1 19 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.851 0.979 25153 16963 1 19 . 1 1 18 18 ALA H H 18 7.374 7.374 8.204 -0.830 25153 16964 1 19 . 1 1 19 19 GLU N N 19 116.650 116.650 118.076 -1.426 25153 16965 1 19 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.849 -0.233 25153 16966 1 19 . 1 1 19 19 GLU C C 19 178.479 178.479 179.299 -0.820 25153 16967 1 19 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.545 0.185 25153 16968 1 19 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.391 -0.091 25153 16969 1 19 . 1 1 20 20 LYS N N 20 119.470 119.470 119.624 -0.154 25153 16970 1 19 . 1 1 20 20 LYS HA H 20 4.050 4.050 3.988 0.062 25153 16971 1 19 . 1 1 20 20 LYS C C 20 179.116 179.116 179.048 0.068 25153 16972 1 19 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.764 0.066 25153 16973 1 19 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.439 0.411 25153 16974 1 19 . 1 1 21 21 ILE N N 21 121.030 121.030 120.630 0.400 25153 16975 1 19 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.675 -0.285 25153 16976 1 19 . 1 1 21 21 ILE C C 21 177.580 177.580 178.206 -0.626 25153 16977 1 19 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.747 0.073 25153 16978 1 19 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.907 0.441 25153 16979 1 19 . 1 1 21 21 ILE H H 21 8.100 8.100 8.598 -0.498 25153 16980 1 19 . 1 1 22 22 ARG N N 22 119.720 119.720 119.463 0.257 25153 16981 1 19 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.849 -0.294 25153 16982 1 19 . 1 1 22 22 ARG C C 22 177.320 177.320 178.103 -0.783 25153 16983 1 19 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.730 -0.010 25153 16984 1 19 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.735 -0.803 25153 16985 1 19 . 1 1 23 23 ASP N N 23 118.730 118.730 119.361 -0.631 25153 16986 1 19 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.408 -0.045 25153 16987 1 19 . 1 1 23 23 ASP C C 23 178.330 178.330 178.786 -0.456 25153 16988 1 19 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.377 -0.427 25153 16989 1 19 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.857 -0.617 25153 16990 1 19 . 1 1 24 24 ILE N N 24 121.090 121.090 119.158 1.932 25153 16991 1 19 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.785 0.011 25153 16992 1 19 . 1 1 24 24 ILE C C 24 178.250 178.250 177.882 0.368 25153 16993 1 19 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.952 -0.802 25153 16994 1 19 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.368 0.112 25153 16995 1 19 . 1 1 24 24 ILE H H 24 7.910 7.910 8.152 -0.242 25153 16996 1 19 . 1 1 25 25 ILE N N 25 121.406 121.406 117.218 4.188 25153 16997 1 19 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.877 -0.231 25153 16998 1 19 . 1 1 25 25 ILE C C 25 176.800 176.800 176.776 0.024 25153 16999 1 19 . 1 1 25 25 ILE CA C 25 65.700 65.700 62.995 2.705 25153 17000 1 19 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.947 -0.757 25153 17001 1 19 . 1 1 25 25 ILE H H 25 8.476 8.476 8.035 0.441 25153 17002 1 19 . 1 1 26 26 GLY N N 26 108.900 108.900 105.232 3.668 25153 17003 1 19 . 1 1 26 26 GLY C C 26 173.710 173.710 172.265 1.445 25153 17004 1 19 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.657 -0.327 25153 17005 1 19 . 1 1 26 26 GLY H H 26 8.016 8.016 7.807 0.209 25153 17006 1 19 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.711 -0.373 25153 17007 1 19 . 1 1 27 27 PRO C C 27 177.200 177.200 177.147 0.053 25153 17008 1 19 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.504 1.183 25153 17009 1 19 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.031 0.169 25153 17010 1 19 . 1 1 28 28 GLU N N 28 116.295 116.295 117.977 -1.682 25153 17011 1 19 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.213 0.057 25153 17012 1 19 . 1 1 28 28 GLU C C 28 176.980 176.980 177.302 -0.322 25153 17013 1 19 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.172 -0.432 25153 17014 1 19 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.607 -0.937 25153 17015 1 19 . 1 1 29 29 LEU N N 29 120.250 120.250 112.070 8.180 25153 17016 1 19 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.714 -0.078 25153 17017 1 19 . 1 1 29 29 LEU C C 29 175.770 175.770 175.586 0.184 25153 17018 1 19 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.034 0.766 25153 17019 1 19 . 1 1 29 29 LEU CB C 29 45.100 45.100 44.047 1.053 25153 17020 1 19 . 1 1 29 29 LEU H H 29 7.940 7.940 7.614 0.326 25153 17021 1 19 . 1 1 30 30 VAL N N 30 118.693 118.693 121.110 -2.417 25153 17022 1 19 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.850 -0.202 25153 17023 1 19 . 1 1 30 30 VAL C C 30 174.347 174.347 175.748 -1.401 25153 17024 1 19 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.542 -0.674 25153 17025 1 19 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.192 1.388 25153 17026 1 19 . 1 1 30 30 VAL H H 30 7.434 7.434 7.983 -0.549 25153 17027 1 19 . 1 1 31 31 THR N N 31 123.800 123.800 121.741 2.059 25153 17028 1 19 . 1 1 31 31 THR HA H 31 4.362 4.362 4.567 -0.205 25153 17029 1 19 . 1 1 31 31 THR C C 31 172.964 172.964 173.356 -0.392 25153 17030 1 19 . 1 1 31 31 THR CA C 31 61.720 61.720 61.003 0.717 25153 17031 1 19 . 1 1 31 31 THR CB C 31 70.485 70.485 70.819 -0.334 25153 17032 1 19 . 1 1 31 31 THR H H 31 7.844 7.844 8.239 -0.395 25153 17033 1 19 . 1 1 32 32 LEU N N 32 127.800 127.800 126.970 0.830 25153 17034 1 19 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.599 0.085 25153 17035 1 19 . 1 1 32 32 LEU C C 32 176.600 176.600 176.416 0.184 25153 17036 1 19 . 1 1 32 32 LEU CA C 32 55.155 55.155 55.152 0.003 25153 17037 1 19 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.647 1.203 25153 17038 1 19 . 1 1 32 32 LEU H H 32 8.660 8.660 8.579 0.081 25153 17039 1 19 . 1 1 33 33 HIS N N 33 119.670 119.670 119.946 -0.276 25153 17040 1 19 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.819 -0.419 25153 17041 1 19 . 1 1 33 33 HIS C C 33 171.667 171.667 173.312 -1.645 25153 17042 1 19 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.991 0.209 25153 17043 1 19 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.530 0.670 25153 17044 1 19 . 1 1 33 33 HIS H H 33 9.060 9.060 8.672 0.388 25153 17045 1 19 . 1 1 34 34 ASN N N 34 124.068 124.068 123.204 0.864 25153 17046 1 19 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.158 -0.724 25153 17047 1 19 . 1 1 34 34 ASN C C 34 178.000 178.000 175.940 2.060 25153 17048 1 19 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.966 -0.537 25153 17049 1 19 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.163 -0.603 25153 17050 1 19 . 1 1 34 34 ASN H H 34 8.780 8.780 8.518 0.262 25153 17051 1 19 . 1 1 35 35 LEU N N 35 129.040 129.040 126.528 2.512 25153 17052 1 19 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.183 0.132 25153 17053 1 19 . 1 1 35 35 LEU C C 35 177.700 177.700 177.861 -0.161 25153 17054 1 19 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.361 0.119 25153 17055 1 19 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.780 1.520 25153 17056 1 19 . 1 1 35 35 LEU H H 35 8.821 8.821 8.448 0.373 25153 17057 1 19 . 1 1 36 36 LYS N N 36 121.043 121.043 116.740 4.303 25153 17058 1 19 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.071 -0.191 25153 17059 1 19 . 1 1 36 36 LYS C C 36 176.230 176.230 177.009 -0.779 25153 17060 1 19 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.432 0.988 25153 17061 1 19 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.501 0.769 25153 17062 1 19 . 1 1 37 37 ASP N N 37 114.965 114.965 117.963 -2.998 25153 17063 1 19 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.791 -0.014 25153 17064 1 19 . 1 1 37 37 ASP C C 37 175.440 175.440 175.962 -0.522 25153 17065 1 19 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.465 0.246 25153 17066 1 19 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.532 1.168 25153 17067 1 19 . 1 1 38 38 ASP N N 38 121.650 121.650 121.772 -0.122 25153 17068 1 19 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.853 0.017 25153 17069 1 19 . 1 1 38 38 ASP C C 38 174.852 174.852 176.007 -1.155 25153 17070 1 19 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.776 -1.696 25153 17071 1 19 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.204 -0.094 25153 17072 1 19 . 1 1 39 39 SER N N 39 115.207 115.207 118.096 -2.889 25153 17073 1 19 . 1 1 39 39 SER HA H 39 4.585 4.585 4.699 -0.114 25153 17074 1 19 . 1 1 39 39 SER C C 39 175.040 175.040 174.316 0.724 25153 17075 1 19 . 1 1 39 39 SER CA C 39 54.960 54.960 56.328 -1.368 25153 17076 1 19 . 1 1 39 39 SER CB C 39 64.720 64.720 63.630 1.090 25153 17077 1 19 . 1 1 39 39 SER H H 39 8.351 8.351 8.589 -0.238 25153 17078 1 19 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.331 -0.326 25153 17079 1 19 . 1 1 40 40 PRO C C 40 176.730 176.730 177.789 -1.059 25153 17080 1 19 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.942 -0.042 25153 17081 1 19 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.741 -0.341 25153 17082 1 19 . 1 1 41 41 LYS N N 41 121.150 121.150 119.847 1.303 25153 17083 1 19 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.051 -0.139 25153 17084 1 19 . 1 1 41 41 LYS C C 41 179.600 179.600 178.646 0.954 25153 17085 1 19 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.128 -0.928 25153 17086 1 19 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.636 0.364 25153 17087 1 19 . 1 1 42 42 LEU N N 42 118.103 118.103 116.974 1.129 25153 17088 1 19 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.198 -0.161 25153 17089 1 19 . 1 1 42 42 LEU C C 42 178.760 178.760 178.925 -0.165 25153 17090 1 19 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.164 0.016 25153 17091 1 19 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.971 1.002 25153 17092 1 19 . 1 1 42 42 LEU H H 42 7.600 7.600 7.537 0.063 25153 17093 1 19 . 1 1 43 43 MET N N 43 118.917 118.917 118.545 0.372 25153 17094 1 19 . 1 1 43 43 MET HA H 43 3.750 3.750 4.306 -0.556 25153 17095 1 19 . 1 1 43 43 MET C C 43 177.680 177.680 177.079 0.601 25153 17096 1 19 . 1 1 43 43 MET CA C 43 59.730 59.730 58.105 1.625 25153 17097 1 19 . 1 1 43 43 MET CB C 43 32.700 32.700 32.016 0.684 25153 17098 1 19 . 1 1 43 43 MET H H 43 8.202 8.202 7.904 0.298 25153 17099 1 19 . 1 1 44 44 GLU N N 44 110.924 110.924 117.271 -6.347 25153 17100 1 19 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.319 -0.579 25153 17101 1 19 . 1 1 44 44 GLU C C 44 178.130 178.130 178.877 -0.747 25153 17102 1 19 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.479 0.921 25153 17103 1 19 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.947 -0.397 25153 17104 1 19 . 1 1 45 45 GLN N N 45 115.756 115.756 118.546 -2.790 25153 17105 1 19 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.032 0.151 25153 17106 1 19 . 1 1 45 45 GLN C C 45 175.414 175.414 177.156 -1.742 25153 17107 1 19 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.553 -1.373 25153 17108 1 19 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.115 -0.515 25153 17109 1 19 . 1 1 45 45 GLN H H 45 7.516 7.516 7.505 0.011 25153 17110 1 19 . 1 1 46 46 TYR N N 46 117.860 117.860 118.859 -0.999 25153 17111 1 19 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.362 0.301 25153 17112 1 19 . 1 1 46 46 TYR C C 46 175.500 175.500 177.152 -1.652 25153 17113 1 19 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.475 -0.989 25153 17114 1 19 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.125 3.345 25153 17115 1 19 . 1 1 46 46 TYR H H 46 6.996 6.996 7.209 -0.213 25153 17116 1 19 . 1 1 47 47 ASP N N 47 121.683 121.683 122.063 -0.380 25153 17117 1 19 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.616 0.084 25153 17118 1 19 . 1 1 47 47 ASP C C 47 175.610 175.610 175.183 0.427 25153 17119 1 19 . 1 1 47 47 ASP CA C 47 56.700 56.700 57.299 -0.599 25153 17120 1 19 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.917 1.083 25153 17121 1 19 . 1 1 48 48 VAL N N 48 118.628 118.628 116.098 2.530 25153 17122 1 19 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.826 0.208 25153 17123 1 19 . 1 1 48 48 VAL C C 48 174.190 174.190 174.044 0.146 25153 17124 1 19 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.322 -1.132 25153 17125 1 19 . 1 1 48 48 VAL CB C 48 36.100 36.100 36.163 -0.063 25153 17126 1 19 . 1 1 48 48 VAL H H 48 7.628 7.628 7.359 0.269 25153 17127 1 19 . 1 1 49 49 LEU N N 49 128.190 128.190 123.260 4.930 25153 17128 1 19 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.367 0.236 25153 17129 1 19 . 1 1 49 49 LEU C C 49 174.880 174.880 175.448 -0.568 25153 17130 1 19 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.866 -1.626 25153 17131 1 19 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.338 -0.998 25153 17132 1 19 . 1 1 49 49 LEU H H 49 9.407 9.407 8.965 0.442 25153 17133 1 19 . 1 1 50 50 ILE N N 50 124.550 124.550 120.976 3.574 25153 17134 1 19 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.078 0.622 25153 17135 1 19 . 1 1 50 50 ILE C C 50 175.300 175.300 174.580 0.720 25153 17136 1 19 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.899 -1.035 25153 17137 1 19 . 1 1 50 50 ILE CB C 50 40.250 40.250 41.035 -0.785 25153 17138 1 19 . 1 1 50 50 ILE H H 50 9.238 9.238 9.236 0.002 25153 17139 1 19 . 1 1 51 51 LEU N N 51 127.460 127.460 128.378 -0.918 25153 17140 1 19 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.816 0.369 25153 17141 1 19 . 1 1 51 51 LEU C C 51 174.544 174.544 175.865 -1.321 25153 17142 1 19 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.577 -0.757 25153 17143 1 19 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.166 -2.529 25153 17144 1 19 . 1 1 51 51 LEU H H 51 9.228 9.228 9.095 0.133 25153 17145 1 19 . 1 1 52 52 GLY N N 52 107.760 107.760 111.156 -3.396 25153 17146 1 19 . 1 1 52 52 GLY C C 52 174.710 174.710 172.379 2.331 25153 17147 1 19 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.902 -0.032 25153 17148 1 19 . 1 1 52 52 GLY H H 52 8.860 8.860 8.989 -0.129 25153 17149 1 19 . 1 1 53 53 ILE N N 53 123.890 123.890 120.199 3.691 25153 17150 1 19 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.840 0.430 25153 17151 1 19 . 1 1 53 53 ILE C C 53 172.630 172.630 172.851 -0.221 25153 17152 1 19 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.588 0.092 25153 17153 1 19 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.374 3.786 25153 17154 1 19 . 1 1 53 53 ILE H H 53 8.458 8.458 7.918 0.540 25153 17155 1 19 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.907 0.481 25153 17156 1 19 . 1 1 54 54 PRO C C 54 175.000 175.000 176.545 -1.545 25153 17157 1 19 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.737 -0.137 25153 17158 1 19 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.193 -0.893 25153 17159 1 19 . 1 1 55 55 THR N N 55 112.754 112.754 118.347 -5.593 25153 17160 1 19 . 1 1 55 55 THR HA H 55 4.452 4.452 4.661 -0.209 25153 17161 1 19 . 1 1 55 55 THR C C 55 172.480 172.480 174.101 -1.621 25153 17162 1 19 . 1 1 55 55 THR CA C 55 62.350 62.350 63.019 -0.669 25153 17163 1 19 . 1 1 55 55 THR CB C 55 70.230 70.230 70.030 0.200 25153 17164 1 19 . 1 1 55 55 THR H H 55 6.523 6.523 8.037 -1.514 25153 17165 1 19 . 1 1 56 56 TRP N N 56 130.044 130.044 126.653 3.391 25153 17166 1 19 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.666 -1.951 25153 17167 1 19 . 1 1 56 56 TRP C C 56 172.890 172.890 175.136 -2.246 25153 17168 1 19 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.742 -0.092 25153 17169 1 19 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.016 0.985 25153 17170 1 19 . 1 1 56 56 TRP H H 56 8.450 8.450 8.824 -0.374 25153 17171 1 19 . 1 1 57 57 ASP N N 57 115.275 115.275 120.128 -4.853 25153 17172 1 19 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.023 0.329 25153 17173 1 19 . 1 1 57 57 ASP C C 57 173.660 173.660 174.930 -1.270 25153 17174 1 19 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.209 1.021 25153 17175 1 19 . 1 1 57 57 ASP CB C 57 40.170 40.170 40.011 0.159 25153 17176 1 19 . 1 1 58 58 PHE N N 58 112.840 112.840 115.327 -2.487 25153 17177 1 19 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.694 -0.370 25153 17178 1 19 . 1 1 58 58 PHE C C 58 175.730 175.730 176.025 -0.295 25153 17179 1 19 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.750 1.073 25153 17180 1 19 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.920 -2.166 25153 17181 1 19 . 1 1 58 58 PHE H H 58 7.640 7.640 7.380 0.260 25153 17182 1 19 . 1 1 59 59 GLY N N 59 104.940 104.940 105.633 -0.693 25153 17183 1 19 . 1 1 59 59 GLY C C 59 173.750 173.750 174.931 -1.181 25153 17184 1 19 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.550 0.740 25153 17185 1 19 . 1 1 59 59 GLY H H 59 8.024 8.024 8.678 -0.654 25153 17186 1 19 . 1 1 60 60 GLU N N 60 120.045 120.045 119.387 0.658 25153 17187 1 19 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.461 -0.048 25153 17188 1 19 . 1 1 60 60 GLU C C 60 176.050 176.050 175.886 0.164 25153 17189 1 19 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.550 -0.930 25153 17190 1 19 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.044 -0.434 25153 17191 1 19 . 1 1 61 61 ILE N N 61 120.790 120.790 120.288 0.502 25153 17192 1 19 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.201 -0.734 25153 17193 1 19 . 1 1 61 61 ILE C C 61 175.130 175.130 176.005 -0.875 25153 17194 1 19 . 1 1 61 61 ILE CA C 61 61.547 61.547 60.851 0.696 25153 17195 1 19 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.343 -0.493 25153 17196 1 19 . 1 1 61 61 ILE H H 61 8.200 8.200 8.361 -0.161 25153 17197 1 19 . 1 1 62 62 GLN N N 62 124.520 124.520 123.741 0.779 25153 17198 1 19 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.059 -0.103 25153 17199 1 19 . 1 1 62 62 GLN C C 62 177.160 177.160 176.893 0.267 25153 17200 1 19 . 1 1 62 62 GLN CA C 62 57.610 57.610 55.695 1.915 25153 17201 1 19 . 1 1 62 62 GLN CB C 62 27.650 27.650 29.942 -2.292 25153 17202 1 19 . 1 1 62 62 GLN H H 62 5.667 5.667 8.883 -3.216 25153 17203 1 19 . 1 1 63 63 GLU N N 63 124.570 124.570 127.051 -2.481 25153 17204 1 19 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.143 -0.157 25153 17205 1 19 . 1 1 63 63 GLU C C 63 177.300 177.300 177.135 0.165 25153 17206 1 19 . 1 1 63 63 GLU CA C 63 60.720 60.720 59.337 1.383 25153 17207 1 19 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.230 0.890 25153 17208 1 19 . 1 1 64 64 ASP N N 64 119.060 119.060 119.516 -0.456 25153 17209 1 19 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.433 0.187 25153 17210 1 19 . 1 1 64 64 ASP C C 64 179.180 179.180 177.399 1.781 25153 17211 1 19 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.601 1.349 25153 17212 1 19 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.250 0.700 25153 17213 1 19 . 1 1 65 65 TRP N N 65 121.070 121.070 120.933 0.137 25153 17214 1 19 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.506 -0.166 25153 17215 1 19 . 1 1 65 65 TRP C C 65 178.970 178.970 178.067 0.903 25153 17216 1 19 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.694 0.126 25153 17217 1 19 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.508 -0.108 25153 17218 1 19 . 1 1 65 65 TRP H H 65 7.350 7.350 8.059 -0.709 25153 17219 1 19 . 1 1 66 66 GLU N N 66 120.900 120.900 119.035 1.865 25153 17220 1 19 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.869 -0.029 25153 17221 1 19 . 1 1 66 66 GLU C C 66 178.750 178.750 179.119 -0.369 25153 17222 1 19 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.481 0.519 25153 17223 1 19 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.274 -0.414 25153 17224 1 19 . 1 1 67 67 ALA N N 67 119.130 119.130 119.951 -0.821 25153 17225 1 19 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.234 0.019 25153 17226 1 19 . 1 1 67 67 ALA C C 67 179.410 179.410 179.093 0.317 25153 17227 1 19 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.748 -0.168 25153 17228 1 19 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.848 -0.038 25153 17229 1 19 . 1 1 67 67 ALA H H 67 7.640 7.640 8.167 -0.527 25153 17230 1 19 . 1 1 68 68 VAL N N 68 106.845 106.845 111.304 -4.459 25153 17231 1 19 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.482 0.328 25153 17232 1 19 . 1 1 68 68 VAL C C 68 176.750 176.750 177.247 -0.497 25153 17233 1 19 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.524 -2.914 25153 17234 1 19 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.619 0.001 25153 17235 1 19 . 1 1 68 68 VAL H H 68 7.219 7.219 7.537 -0.318 25153 17236 1 19 . 1 1 69 69 TRP N N 69 127.630 127.630 124.406 3.224 25153 17237 1 19 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.268 -0.030 25153 17238 1 19 . 1 1 69 69 TRP C C 69 178.670 178.670 177.119 1.551 25153 17239 1 19 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.744 -1.524 25153 17240 1 19 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.859 1.771 25153 17241 1 19 . 1 1 69 69 TRP H H 69 7.832 7.832 8.618 -0.786 25153 17242 1 19 . 1 1 70 70 ASP N N 70 114.544 114.544 118.562 -4.018 25153 17243 1 19 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.436 0.086 25153 17244 1 19 . 1 1 70 70 ASP C C 70 178.670 178.670 178.963 -0.293 25153 17245 1 19 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.384 -1.384 25153 17246 1 19 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.914 -1.064 25153 17247 1 19 . 1 1 71 71 GLN N N 71 120.040 120.040 119.425 0.615 25153 17248 1 19 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.105 0.079 25153 17249 1 19 . 1 1 71 71 GLN C C 71 178.910 178.910 178.829 0.081 25153 17250 1 19 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.339 -0.729 25153 17251 1 19 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.802 0.298 25153 17252 1 19 . 1 1 71 71 GLN H H 71 7.995 7.995 7.705 0.290 25153 17253 1 19 . 1 1 72 72 LEU N N 72 117.400 117.400 119.258 -1.858 25153 17254 1 19 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.944 -0.131 25153 17255 1 19 . 1 1 72 72 LEU C C 72 178.650 178.650 178.667 -0.017 25153 17256 1 19 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.423 -0.223 25153 17257 1 19 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.221 0.189 25153 17258 1 19 . 1 1 72 72 LEU H H 72 7.450 7.450 7.901 -0.451 25153 17259 1 19 . 1 1 73 73 ASP N N 73 115.750 115.750 118.568 -2.818 25153 17260 1 19 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.357 -0.189 25153 17261 1 19 . 1 1 73 73 ASP C C 73 177.560 177.560 177.229 0.331 25153 17262 1 19 . 1 1 73 73 ASP CA C 73 57.400 57.400 57.020 0.380 25153 17263 1 19 . 1 1 73 73 ASP CB C 73 40.100 40.100 40.985 -0.885 25153 17264 1 19 . 1 1 74 74 ASP N N 74 117.223 117.223 118.683 -1.460 25153 17265 1 19 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.643 0.060 25153 17266 1 19 . 1 1 74 74 ASP C C 74 176.388 176.388 176.882 -0.494 25153 17267 1 19 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.384 0.116 25153 17268 1 19 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.509 0.191 25153 17269 1 19 . 1 1 75 75 LEU N N 75 118.316 118.316 118.602 -0.286 25153 17270 1 19 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.453 -0.168 25153 17271 1 19 . 1 1 75 75 LEU C C 75 176.820 176.820 175.850 0.970 25153 17272 1 19 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.459 -0.059 25153 17273 1 19 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.824 0.456 25153 17274 1 19 . 1 1 75 75 LEU H H 75 6.960 6.960 7.201 -0.241 25153 17275 1 19 . 1 1 76 76 ASN N N 76 123.045 123.045 117.360 5.685 25153 17276 1 19 . 1 1 76 76 ASN HA H 76 4.890 4.890 5.097 -0.207 25153 17277 1 19 . 1 1 76 76 ASN C C 76 174.950 174.950 175.030 -0.080 25153 17278 1 19 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.022 0.028 25153 17279 1 19 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.851 -1.351 25153 17280 1 19 . 1 1 76 76 ASN H H 76 9.890 9.890 8.811 1.079 25153 17281 1 19 . 1 1 77 77 LEU N N 77 123.494 123.494 122.861 0.633 25153 17282 1 19 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.560 -0.190 25153 17283 1 19 . 1 1 77 77 LEU C C 77 175.040 175.040 176.244 -1.204 25153 17284 1 19 . 1 1 77 77 LEU CA C 77 52.250 52.250 54.016 -1.766 25153 17285 1 19 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.524 0.376 25153 17286 1 19 . 1 1 77 77 LEU H H 77 8.730 8.730 8.445 0.285 25153 17287 1 19 . 1 1 78 78 GLU N N 78 120.870 120.870 121.926 -1.056 25153 17288 1 19 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.514 -0.614 25153 17289 1 19 . 1 1 78 78 GLU C C 78 178.660 178.660 177.864 0.796 25153 17290 1 19 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.398 1.362 25153 17291 1 19 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.257 1.143 25153 17292 1 19 . 1 1 79 79 GLY N N 79 113.240 113.240 113.429 -0.189 25153 17293 1 19 . 1 1 79 79 GLY C C 79 174.460 174.460 174.565 -0.105 25153 17294 1 19 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.004 0.426 25153 17295 1 19 . 1 1 79 79 GLY H H 79 8.474 8.474 8.766 -0.292 25153 17296 1 19 . 1 1 80 80 LYS N N 80 120.295 120.295 121.395 -1.100 25153 17297 1 19 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.493 -0.135 25153 17298 1 19 . 1 1 80 80 LYS C C 80 175.360 175.360 175.951 -0.591 25153 17299 1 19 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.569 0.401 25153 17300 1 19 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.785 -0.585 25153 17301 1 19 . 1 1 81 81 ILE N N 81 122.400 122.400 121.136 1.264 25153 17302 1 19 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.706 0.087 25153 17303 1 19 . 1 1 81 81 ILE C C 81 174.760 174.760 175.478 -0.718 25153 17304 1 19 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.386 -1.556 25153 17305 1 19 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.958 -0.258 25153 17306 1 19 . 1 1 81 81 ILE H H 81 7.400 7.400 7.757 -0.357 25153 17307 1 19 . 1 1 82 82 VAL N N 82 127.840 127.840 125.993 1.847 25153 17308 1 19 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.004 0.258 25153 17309 1 19 . 1 1 82 82 VAL C C 82 172.724 172.724 174.273 -1.549 25153 17310 1 19 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.462 -0.052 25153 17311 1 19 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.567 -0.167 25153 17312 1 19 . 1 1 82 82 VAL H H 82 8.790 8.790 8.716 0.074 25153 17313 1 19 . 1 1 83 83 ALA N N 83 131.347 131.347 129.493 1.854 25153 17314 1 19 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.298 0.084 25153 17315 1 19 . 1 1 83 83 ALA C C 83 175.750 175.750 176.264 -0.514 25153 17316 1 19 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.046 -0.176 25153 17317 1 19 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.869 2.581 25153 17318 1 19 . 1 1 83 83 ALA H H 83 9.300 9.300 8.927 0.373 25153 17319 1 19 . 1 1 84 84 LEU N N 84 124.200 124.200 126.440 -2.240 25153 17320 1 19 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.660 -0.140 25153 17321 1 19 . 1 1 84 84 LEU C C 84 175.760 175.760 176.785 -1.025 25153 17322 1 19 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.767 -0.267 25153 17323 1 19 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.420 1.480 25153 17324 1 19 . 1 1 84 84 LEU H H 84 10.287 10.287 8.964 1.323 25153 17325 1 19 . 1 1 85 85 TYR N N 85 115.912 115.912 118.750 -2.838 25153 17326 1 19 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.289 -0.329 25153 17327 1 19 . 1 1 85 85 TYR C C 85 172.372 172.372 173.765 -1.393 25153 17328 1 19 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.175 0.925 25153 17329 1 19 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.433 1.597 25153 17330 1 19 . 1 1 85 85 TYR H H 85 9.257 9.257 8.665 0.592 25153 17331 1 19 . 1 1 86 86 GLY N N 86 107.800 107.800 105.656 2.144 25153 17332 1 19 . 1 1 86 86 GLY C C 86 170.330 170.330 171.497 -1.167 25153 17333 1 19 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.834 -0.464 25153 17334 1 19 . 1 1 86 86 GLY H H 86 9.027 9.027 8.650 0.377 25153 17335 1 19 . 1 1 87 87 LEU N N 87 123.458 123.458 118.335 5.123 25153 17336 1 19 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.360 0.105 25153 17337 1 19 . 1 1 87 87 LEU C C 87 178.100 178.100 175.963 2.137 25153 17338 1 19 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.749 0.841 25153 17339 1 19 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.423 -0.083 25153 17340 1 19 . 1 1 87 87 LEU H H 87 6.580 6.580 7.683 -1.103 25153 17341 1 19 . 1 1 88 88 GLY N N 88 108.966 108.966 107.034 1.932 25153 17342 1 19 . 1 1 88 88 GLY C C 88 172.820 172.820 171.350 1.470 25153 17343 1 19 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.753 0.907 25153 17344 1 19 . 1 1 88 88 GLY H H 88 8.070 8.070 8.256 -0.186 25153 17345 1 19 . 1 1 89 89 ASP N N 89 121.150 121.150 117.421 3.729 25153 17346 1 19 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.171 0.075 25153 17347 1 19 . 1 1 89 89 ASP C C 89 176.220 176.220 176.269 -0.049 25153 17348 1 19 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.831 -0.361 25153 17349 1 19 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.477 -0.997 25153 17350 1 19 . 1 1 90 90 GLN N N 90 123.970 123.970 122.278 1.692 25153 17351 1 19 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.257 -0.769 25153 17352 1 19 . 1 1 90 90 GLN C C 90 173.646 173.646 176.214 -2.568 25153 17353 1 19 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.615 0.695 25153 17354 1 19 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.772 -0.562 25153 17355 1 19 . 1 1 90 90 GLN H H 90 8.623 8.623 8.781 -0.158 25153 17356 1 19 . 1 1 91 91 LEU N N 91 118.017 118.017 119.909 -1.892 25153 17357 1 19 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.162 0.213 25153 17358 1 19 . 1 1 91 91 LEU C C 91 180.160 180.160 178.882 1.278 25153 17359 1 19 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.387 -0.327 25153 17360 1 19 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.098 -0.548 25153 17361 1 19 . 1 1 91 91 LEU H H 91 7.046 7.046 8.792 -1.746 25153 17362 1 19 . 1 1 92 92 GLY N N 92 110.028 110.028 104.383 5.645 25153 17363 1 19 . 1 1 92 92 GLY C C 92 174.912 174.912 173.948 0.964 25153 17364 1 19 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.849 0.331 25153 17365 1 19 . 1 1 92 92 GLY H H 92 9.238 9.238 8.714 0.524 25153 17366 1 19 . 1 1 93 93 TYR N N 93 115.910 115.910 119.293 -3.383 25153 17367 1 19 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.268 -0.259 25153 17368 1 19 . 1 1 93 93 TYR C C 93 176.850 176.850 178.120 -1.270 25153 17369 1 19 . 1 1 93 93 TYR CA C 93 56.730 56.730 58.487 -1.757 25153 17370 1 19 . 1 1 93 93 TYR CB C 93 38.130 38.130 40.103 -1.974 25153 17371 1 19 . 1 1 93 93 TYR H H 93 6.962 6.962 7.548 -0.586 25153 17372 1 19 . 1 1 94 94 GLY N N 94 111.630 111.630 107.014 4.616 25153 17373 1 19 . 1 1 94 94 GLY C C 94 177.777 177.777 175.895 1.882 25153 17374 1 19 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.116 2.914 25153 17375 1 19 . 1 1 94 94 GLY H H 94 7.835 7.835 8.616 -0.781 25153 17376 1 19 . 1 1 95 95 GLU N N 95 122.450 122.450 121.981 0.469 25153 17377 1 19 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.999 -0.081 25153 17378 1 19 . 1 1 95 95 GLU C C 95 175.300 175.300 176.459 -1.159 25153 17379 1 19 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.605 -0.505 25153 17380 1 19 . 1 1 95 95 GLU CB C 95 27.511 27.511 29.123 -1.612 25153 17381 1 19 . 1 1 96 96 TRP N N 96 118.790 118.790 113.769 5.021 25153 17382 1 19 . 1 1 96 96 TRP HA H 96 5.444 5.444 5.011 0.433 25153 17383 1 19 . 1 1 96 96 TRP C C 96 179.280 179.280 175.727 3.553 25153 17384 1 19 . 1 1 96 96 TRP CA C 96 57.015 57.015 55.769 1.246 25153 17385 1 19 . 1 1 96 96 TRP CB C 96 30.020 30.020 29.850 0.170 25153 17386 1 19 . 1 1 96 96 TRP H H 96 8.070 8.070 8.249 -0.179 25153 17387 1 19 . 1 1 97 97 PHE N N 97 128.067 128.067 123.413 4.654 25153 17388 1 19 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.233 1.072 25153 17389 1 19 . 1 1 97 97 PHE C C 97 173.227 173.227 175.775 -2.548 25153 17390 1 19 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.745 -3.025 25153 17391 1 19 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.318 0.622 25153 17392 1 19 . 1 1 97 97 PHE H H 97 7.165 7.165 7.747 -0.582 25153 17393 1 19 . 1 1 98 98 LEU N N 98 114.306 114.306 122.435 -8.129 25153 17394 1 19 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.641 -0.151 25153 17395 1 19 . 1 1 98 98 LEU C C 98 179.365 179.365 177.303 2.062 25153 17396 1 19 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.393 0.067 25153 17397 1 19 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.830 -0.600 25153 17398 1 19 . 1 1 98 98 LEU H H 98 7.453 7.453 8.377 -0.924 25153 17399 1 19 . 1 1 99 99 ASP N N 99 122.354 122.354 120.653 1.701 25153 17400 1 19 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.344 -0.411 25153 17401 1 19 . 1 1 99 99 ASP C C 99 178.800 178.800 177.235 1.565 25153 17402 1 19 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.550 1.630 25153 17403 1 19 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.340 -0.910 25153 17404 1 19 . 1 1 100 100 ALA N N 100 118.568 118.568 121.569 -3.001 25153 17405 1 19 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.069 -0.229 25153 17406 1 19 . 1 1 100 100 ALA C C 100 178.500 178.500 178.979 -0.479 25153 17407 1 19 . 1 1 100 100 ALA CA C 100 54.916 54.916 54.947 -0.031 25153 17408 1 19 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.574 1.086 25153 17409 1 19 . 1 1 100 100 ALA H H 100 8.682 8.682 7.891 0.791 25153 17410 1 19 . 1 1 101 101 LEU N N 101 118.815 118.815 120.674 -1.859 25153 17411 1 19 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.972 -0.292 25153 17412 1 19 . 1 1 101 101 LEU C C 101 178.930 178.930 178.801 0.129 25153 17413 1 19 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.766 -0.066 25153 17414 1 19 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.549 0.851 25153 17415 1 19 . 1 1 101 101 LEU H H 101 6.637 6.637 7.550 -0.913 25153 17416 1 19 . 1 1 102 102 GLY N N 102 103.700 103.700 106.359 -2.659 25153 17417 1 19 . 1 1 102 102 GLY C C 102 175.530 175.530 176.102 -0.572 25153 17418 1 19 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.294 0.706 25153 17419 1 19 . 1 1 102 102 GLY H H 102 7.330 7.330 7.912 -0.582 25153 17420 1 19 . 1 1 103 103 MET N N 103 120.330 120.330 121.578 -1.248 25153 17421 1 19 . 1 1 103 103 MET HA H 103 4.254 4.254 4.258 -0.004 25153 17422 1 19 . 1 1 103 103 MET C C 103 179.688 179.688 178.614 1.074 25153 17423 1 19 . 1 1 103 103 MET CA C 103 59.615 59.615 59.527 0.088 25153 17424 1 19 . 1 1 103 103 MET CB C 103 33.290 33.290 32.609 0.681 25153 17425 1 19 . 1 1 103 103 MET H H 103 8.407 8.407 7.829 0.578 25153 17426 1 19 . 1 1 104 104 LEU N N 104 123.450 123.450 120.007 3.443 25153 17427 1 19 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.671 0.525 25153 17428 1 19 . 1 1 104 104 LEU C C 104 177.620 177.620 178.697 -1.077 25153 17429 1 19 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.996 -0.026 25153 17430 1 19 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.267 0.032 25153 17431 1 19 . 1 1 104 104 LEU H H 104 8.330 8.330 8.638 -0.308 25153 17432 1 19 . 1 1 105 105 HIS N N 105 119.040 119.040 119.112 -0.072 25153 17433 1 19 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.034 -0.157 25153 17434 1 19 . 1 1 105 105 HIS C C 105 177.100 177.100 177.027 0.073 25153 17435 1 19 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.769 0.201 25153 17436 1 19 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.817 -1.224 25153 17437 1 19 . 1 1 105 105 HIS H H 105 8.050 8.050 8.376 -0.326 25153 17438 1 19 . 1 1 106 106 ASP N N 106 119.950 119.950 119.212 0.738 25153 17439 1 19 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.432 -0.102 25153 17440 1 19 . 1 1 106 106 ASP C C 106 179.300 179.300 178.642 0.658 25153 17441 1 19 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.301 0.509 25153 17442 1 19 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.013 -0.613 25153 17443 1 19 . 1 1 107 107 LYS N N 107 122.060 122.060 119.237 2.823 25153 17444 1 19 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.026 0.107 25153 17445 1 19 . 1 1 107 107 LYS C C 107 178.100 178.100 179.587 -1.487 25153 17446 1 19 . 1 1 107 107 LYS CA C 107 58.200 58.200 59.017 -0.817 25153 17447 1 19 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.283 0.077 25153 17448 1 19 . 1 1 108 108 LEU N N 108 115.610 115.610 118.198 -2.588 25153 17449 1 19 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.122 -0.054 25153 17450 1 19 . 1 1 108 108 LEU C C 108 178.866 178.866 178.372 0.494 25153 17451 1 19 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.834 -0.880 25153 17452 1 19 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.326 0.834 25153 17453 1 19 . 1 1 108 108 LEU H H 108 7.828 7.828 8.549 -0.721 25153 17454 1 19 . 1 1 109 109 SER N N 109 116.362 116.362 114.944 1.418 25153 17455 1 19 . 1 1 109 109 SER HA H 109 4.299 4.299 4.297 0.002 25153 17456 1 19 . 1 1 109 109 SER C C 109 175.660 175.660 176.936 -1.276 25153 17457 1 19 . 1 1 109 109 SER CA C 109 62.350 62.350 61.429 0.921 25153 17458 1 19 . 1 1 109 109 SER CB C 109 62.815 62.815 63.126 -0.311 25153 17459 1 19 . 1 1 109 109 SER H H 109 8.278 8.278 8.632 -0.354 25153 17460 1 19 . 1 1 110 110 THR N N 110 110.230 110.230 116.956 -6.726 25153 17461 1 19 . 1 1 110 110 THR HA H 110 4.615 4.615 4.201 0.414 25153 17462 1 19 . 1 1 110 110 THR C C 110 175.990 175.990 175.762 0.228 25153 17463 1 19 . 1 1 110 110 THR CA C 110 62.090 62.090 64.493 -2.403 25153 17464 1 19 . 1 1 110 110 THR CB C 110 68.800 68.800 68.942 -0.142 25153 17465 1 19 . 1 1 110 110 THR H H 110 7.211 7.211 7.910 -0.699 25153 17466 1 19 . 1 1 111 111 LYS N N 111 119.900 119.900 118.686 1.214 25153 17467 1 19 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.354 0.158 25153 17468 1 19 . 1 1 111 111 LYS C C 111 176.916 176.916 176.693 0.223 25153 17469 1 19 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.272 0.382 25153 17470 1 19 . 1 1 111 111 LYS CB C 111 30.843 30.843 31.548 -0.705 25153 17471 1 19 . 1 1 112 112 GLY N N 112 107.910 107.910 107.793 0.117 25153 17472 1 19 . 1 1 112 112 GLY C C 112 176.250 176.250 174.260 1.990 25153 17473 1 19 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.646 1.394 25153 17474 1 19 . 1 1 112 112 GLY H H 112 8.366 8.366 7.602 0.764 25153 17475 1 19 . 1 1 113 113 VAL N N 113 113.530 113.530 114.479 -0.949 25153 17476 1 19 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.495 -0.021 25153 17477 1 19 . 1 1 113 113 VAL C C 113 174.630 174.630 174.812 -0.182 25153 17478 1 19 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.860 -1.410 25153 17479 1 19 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.743 -0.193 25153 17480 1 19 . 1 1 113 113 VAL H H 113 6.903 6.903 7.094 -0.191 25153 17481 1 19 . 1 1 114 114 LYS N N 114 123.020 123.020 118.885 4.135 25153 17482 1 19 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.547 -0.042 25153 17483 1 19 . 1 1 114 114 LYS C C 114 175.000 175.000 174.454 0.546 25153 17484 1 19 . 1 1 114 114 LYS CA C 114 54.200 54.200 53.995 0.205 25153 17485 1 19 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.961 -1.621 25153 17486 1 19 . 1 1 115 115 PHE N N 115 123.290 123.290 119.719 3.571 25153 17487 1 19 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.631 0.082 25153 17488 1 19 . 1 1 115 115 PHE C C 115 177.605 177.605 176.320 1.285 25153 17489 1 19 . 1 1 115 115 PHE CA C 115 58.610 58.610 57.225 1.385 25153 17490 1 19 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.827 -0.827 25153 17491 1 19 . 1 1 115 115 PHE H H 115 8.494 8.494 8.708 -0.214 25153 17492 1 19 . 1 1 116 116 VAL N N 116 115.790 115.790 115.185 0.605 25153 17493 1 19 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.340 0.152 25153 17494 1 19 . 1 1 116 116 VAL C C 116 175.414 175.414 175.897 -0.483 25153 17495 1 19 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.640 -0.654 25153 17496 1 19 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.442 -0.342 25153 17497 1 19 . 1 1 116 116 VAL H H 116 8.889 8.889 8.520 0.369 25153 17498 1 19 . 1 1 117 117 GLY N N 117 108.300 108.300 107.272 1.028 25153 17499 1 19 . 1 1 117 117 GLY C C 117 176.180 176.180 174.616 1.564 25153 17500 1 19 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.397 2.403 25153 17501 1 19 . 1 1 117 117 GLY H H 117 9.810 9.810 8.573 1.237 25153 17502 1 19 . 1 1 118 118 TYR N N 118 120.050 120.050 119.601 0.449 25153 17503 1 19 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.656 0.298 25153 17504 1 19 . 1 1 118 118 TYR C C 118 177.450 177.450 175.849 1.601 25153 17505 1 19 . 1 1 118 118 TYR CA C 118 56.240 56.240 59.373 -3.133 25153 17506 1 19 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.323 -3.213 25153 17507 1 19 . 1 1 118 118 TYR H H 118 8.592 8.592 7.445 1.147 25153 17508 1 19 . 1 1 119 119 TRP N N 119 125.500 125.500 120.533 4.967 25153 17509 1 19 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.159 0.869 25153 17510 1 19 . 1 1 119 119 TRP C C 119 173.090 173.090 174.029 -0.939 25153 17511 1 19 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.442 -0.542 25153 17512 1 19 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.597 2.653 25153 17513 1 19 . 1 1 119 119 TRP H H 119 7.926 7.926 8.183 -0.257 25153 17514 1 19 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.790 0.020 25153 17515 1 19 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.683 0.997 25153 17516 1 19 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.774 -0.524 25153 17517 1 19 . 1 1 121 121 THR N N 121 109.114 109.114 110.820 -1.706 25153 17518 1 19 . 1 1 121 121 THR HA H 121 4.142 4.142 3.388 0.754 25153 17519 1 19 . 1 1 121 121 THR C C 121 176.300 176.300 175.427 0.873 25153 17520 1 19 . 1 1 121 121 THR CA C 121 61.230 61.230 63.315 -2.085 25153 17521 1 19 . 1 1 121 121 THR CB C 121 69.890 69.890 68.450 1.440 25153 17522 1 19 . 1 1 121 121 THR H H 121 7.356 7.356 8.402 -1.046 25153 17523 1 19 . 1 1 122 122 GLU N N 122 123.980 123.980 122.382 1.598 25153 17524 1 19 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.056 0.182 25153 17525 1 19 . 1 1 122 122 GLU C C 122 177.830 177.830 177.658 0.172 25153 17526 1 19 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.928 0.301 25153 17527 1 19 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.462 0.308 25153 17528 1 19 . 1 1 123 123 GLY N N 123 114.570 114.570 112.219 2.351 25153 17529 1 19 . 1 1 123 123 GLY C C 123 173.700 173.700 174.288 -0.588 25153 17530 1 19 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.343 0.057 25153 17531 1 19 . 1 1 123 123 GLY H H 123 9.181 9.181 8.791 0.390 25153 17532 1 19 . 1 1 124 124 TYR N N 124 118.923 118.923 120.356 -1.433 25153 17533 1 19 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.644 0.666 25153 17534 1 19 . 1 1 124 124 TYR C C 124 175.680 175.680 175.553 0.127 25153 17535 1 19 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.903 -2.433 25153 17536 1 19 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.297 0.703 25153 17537 1 19 . 1 1 124 124 TYR H H 124 7.877 7.877 7.687 0.190 25153 17538 1 19 . 1 1 125 125 GLU N N 125 124.890 124.890 120.865 4.025 25153 17539 1 19 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.634 0.066 25153 17540 1 19 . 1 1 125 125 GLU C C 125 172.880 172.880 175.448 -2.568 25153 17541 1 19 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.890 -0.460 25153 17542 1 19 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.668 -0.248 25153 17543 1 19 . 1 1 126 126 PHE N N 126 119.166 119.166 120.656 -1.490 25153 17544 1 19 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.495 0.314 25153 17545 1 19 . 1 1 126 126 PHE C C 126 173.750 173.750 175.161 -1.411 25153 17546 1 19 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.285 -1.495 25153 17547 1 19 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.212 0.838 25153 17548 1 19 . 1 1 126 126 PHE H H 126 7.716 7.716 8.031 -0.315 25153 17549 1 19 . 1 1 127 127 THR N N 127 106.800 106.800 115.159 -8.359 25153 17550 1 19 . 1 1 127 127 THR HA H 127 4.400 4.400 3.337 1.063 25153 17551 1 19 . 1 1 127 127 THR C C 127 175.300 175.300 173.829 1.471 25153 17552 1 19 . 1 1 127 127 THR CA C 127 61.100 61.100 63.109 -2.009 25153 17553 1 19 . 1 1 127 127 THR CB C 127 70.600 70.600 68.168 2.432 25153 17554 1 19 . 1 1 127 127 THR H H 127 7.220 7.220 6.670 0.550 25153 17555 1 19 . 1 1 128 128 SER N N 128 118.360 118.360 115.096 3.264 25153 17556 1 19 . 1 1 128 128 SER HA H 128 4.680 4.680 4.653 0.027 25153 17557 1 19 . 1 1 128 128 SER C C 128 175.720 175.720 173.844 1.876 25153 17558 1 19 . 1 1 128 128 SER CA C 128 56.250 56.250 56.665 -0.415 25153 17559 1 19 . 1 1 128 128 SER CB C 128 65.635 65.635 64.558 1.077 25153 17560 1 19 . 1 1 128 128 SER H H 128 7.411 7.411 8.011 -0.600 25153 17561 1 19 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.635 0.140 25153 17562 1 19 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.222 -1.722 25153 17563 1 19 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.455 -0.055 25153 17564 1 19 . 1 1 130 130 LYS N N 130 122.014 122.014 120.331 1.683 25153 17565 1 19 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.306 -0.073 25153 17566 1 19 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.815 2.885 25153 17567 1 19 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.961 -0.391 25153 17568 1 19 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.558 -0.040 25153 17569 1 19 . 1 1 131 131 PRO C C 131 174.000 174.000 175.193 -1.193 25153 17570 1 19 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.371 2.329 25153 17571 1 19 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.311 0.889 25153 17572 1 19 . 1 1 132 132 VAL N N 132 113.260 113.260 117.033 -3.773 25153 17573 1 19 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.952 0.248 25153 17574 1 19 . 1 1 132 132 VAL C C 132 175.210 175.210 174.961 0.249 25153 17575 1 19 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.002 -0.382 25153 17576 1 19 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.958 -0.978 25153 17577 1 19 . 1 1 132 132 VAL H H 132 6.697 6.697 7.626 -0.929 25153 17578 1 19 . 1 1 133 133 ILE N N 133 119.940 119.940 117.231 2.709 25153 17579 1 19 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.559 -0.179 25153 17580 1 19 . 1 1 133 133 ILE C C 133 175.440 175.440 175.219 0.221 25153 17581 1 19 . 1 1 133 133 ILE CA C 133 60.450 60.450 59.028 1.422 25153 17582 1 19 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.130 1.970 25153 17583 1 19 . 1 1 133 133 ILE H H 133 8.756 8.756 8.775 -0.019 25153 17584 1 19 . 1 1 134 134 ALA N N 134 122.632 122.632 123.883 -1.251 25153 17585 1 19 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.879 0.081 25153 17586 1 19 . 1 1 134 134 ALA C C 134 178.312 178.312 177.202 1.110 25153 17587 1 19 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.575 -1.495 25153 17588 1 19 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.215 -0.379 25153 17589 1 19 . 1 1 134 134 ALA H H 134 8.523 8.523 8.486 0.037 25153 17590 1 19 . 1 1 135 135 ASP N N 135 117.366 117.366 122.752 -5.386 25153 17591 1 19 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.662 -0.410 25153 17592 1 19 . 1 1 135 135 ASP C C 135 176.387 176.387 176.640 -0.253 25153 17593 1 19 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.348 1.862 25153 17594 1 19 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.240 -1.540 25153 17595 1 19 . 1 1 136 136 GLY N N 136 104.310 104.310 108.071 -3.761 25153 17596 1 19 . 1 1 136 136 GLY C C 136 174.922 174.922 174.913 0.009 25153 17597 1 19 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.395 -0.295 25153 17598 1 19 . 1 1 136 136 GLY H H 136 7.610 7.610 8.309 -0.699 25153 17599 1 19 . 1 1 137 137 GLN N N 137 118.784 118.784 117.630 1.154 25153 17600 1 19 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.414 -0.359 25153 17601 1 19 . 1 1 137 137 GLN C C 137 176.390 176.390 175.441 0.949 25153 17602 1 19 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.847 1.793 25153 17603 1 19 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.230 0.000 25153 17604 1 19 . 1 1 137 137 GLN H H 137 7.870 7.870 7.850 0.020 25153 17605 1 19 . 1 1 138 138 LEU N N 138 118.040 118.040 115.950 2.090 25153 17606 1 19 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.022 -0.035 25153 17607 1 19 . 1 1 138 138 LEU C C 138 175.913 175.913 175.218 0.695 25153 17608 1 19 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.240 0.359 25153 17609 1 19 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.867 1.532 25153 17610 1 19 . 1 1 138 138 LEU H H 138 7.356 7.356 7.219 0.137 25153 17611 1 19 . 1 1 139 139 PHE N N 139 119.060 119.060 119.119 -0.059 25153 17612 1 19 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.978 0.332 25153 17613 1 19 . 1 1 139 139 PHE C C 139 178.780 178.780 178.145 0.635 25153 17614 1 19 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.451 -0.601 25153 17615 1 19 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.631 3.829 25153 17616 1 19 . 1 1 139 139 PHE H H 139 10.094 10.094 8.912 1.182 25153 17617 1 19 . 1 1 140 140 VAL N N 140 109.690 109.690 116.107 -6.417 25153 17618 1 19 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.799 -0.318 25153 17619 1 19 . 1 1 140 140 VAL C C 140 172.790 172.790 175.539 -2.749 25153 17620 1 19 . 1 1 140 140 VAL CA C 140 62.000 62.000 64.130 -2.130 25153 17621 1 19 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.520 -0.970 25153 17622 1 19 . 1 1 140 140 VAL H H 140 7.470 7.470 8.187 -0.717 25153 17623 1 19 . 1 1 141 141 GLY N N 141 107.060 107.060 105.183 1.877 25153 17624 1 19 . 1 1 141 141 GLY C C 141 171.513 171.513 172.548 -1.035 25153 17625 1 19 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.282 1.148 25153 17626 1 19 . 1 1 141 141 GLY H H 141 7.137 7.137 7.324 -0.187 25153 17627 1 19 . 1 1 142 142 LEU N N 142 117.863 117.863 120.285 -2.422 25153 17628 1 19 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.196 -1.221 25153 17629 1 19 . 1 1 142 142 LEU C C 142 173.640 173.640 175.135 -1.495 25153 17630 1 19 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.716 1.204 25153 17631 1 19 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.413 -4.863 25153 17632 1 19 . 1 1 142 142 LEU H H 142 7.517 7.517 7.558 -0.041 25153 17633 1 19 . 1 1 143 143 ALA N N 143 126.990 126.990 129.200 -2.210 25153 17634 1 19 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.610 -0.333 25153 17635 1 19 . 1 1 143 143 ALA C C 143 175.730 175.730 175.936 -0.206 25153 17636 1 19 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.254 -0.814 25153 17637 1 19 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.446 3.864 25153 17638 1 19 . 1 1 143 143 ALA H H 143 5.186 5.186 8.239 -3.053 25153 17639 1 19 . 1 1 144 144 LEU N N 144 125.477 125.477 124.928 0.549 25153 17640 1 19 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.731 0.049 25153 17641 1 19 . 1 1 144 144 LEU C C 144 174.473 174.473 175.180 -0.707 25153 17642 1 19 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.592 -0.352 25153 17643 1 19 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.316 -0.016 25153 17644 1 19 . 1 1 144 144 LEU H H 144 8.758 8.758 8.275 0.483 25153 17645 1 19 . 1 1 145 145 ASP N N 145 118.915 118.915 119.007 -0.092 25153 17646 1 19 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.223 0.309 25153 17647 1 19 . 1 1 145 145 ASP C C 145 176.470 176.470 175.968 0.502 25153 17648 1 19 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.262 -0.632 25153 17649 1 19 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.421 -1.421 25153 17650 1 19 . 1 1 146 146 GLU N N 146 124.813 124.813 123.476 1.337 25153 17651 1 19 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.515 -0.139 25153 17652 1 19 . 1 1 146 146 GLU C C 146 177.290 177.290 176.600 0.690 25153 17653 1 19 . 1 1 146 146 GLU CA C 146 56.120 56.120 56.249 -0.130 25153 17654 1 19 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.532 0.619 25153 17655 1 19 . 1 1 147 147 THR N N 147 118.328 118.328 113.922 4.406 25153 17656 1 19 . 1 1 147 147 THR HA H 147 4.200 4.200 4.627 -0.427 25153 17657 1 19 . 1 1 147 147 THR C C 147 175.683 175.683 175.035 0.648 25153 17658 1 19 . 1 1 147 147 THR CA C 147 66.250 66.250 62.751 3.499 25153 17659 1 19 . 1 1 147 147 THR CB C 147 69.600 69.600 69.514 0.086 25153 17660 1 19 . 1 1 147 147 THR H H 147 8.562 8.562 8.800 -0.238 25153 17661 1 19 . 1 1 148 148 ASN N N 148 115.550 115.550 118.760 -3.210 25153 17662 1 19 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.913 0.074 25153 17663 1 19 . 1 1 148 148 ASN C C 148 175.870 175.870 174.874 0.996 25153 17664 1 19 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.921 -1.221 25153 17665 1 19 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.880 2.000 25153 17666 1 19 . 1 1 148 148 ASN H H 148 9.118 9.118 8.974 0.144 25153 17667 1 19 . 1 1 149 149 GLN N N 149 117.400 117.400 119.443 -2.043 25153 17668 1 19 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.319 0.524 25153 17669 1 19 . 1 1 149 149 GLN C C 149 177.780 177.780 176.271 1.509 25153 17670 1 19 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.185 -1.286 25153 17671 1 19 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.732 0.568 25153 17672 1 19 . 1 1 149 149 GLN H H 149 7.555 7.555 7.876 -0.321 25153 17673 1 19 . 1 1 150 150 TYR N N 150 120.674 120.674 118.016 2.658 25153 17674 1 19 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.347 0.181 25153 17675 1 19 . 1 1 150 150 TYR C C 150 177.830 177.830 176.740 1.090 25153 17676 1 19 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.451 0.036 25153 17677 1 19 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.905 -0.305 25153 17678 1 19 . 1 1 150 150 TYR H H 150 6.983 6.983 7.813 -0.830 25153 17679 1 19 . 1 1 151 151 ASP N N 151 120.810 120.810 119.304 1.506 25153 17680 1 19 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.616 -0.101 25153 17681 1 19 . 1 1 151 151 ASP C C 151 176.400 176.400 177.131 -0.731 25153 17682 1 19 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.969 -0.569 25153 17683 1 19 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.221 -2.141 25153 17684 1 19 . 1 1 152 152 LEU N N 152 118.083 118.083 112.327 5.756 25153 17685 1 19 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.741 -0.065 25153 17686 1 19 . 1 1 152 152 LEU C C 152 178.470 178.470 177.865 0.605 25153 17687 1 19 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.779 -1.179 25153 17688 1 19 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.260 -0.660 25153 17689 1 19 . 1 1 152 152 LEU H H 152 7.453 7.453 7.399 0.054 25153 17690 1 19 . 1 1 153 153 SER N N 153 116.407 116.407 117.959 -1.552 25153 17691 1 19 . 1 1 153 153 SER HA H 153 3.960 3.960 4.029 -0.069 25153 17692 1 19 . 1 1 153 153 SER C C 153 174.590 174.590 175.878 -1.288 25153 17693 1 19 . 1 1 153 153 SER CA C 153 63.400 63.400 63.871 -0.471 25153 17694 1 19 . 1 1 153 153 SER CB C 153 63.100 63.100 62.867 0.233 25153 17695 1 19 . 1 1 153 153 SER H H 153 7.360 7.360 8.663 -1.303 25153 17696 1 19 . 1 1 154 154 ASP N N 154 121.960 121.960 120.957 1.003 25153 17697 1 19 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.301 0.009 25153 17698 1 19 . 1 1 154 154 ASP C C 154 178.640 178.640 177.641 0.999 25153 17699 1 19 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.607 1.393 25153 17700 1 19 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.938 -1.368 25153 17701 1 19 . 1 1 155 155 GLU N N 155 121.310 121.310 119.067 2.243 25153 17702 1 19 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.046 0.139 25153 17703 1 19 . 1 1 155 155 GLU C C 155 179.600 179.600 178.956 0.644 25153 17704 1 19 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.967 0.483 25153 17705 1 19 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.468 -0.068 25153 17706 1 19 . 1 1 156 156 ARG N N 156 121.394 121.394 119.025 2.369 25153 17707 1 19 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.338 -0.038 25153 17708 1 19 . 1 1 156 156 ARG C C 156 177.330 177.330 178.787 -1.457 25153 17709 1 19 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.487 1.973 25153 17710 1 19 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.331 0.429 25153 17711 1 19 . 1 1 157 157 ILE N N 157 118.390 118.390 121.585 -3.195 25153 17712 1 19 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.748 -0.314 25153 17713 1 19 . 1 1 157 157 ILE C C 157 178.814 178.814 177.687 1.127 25153 17714 1 19 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.757 0.937 25153 17715 1 19 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.843 1.010 25153 17716 1 19 . 1 1 157 157 ILE H H 157 8.966 8.966 7.599 1.367 25153 17717 1 19 . 1 1 158 158 GLN N N 158 120.060 120.060 118.709 1.351 25153 17718 1 19 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.980 -0.024 25153 17719 1 19 . 1 1 158 158 GLN C C 158 178.843 178.843 178.984 -0.141 25153 17720 1 19 . 1 1 158 158 GLN CA C 158 60.600 60.600 58.888 1.712 25153 17721 1 19 . 1 1 158 158 GLN CB C 158 28.390 28.390 27.930 0.460 25153 17722 1 19 . 1 1 158 158 GLN H H 158 8.394 8.394 7.886 0.508 25153 17723 1 19 . 1 1 159 159 SER N N 159 115.613 115.613 116.004 -0.391 25153 17724 1 19 . 1 1 159 159 SER HA H 159 4.455 4.455 4.500 -0.045 25153 17725 1 19 . 1 1 159 159 SER C C 159 177.330 177.330 176.801 0.529 25153 17726 1 19 . 1 1 159 159 SER CA C 159 62.400 62.400 61.160 1.240 25153 17727 1 19 . 1 1 159 159 SER CB C 159 63.760 63.760 63.412 0.348 25153 17728 1 19 . 1 1 159 159 SER H H 159 8.460 8.460 8.156 0.304 25153 17729 1 19 . 1 1 160 160 TRP N N 160 126.820 126.820 125.003 1.817 25153 17730 1 19 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.151 0.314 25153 17731 1 19 . 1 1 160 160 TRP C C 160 178.050 178.050 177.638 0.412 25153 17732 1 19 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.838 0.862 25153 17733 1 19 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.336 0.024 25153 17734 1 19 . 1 1 160 160 TRP H H 160 9.318 9.318 8.486 0.832 25153 17735 1 19 . 1 1 161 161 CYS N N 161 116.750 116.750 117.845 -1.095 25153 17736 1 19 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.745 0.138 25153 17737 1 19 . 1 1 161 161 CYS C C 161 176.270 176.270 176.742 -0.472 25153 17738 1 19 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.278 1.082 25153 17739 1 19 . 1 1 161 161 CYS CB C 161 27.880 27.880 27.084 0.796 25153 17740 1 19 . 1 1 161 161 CYS H H 161 8.950 8.950 9.059 -0.109 25153 17741 1 19 . 1 1 162 162 GLU N N 162 118.096 118.096 120.001 -1.905 25153 17742 1 19 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.033 -0.103 25153 17743 1 19 . 1 1 162 162 GLU C C 162 178.680 178.680 177.516 1.164 25153 17744 1 19 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.074 0.656 25153 17745 1 19 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.355 0.075 25153 17746 1 19 . 1 1 163 163 GLN N N 163 120.790 120.790 117.806 2.984 25153 17747 1 19 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.140 0.037 25153 17748 1 19 . 1 1 163 163 GLN C C 163 179.690 179.690 178.271 1.419 25153 17749 1 19 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.804 1.736 25153 17750 1 19 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.124 -0.124 25153 17751 1 19 . 1 1 163 163 GLN H H 163 8.205 8.205 7.521 0.684 25153 17752 1 19 . 1 1 164 164 ILE N N 164 114.860 114.860 118.859 -3.999 25153 17753 1 19 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.876 0.167 25153 17754 1 19 . 1 1 164 164 ILE C C 164 178.680 178.680 177.240 1.440 25153 17755 1 19 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.010 2.200 25153 17756 1 19 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.632 0.068 25153 17757 1 19 . 1 1 164 164 ILE H H 164 9.005 9.005 8.016 0.989 25153 17758 1 19 . 1 1 165 165 LEU N N 165 123.900 123.900 116.923 6.977 25153 17759 1 19 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.225 -0.075 25153 17760 1 19 . 1 1 165 165 LEU C C 165 180.520 180.520 177.521 2.999 25153 17761 1 19 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.056 1.244 25153 17762 1 19 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.107 -0.057 25153 17763 1 19 . 1 1 165 165 LEU H H 165 7.825 7.825 7.987 -0.162 25153 17764 1 19 . 1 1 166 166 ASN N N 166 120.112 120.112 118.178 1.934 25153 17765 1 19 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.673 -0.090 25153 17766 1 19 . 1 1 166 166 ASN C C 166 178.440 178.440 177.154 1.286 25153 17767 1 19 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.426 0.994 25153 17768 1 19 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.675 -1.255 25153 17769 1 19 . 1 1 166 166 ASN H H 166 7.760 7.760 8.002 -0.242 25153 17770 1 19 . 1 1 167 167 GLU N N 167 121.370 121.370 120.806 0.564 25153 17771 1 19 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.042 0.061 25153 17772 1 19 . 1 1 167 167 GLU C C 167 180.332 180.332 179.112 1.220 25153 17773 1 19 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.362 0.788 25153 17774 1 19 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.601 1.419 25153 17775 1 19 . 1 1 168 168 MET N N 168 118.532 118.532 117.109 1.423 25153 17776 1 19 . 1 1 168 168 MET HA H 168 4.015 4.015 4.403 -0.388 25153 17777 1 19 . 1 1 168 168 MET C C 168 176.600 176.600 177.868 -1.268 25153 17778 1 19 . 1 1 168 168 MET CA C 168 59.300 59.300 59.064 0.236 25153 17779 1 19 . 1 1 168 168 MET CB C 168 33.400 33.400 33.162 0.238 25153 17780 1 19 . 1 1 168 168 MET H H 168 8.718 8.718 8.325 0.393 25153 17781 1 19 . 1 1 169 169 ALA N N 169 121.922 121.922 121.736 0.186 25153 17782 1 19 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.269 -0.095 25153 17783 1 19 . 1 1 169 169 ALA C C 169 179.410 179.410 179.217 0.193 25153 17784 1 19 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.471 -0.071 25153 17785 1 19 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.644 -0.234 25153 17786 1 19 . 1 1 169 169 ALA H H 169 7.448 7.448 7.877 -0.429 25153 17787 1 19 . 1 1 170 170 GLU N N 170 117.300 117.300 116.245 1.055 25153 17788 1 19 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.151 -0.056 25153 17789 1 19 . 1 1 170 170 GLU C C 170 177.470 177.470 179.089 -1.619 25153 17790 1 19 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.473 -0.523 25153 17791 1 19 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.617 0.158 25153 17792 1 19 . 1 1 171 171 HIS N N 171 117.944 117.944 119.587 -1.643 25153 17793 1 19 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.377 0.123 25153 17794 1 19 . 1 1 171 171 HIS C C 171 175.120 175.120 176.771 -1.651 25153 17795 1 19 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.905 -1.705 25153 17796 1 19 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.841 0.759 25153 17797 1 19 . 1 1 171 171 HIS H H 171 7.788 7.788 7.914 -0.126 25153 17798 1 19 . 1 1 172 172 TYR N N 172 120.040 120.040 118.353 1.687 25153 17799 1 19 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.363 0.230 25153 17800 1 19 . 1 1 172 172 TYR C C 172 174.612 174.612 175.449 -0.837 25153 17801 1 19 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.431 -0.451 25153 17802 1 19 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.508 0.472 25153 17803 1 19 . 1 1 172 172 TYR H H 172 7.820 7.820 8.068 -0.248 25153 17804 1 20 . 1 1 2 2 ASN N N 2 123.320 123.320 120.026 3.294 25153 17805 1 20 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.094 0.114 25153 17806 1 20 . 1 1 2 2 ASN C C 2 174.590 174.590 174.350 0.240 25153 17807 1 20 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.803 0.197 25153 17808 1 20 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.353 -0.383 25153 17809 1 20 . 1 1 2 2 ASN H H 2 9.428 9.428 8.347 1.081 25153 17810 1 20 . 1 1 3 3 MET N N 3 120.920 120.920 119.111 1.809 25153 17811 1 20 . 1 1 3 3 MET HA H 3 5.530 5.530 5.286 0.244 25153 17812 1 20 . 1 1 3 3 MET C C 3 174.400 174.400 174.941 -0.541 25153 17813 1 20 . 1 1 3 3 MET CA C 3 54.643 54.643 54.337 0.306 25153 17814 1 20 . 1 1 3 3 MET CB C 3 34.637 34.637 37.462 -2.825 25153 17815 1 20 . 1 1 3 3 MET H H 3 8.751 8.751 9.188 -0.437 25153 17816 1 20 . 1 1 4 4 GLY N N 4 115.542 115.542 109.558 5.984 25153 17817 1 20 . 1 1 4 4 GLY C C 4 170.413 170.413 172.336 -1.923 25153 17818 1 20 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.868 -0.766 25153 17819 1 20 . 1 1 4 4 GLY H H 4 8.927 8.927 9.020 -0.093 25153 17820 1 20 . 1 1 5 5 LEU N N 5 131.030 131.030 127.990 3.040 25153 17821 1 20 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.319 1.083 25153 17822 1 20 . 1 1 5 5 LEU C C 5 175.952 175.952 174.546 1.406 25153 17823 1 20 . 1 1 5 5 LEU CA C 5 53.450 53.450 53.239 0.211 25153 17824 1 20 . 1 1 5 5 LEU CB C 5 44.592 44.592 42.329 2.263 25153 17825 1 20 . 1 1 5 5 LEU H H 5 8.928 8.928 8.665 0.263 25153 17826 1 20 . 1 1 6 6 PHE N N 6 125.790 125.790 126.100 -0.310 25153 17827 1 20 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.692 0.048 25153 17828 1 20 . 1 1 6 6 PHE C C 6 174.300 174.300 175.574 -1.274 25153 17829 1 20 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.309 -0.989 25153 17830 1 20 . 1 1 6 6 PHE CB C 6 41.230 41.230 42.024 -0.794 25153 17831 1 20 . 1 1 6 6 PHE H H 6 9.237 9.237 9.566 -0.329 25153 17832 1 20 . 1 1 7 7 TYR N N 7 117.289 117.289 117.390 -0.101 25153 17833 1 20 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.904 0.061 25153 17834 1 20 . 1 1 7 7 TYR C C 7 171.262 171.262 173.287 -2.025 25153 17835 1 20 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.090 -0.690 25153 17836 1 20 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.487 -0.247 25153 17837 1 20 . 1 1 7 7 TYR H H 7 8.125 8.125 8.670 -0.545 25153 17838 1 20 . 1 1 8 8 GLY N N 8 107.420 107.420 106.928 0.492 25153 17839 1 20 . 1 1 8 8 GLY C C 8 172.000 172.000 172.215 -0.215 25153 17840 1 20 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.288 -0.344 25153 17841 1 20 . 1 1 8 8 GLY H H 8 7.031 7.031 8.516 -1.485 25153 17842 1 20 . 1 1 9 9 SER N N 9 118.150 118.150 116.114 2.036 25153 17843 1 20 . 1 1 9 9 SER HA H 9 5.200 5.200 5.128 0.072 25153 17844 1 20 . 1 1 9 9 SER C C 9 175.000 175.000 173.904 1.096 25153 17845 1 20 . 1 1 9 9 SER CA C 9 57.570 57.570 57.400 0.170 25153 17846 1 20 . 1 1 9 9 SER CB C 9 66.700 66.700 65.906 0.794 25153 17847 1 20 . 1 1 9 9 SER H H 9 9.604 9.604 8.126 1.478 25153 17848 1 20 . 1 1 10 10 SER N N 10 131.193 131.193 120.161 11.032 25153 17849 1 20 . 1 1 10 10 SER HA H 10 4.775 4.775 4.418 0.357 25153 17850 1 20 . 1 1 10 10 SER C C 10 175.730 175.730 175.758 -0.028 25153 17851 1 20 . 1 1 10 10 SER CA C 10 61.750 61.750 60.512 1.238 25153 17852 1 20 . 1 1 10 10 SER CB C 10 64.400 64.400 63.581 0.819 25153 17853 1 20 . 1 1 10 10 SER H H 10 11.636 11.636 9.016 2.620 25153 17854 1 20 . 1 1 11 11 THR N N 11 115.848 115.848 116.336 -0.488 25153 17855 1 20 . 1 1 11 11 THR HA H 11 4.770 4.770 4.177 0.593 25153 17856 1 20 . 1 1 11 11 THR C C 11 173.700 173.700 174.882 -1.182 25153 17857 1 20 . 1 1 11 11 THR CA C 11 60.700 60.700 62.760 -2.060 25153 17858 1 20 . 1 1 11 11 THR CB C 11 67.430 67.430 69.124 -1.694 25153 17859 1 20 . 1 1 11 11 THR H H 11 9.550 9.550 8.469 1.081 25153 17860 1 20 . 1 1 12 12 CYS N N 12 109.780 109.780 114.503 -4.723 25153 17861 1 20 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.828 -0.758 25153 17862 1 20 . 1 1 12 12 CYS C C 12 176.220 176.220 175.269 0.951 25153 17863 1 20 . 1 1 12 12 CYS CA C 12 63.600 63.600 58.349 5.251 25153 17864 1 20 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.962 -1.562 25153 17865 1 20 . 1 1 12 12 CYS H H 12 7.437 7.437 7.631 -0.194 25153 17866 1 20 . 1 1 13 13 TYR N N 13 127.830 127.830 123.533 4.297 25153 17867 1 20 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.330 -0.227 25153 17868 1 20 . 1 1 13 13 TYR C C 13 180.880 180.880 177.882 2.998 25153 17869 1 20 . 1 1 13 13 TYR CA C 13 65.100 65.100 59.847 5.253 25153 17870 1 20 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.863 -1.028 25153 17871 1 20 . 1 1 13 13 TYR H H 13 10.886 10.886 7.732 3.154 25153 17872 1 20 . 1 1 14 14 THR N N 14 124.428 124.428 113.605 10.823 25153 17873 1 20 . 1 1 14 14 THR HA H 14 4.160 4.160 4.160 0.000 25153 17874 1 20 . 1 1 14 14 THR C C 14 177.760 177.760 176.355 1.405 25153 17875 1 20 . 1 1 14 14 THR CA C 14 67.823 67.823 66.358 1.465 25153 17876 1 20 . 1 1 14 14 THR CB C 14 68.040 68.040 68.047 -0.007 25153 17877 1 20 . 1 1 14 14 THR H H 14 11.405 11.405 8.642 2.763 25153 17878 1 20 . 1 1 15 15 GLU N N 15 123.050 123.050 123.230 -0.180 25153 17879 1 20 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.115 -0.225 25153 17880 1 20 . 1 1 15 15 GLU C C 15 176.392 176.392 178.348 -1.956 25153 17881 1 20 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.715 -0.515 25153 17882 1 20 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.287 1.163 25153 17883 1 20 . 1 1 16 16 MET N N 16 120.173 120.173 118.227 1.946 25153 17884 1 20 . 1 1 16 16 MET HA H 16 4.050 4.050 4.143 -0.093 25153 17885 1 20 . 1 1 16 16 MET C C 16 179.940 179.940 178.673 1.267 25153 17886 1 20 . 1 1 16 16 MET CA C 16 59.240 59.240 59.261 -0.021 25153 17887 1 20 . 1 1 16 16 MET CB C 16 32.970 32.970 32.847 0.123 25153 17888 1 20 . 1 1 16 16 MET H H 16 8.469 8.469 8.355 0.114 25153 17889 1 20 . 1 1 17 17 ALA N N 17 121.930 121.930 121.854 0.076 25153 17890 1 20 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.876 -0.040 25153 17891 1 20 . 1 1 17 17 ALA C C 17 177.900 177.900 178.804 -0.904 25153 17892 1 20 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.101 0.099 25153 17893 1 20 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.155 -0.155 25153 17894 1 20 . 1 1 17 17 ALA H H 17 7.880 7.880 8.010 -0.130 25153 17895 1 20 . 1 1 18 18 ALA N N 18 121.477 121.477 121.434 0.043 25153 17896 1 20 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.860 -0.123 25153 17897 1 20 . 1 1 18 18 ALA C C 18 179.380 179.380 179.633 -0.253 25153 17898 1 20 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.179 -0.179 25153 17899 1 20 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.856 0.974 25153 17900 1 20 . 1 1 18 18 ALA H H 18 7.374 7.374 8.327 -0.953 25153 17901 1 20 . 1 1 19 19 GLU N N 19 116.650 116.650 118.088 -1.438 25153 17902 1 20 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.882 -0.266 25153 17903 1 20 . 1 1 19 19 GLU C C 19 178.479 178.479 179.526 -1.047 25153 17904 1 20 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.491 0.239 25153 17905 1 20 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.384 -0.084 25153 17906 1 20 . 1 1 20 20 LYS N N 20 119.470 119.470 120.084 -0.614 25153 17907 1 20 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.002 0.048 25153 17908 1 20 . 1 1 20 20 LYS C C 20 179.116 179.116 178.925 0.191 25153 17909 1 20 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.740 0.090 25153 17910 1 20 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.492 0.358 25153 17911 1 20 . 1 1 21 21 ILE N N 21 121.030 121.030 120.661 0.369 25153 17912 1 20 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.681 -0.291 25153 17913 1 20 . 1 1 21 21 ILE C C 21 177.580 177.580 178.188 -0.608 25153 17914 1 20 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.751 0.069 25153 17915 1 20 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.909 0.439 25153 17916 1 20 . 1 1 21 21 ILE H H 21 8.100 8.100 8.681 -0.581 25153 17917 1 20 . 1 1 22 22 ARG N N 22 119.720 119.720 119.403 0.317 25153 17918 1 20 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.853 -0.298 25153 17919 1 20 . 1 1 22 22 ARG C C 22 177.320 177.320 178.179 -0.859 25153 17920 1 20 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.614 0.106 25153 17921 1 20 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.640 -0.708 25153 17922 1 20 . 1 1 23 23 ASP N N 23 118.730 118.730 119.353 -0.623 25153 17923 1 20 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.413 -0.050 25153 17924 1 20 . 1 1 23 23 ASP C C 23 178.330 178.330 178.743 -0.413 25153 17925 1 20 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.360 -0.410 25153 17926 1 20 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.869 -0.629 25153 17927 1 20 . 1 1 24 24 ILE N N 24 121.090 121.090 119.158 1.932 25153 17928 1 20 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.779 0.017 25153 17929 1 20 . 1 1 24 24 ILE C C 24 178.250 178.250 177.920 0.330 25153 17930 1 20 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.941 -0.791 25153 17931 1 20 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.354 0.126 25153 17932 1 20 . 1 1 24 24 ILE H H 24 7.910 7.910 8.140 -0.230 25153 17933 1 20 . 1 1 25 25 ILE N N 25 121.406 121.406 117.209 4.197 25153 17934 1 20 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.868 -0.222 25153 17935 1 20 . 1 1 25 25 ILE C C 25 176.800 176.800 176.782 0.018 25153 17936 1 20 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.027 2.673 25153 17937 1 20 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.920 -0.730 25153 17938 1 20 . 1 1 25 25 ILE H H 25 8.476 8.476 8.024 0.452 25153 17939 1 20 . 1 1 26 26 GLY N N 26 108.900 108.900 105.126 3.774 25153 17940 1 20 . 1 1 26 26 GLY C C 26 173.710 173.710 172.271 1.439 25153 17941 1 20 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.651 -0.321 25153 17942 1 20 . 1 1 26 26 GLY H H 26 8.016 8.016 7.807 0.209 25153 17943 1 20 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.687 -0.349 25153 17944 1 20 . 1 1 27 27 PRO C C 27 177.200 177.200 177.100 0.100 25153 17945 1 20 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.574 1.112 25153 17946 1 20 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.053 0.147 25153 17947 1 20 . 1 1 28 28 GLU N N 28 116.295 116.295 117.862 -1.567 25153 17948 1 20 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.225 0.045 25153 17949 1 20 . 1 1 28 28 GLU C C 28 176.980 176.980 177.291 -0.311 25153 17950 1 20 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.123 -0.383 25153 17951 1 20 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.632 -0.962 25153 17952 1 20 . 1 1 29 29 LEU N N 29 120.250 120.250 111.530 8.720 25153 17953 1 20 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.734 -0.098 25153 17954 1 20 . 1 1 29 29 LEU C C 29 175.770 175.770 175.466 0.304 25153 17955 1 20 . 1 1 29 29 LEU CA C 29 55.800 55.800 54.873 0.927 25153 17956 1 20 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.666 1.434 25153 17957 1 20 . 1 1 29 29 LEU H H 29 7.940 7.940 7.630 0.310 25153 17958 1 20 . 1 1 30 30 VAL N N 30 118.693 118.693 121.735 -3.042 25153 17959 1 20 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.991 -0.343 25153 17960 1 20 . 1 1 30 30 VAL C C 30 174.347 174.347 175.827 -1.480 25153 17961 1 20 . 1 1 30 30 VAL CA C 30 60.868 60.868 62.076 -1.208 25153 17962 1 20 . 1 1 30 30 VAL CB C 30 34.580 34.580 33.229 1.351 25153 17963 1 20 . 1 1 30 30 VAL H H 30 7.434 7.434 7.976 -0.542 25153 17964 1 20 . 1 1 31 31 THR N N 31 123.800 123.800 121.752 2.048 25153 17965 1 20 . 1 1 31 31 THR HA H 31 4.362 4.362 4.538 -0.176 25153 17966 1 20 . 1 1 31 31 THR C C 31 172.964 172.964 172.864 0.100 25153 17967 1 20 . 1 1 31 31 THR CA C 31 61.720 61.720 61.124 0.596 25153 17968 1 20 . 1 1 31 31 THR CB C 31 70.485 70.485 70.684 -0.199 25153 17969 1 20 . 1 1 31 31 THR H H 31 7.844 7.844 8.154 -0.310 25153 17970 1 20 . 1 1 32 32 LEU N N 32 127.800 127.800 123.887 3.913 25153 17971 1 20 . 1 1 32 32 LEU HA H 32 4.684 4.684 5.086 -0.402 25153 17972 1 20 . 1 1 32 32 LEU C C 32 176.600 176.600 175.724 0.876 25153 17973 1 20 . 1 1 32 32 LEU CA C 32 55.155 55.155 53.781 1.374 25153 17974 1 20 . 1 1 32 32 LEU CB C 32 43.850 43.850 43.387 0.463 25153 17975 1 20 . 1 1 32 32 LEU H H 32 8.660 8.660 8.275 0.385 25153 17976 1 20 . 1 1 33 33 HIS N N 33 119.670 119.670 119.502 0.168 25153 17977 1 20 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.729 -0.329 25153 17978 1 20 . 1 1 33 33 HIS C C 33 171.667 171.667 173.188 -1.521 25153 17979 1 20 . 1 1 33 33 HIS CA C 33 55.200 55.200 54.893 0.307 25153 17980 1 20 . 1 1 33 33 HIS CB C 33 32.200 32.200 32.200 0.000 25153 17981 1 20 . 1 1 33 33 HIS H H 33 9.060 9.060 8.694 0.366 25153 17982 1 20 . 1 1 34 34 ASN N N 34 124.068 124.068 123.392 0.676 25153 17983 1 20 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.063 -0.629 25153 17984 1 20 . 1 1 34 34 ASN C C 34 178.000 178.000 176.089 1.911 25153 17985 1 20 . 1 1 34 34 ASN CA C 34 51.429 51.429 51.521 -0.092 25153 17986 1 20 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.170 -0.610 25153 17987 1 20 . 1 1 34 34 ASN H H 34 8.780 8.780 9.223 -0.443 25153 17988 1 20 . 1 1 35 35 LEU N N 35 129.040 129.040 124.970 4.070 25153 17989 1 20 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.126 0.189 25153 17990 1 20 . 1 1 35 35 LEU C C 35 177.700 177.700 177.434 0.266 25153 17991 1 20 . 1 1 35 35 LEU CA C 35 56.480 56.480 57.069 -0.589 25153 17992 1 20 . 1 1 35 35 LEU CB C 35 42.300 42.300 41.364 0.936 25153 17993 1 20 . 1 1 35 35 LEU H H 35 8.821 8.821 8.212 0.609 25153 17994 1 20 . 1 1 36 36 LYS N N 36 121.043 121.043 113.834 7.209 25153 17995 1 20 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.032 -0.152 25153 17996 1 20 . 1 1 36 36 LYS C C 36 176.230 176.230 176.797 -0.567 25153 17997 1 20 . 1 1 36 36 LYS CA C 36 59.420 59.420 57.611 1.809 25153 17998 1 20 . 1 1 36 36 LYS CB C 36 33.270 33.270 31.897 1.373 25153 17999 1 20 . 1 1 37 37 ASP N N 37 114.965 114.965 118.051 -3.086 25153 18000 1 20 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.767 0.010 25153 18001 1 20 . 1 1 37 37 ASP C C 37 175.440 175.440 175.893 -0.453 25153 18002 1 20 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.645 0.066 25153 18003 1 20 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.180 1.520 25153 18004 1 20 . 1 1 38 38 ASP N N 38 121.650 121.650 121.508 0.142 25153 18005 1 20 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.826 0.044 25153 18006 1 20 . 1 1 38 38 ASP C C 38 174.852 174.852 176.139 -1.287 25153 18007 1 20 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.658 -1.578 25153 18008 1 20 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.266 -0.156 25153 18009 1 20 . 1 1 39 39 SER N N 39 115.207 115.207 117.420 -2.213 25153 18010 1 20 . 1 1 39 39 SER HA H 39 4.585 4.585 4.663 -0.078 25153 18011 1 20 . 1 1 39 39 SER C C 39 175.040 175.040 174.391 0.649 25153 18012 1 20 . 1 1 39 39 SER CA C 39 54.960 54.960 56.600 -1.640 25153 18013 1 20 . 1 1 39 39 SER CB C 39 64.720 64.720 63.571 1.149 25153 18014 1 20 . 1 1 39 39 SER H H 39 8.351 8.351 8.542 -0.191 25153 18015 1 20 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.289 -0.284 25153 18016 1 20 . 1 1 40 40 PRO C C 40 176.730 176.730 177.804 -1.074 25153 18017 1 20 . 1 1 40 40 PRO CA C 40 63.900 63.900 64.153 -0.253 25153 18018 1 20 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.845 -0.445 25153 18019 1 20 . 1 1 41 41 LYS N N 41 121.150 121.150 119.520 1.630 25153 18020 1 20 . 1 1 41 41 LYS HA H 41 3.912 3.912 3.979 -0.067 25153 18021 1 20 . 1 1 41 41 LYS C C 41 179.600 179.600 178.612 0.988 25153 18022 1 20 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.416 -1.216 25153 18023 1 20 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.652 0.348 25153 18024 1 20 . 1 1 42 42 LEU N N 42 118.103 118.103 115.779 2.324 25153 18025 1 20 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.132 -0.095 25153 18026 1 20 . 1 1 42 42 LEU C C 42 178.760 178.760 178.804 -0.044 25153 18027 1 20 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.660 -0.480 25153 18028 1 20 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.935 1.038 25153 18029 1 20 . 1 1 42 42 LEU H H 42 7.600 7.600 7.456 0.144 25153 18030 1 20 . 1 1 43 43 MET N N 43 118.917 118.917 116.634 2.283 25153 18031 1 20 . 1 1 43 43 MET HA H 43 3.750 3.750 4.424 -0.674 25153 18032 1 20 . 1 1 43 43 MET C C 43 177.680 177.680 176.753 0.927 25153 18033 1 20 . 1 1 43 43 MET CA C 43 59.730 59.730 57.938 1.792 25153 18034 1 20 . 1 1 43 43 MET CB C 43 32.700 32.700 31.803 0.897 25153 18035 1 20 . 1 1 43 43 MET H H 43 8.202 8.202 8.044 0.158 25153 18036 1 20 . 1 1 44 44 GLU N N 44 110.924 110.924 117.471 -6.547 25153 18037 1 20 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.251 -0.511 25153 18038 1 20 . 1 1 44 44 GLU C C 44 178.130 178.130 179.025 -0.895 25153 18039 1 20 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.133 1.267 25153 18040 1 20 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.972 -0.422 25153 18041 1 20 . 1 1 45 45 GLN N N 45 115.756 115.756 118.759 -3.003 25153 18042 1 20 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.023 0.160 25153 18043 1 20 . 1 1 45 45 GLN C C 45 175.414 175.414 177.207 -1.793 25153 18044 1 20 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.621 -1.441 25153 18045 1 20 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.072 -0.472 25153 18046 1 20 . 1 1 45 45 GLN H H 45 7.516 7.516 7.544 -0.028 25153 18047 1 20 . 1 1 46 46 TYR N N 46 117.860 117.860 118.549 -0.689 25153 18048 1 20 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.371 0.292 25153 18049 1 20 . 1 1 46 46 TYR C C 46 175.500 175.500 176.992 -1.492 25153 18050 1 20 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.255 -0.769 25153 18051 1 20 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.377 3.092 25153 18052 1 20 . 1 1 46 46 TYR H H 46 6.996 6.996 7.118 -0.122 25153 18053 1 20 . 1 1 47 47 ASP N N 47 121.683 121.683 122.280 -0.597 25153 18054 1 20 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.629 0.071 25153 18055 1 20 . 1 1 47 47 ASP C C 47 175.610 175.610 175.103 0.507 25153 18056 1 20 . 1 1 47 47 ASP CA C 47 56.700 56.700 56.183 0.517 25153 18057 1 20 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.795 1.205 25153 18058 1 20 . 1 1 48 48 VAL N N 48 118.628 118.628 116.631 1.997 25153 18059 1 20 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.786 0.248 25153 18060 1 20 . 1 1 48 48 VAL C C 48 174.190 174.190 174.100 0.090 25153 18061 1 20 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.267 -1.077 25153 18062 1 20 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.880 0.220 25153 18063 1 20 . 1 1 48 48 VAL H H 48 7.628 7.628 7.352 0.276 25153 18064 1 20 . 1 1 49 49 LEU N N 49 128.190 128.190 123.766 4.424 25153 18065 1 20 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.546 0.057 25153 18066 1 20 . 1 1 49 49 LEU C C 49 174.880 174.880 175.599 -0.719 25153 18067 1 20 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.461 -1.221 25153 18068 1 20 . 1 1 49 49 LEU CB C 49 45.340 45.340 46.191 -0.851 25153 18069 1 20 . 1 1 49 49 LEU H H 49 9.407 9.407 9.177 0.230 25153 18070 1 20 . 1 1 50 50 ILE N N 50 124.550 124.550 120.788 3.762 25153 18071 1 20 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.075 0.625 25153 18072 1 20 . 1 1 50 50 ILE C C 50 175.300 175.300 174.654 0.646 25153 18073 1 20 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.910 -1.046 25153 18074 1 20 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.955 -0.705 25153 18075 1 20 . 1 1 50 50 ILE H H 50 9.238 9.238 9.195 0.043 25153 18076 1 20 . 1 1 51 51 LEU N N 51 127.460 127.460 128.662 -1.202 25153 18077 1 20 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.821 0.364 25153 18078 1 20 . 1 1 51 51 LEU C C 51 174.544 174.544 175.976 -1.432 25153 18079 1 20 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.720 -0.900 25153 18080 1 20 . 1 1 51 51 LEU CB C 51 43.637 43.637 45.765 -2.128 25153 18081 1 20 . 1 1 51 51 LEU H H 51 9.228 9.228 9.144 0.084 25153 18082 1 20 . 1 1 52 52 GLY N N 52 107.760 107.760 112.189 -4.429 25153 18083 1 20 . 1 1 52 52 GLY C C 52 174.710 174.710 172.535 2.175 25153 18084 1 20 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.642 0.228 25153 18085 1 20 . 1 1 52 52 GLY H H 52 8.860 8.860 9.234 -0.374 25153 18086 1 20 . 1 1 53 53 ILE N N 53 123.890 123.890 121.178 2.712 25153 18087 1 20 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.750 0.520 25153 18088 1 20 . 1 1 53 53 ILE C C 53 172.630 172.630 172.854 -0.224 25153 18089 1 20 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.247 0.433 25153 18090 1 20 . 1 1 53 53 ILE CB C 53 44.160 44.160 39.526 4.634 25153 18091 1 20 . 1 1 53 53 ILE H H 53 8.458 8.458 8.182 0.276 25153 18092 1 20 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.882 0.506 25153 18093 1 20 . 1 1 54 54 PRO C C 54 175.000 175.000 176.429 -1.429 25153 18094 1 20 . 1 1 54 54 PRO CA C 54 61.600 61.600 62.255 -0.655 25153 18095 1 20 . 1 1 54 54 PRO CB C 54 32.300 32.300 33.006 -0.706 25153 18096 1 20 . 1 1 55 55 THR N N 55 112.754 112.754 117.734 -4.980 25153 18097 1 20 . 1 1 55 55 THR HA H 55 4.452 4.452 4.902 -0.450 25153 18098 1 20 . 1 1 55 55 THR C C 55 172.480 172.480 174.109 -1.629 25153 18099 1 20 . 1 1 55 55 THR CA C 55 62.350 62.350 62.901 -0.551 25153 18100 1 20 . 1 1 55 55 THR CB C 55 70.230 70.230 70.576 -0.346 25153 18101 1 20 . 1 1 55 55 THR H H 55 6.523 6.523 8.333 -1.810 25153 18102 1 20 . 1 1 56 56 TRP N N 56 130.044 130.044 124.859 5.185 25153 18103 1 20 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.714 -1.999 25153 18104 1 20 . 1 1 56 56 TRP C C 56 172.890 172.890 175.183 -2.293 25153 18105 1 20 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.864 -0.214 25153 18106 1 20 . 1 1 56 56 TRP CB C 56 33.000 33.000 32.691 0.309 25153 18107 1 20 . 1 1 56 56 TRP H H 56 8.450 8.450 8.829 -0.379 25153 18108 1 20 . 1 1 57 57 ASP N N 57 115.275 115.275 121.295 -6.020 25153 18109 1 20 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.295 0.057 25153 18110 1 20 . 1 1 57 57 ASP C C 57 173.660 173.660 175.009 -1.349 25153 18111 1 20 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.706 0.524 25153 18112 1 20 . 1 1 57 57 ASP CB C 57 40.170 40.170 40.132 0.038 25153 18113 1 20 . 1 1 58 58 PHE N N 58 112.840 112.840 116.314 -3.474 25153 18114 1 20 . 1 1 58 58 PHE HA H 58 3.324 3.324 4.052 -0.728 25153 18115 1 20 . 1 1 58 58 PHE C C 58 175.730 175.730 175.632 0.098 25153 18116 1 20 . 1 1 58 58 PHE CA C 58 58.823 58.823 58.155 0.668 25153 18117 1 20 . 1 1 58 58 PHE CB C 58 34.754 34.754 37.171 -2.417 25153 18118 1 20 . 1 1 58 58 PHE H H 58 7.640 7.640 8.070 -0.430 25153 18119 1 20 . 1 1 59 59 GLY N N 59 104.940 104.940 107.858 -2.918 25153 18120 1 20 . 1 1 59 59 GLY C C 59 173.750 173.750 174.876 -1.126 25153 18121 1 20 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.360 0.930 25153 18122 1 20 . 1 1 59 59 GLY H H 59 8.024 8.024 8.711 -0.687 25153 18123 1 20 . 1 1 60 60 GLU N N 60 120.045 120.045 119.238 0.807 25153 18124 1 20 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.537 -0.124 25153 18125 1 20 . 1 1 60 60 GLU C C 60 176.050 176.050 176.111 -0.061 25153 18126 1 20 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.423 -0.803 25153 18127 1 20 . 1 1 60 60 GLU CB C 60 30.610 30.610 30.943 -0.333 25153 18128 1 20 . 1 1 61 61 ILE N N 61 120.790 120.790 121.536 -0.746 25153 18129 1 20 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.171 -0.704 25153 18130 1 20 . 1 1 61 61 ILE C C 61 175.130 175.130 176.131 -1.001 25153 18131 1 20 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.300 0.247 25153 18132 1 20 . 1 1 61 61 ILE CB C 61 38.850 38.850 38.988 -0.138 25153 18133 1 20 . 1 1 61 61 ILE H H 61 8.200 8.200 7.985 0.215 25153 18134 1 20 . 1 1 62 62 GLN N N 62 124.520 124.520 122.441 2.079 25153 18135 1 20 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.102 -0.146 25153 18136 1 20 . 1 1 62 62 GLN C C 62 177.160 177.160 177.086 0.074 25153 18137 1 20 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.804 0.806 25153 18138 1 20 . 1 1 62 62 GLN CB C 62 27.650 27.650 29.986 -2.336 25153 18139 1 20 . 1 1 62 62 GLN H H 62 5.667 5.667 8.349 -2.682 25153 18140 1 20 . 1 1 63 63 GLU N N 63 124.570 124.570 126.279 -1.709 25153 18141 1 20 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.251 -0.265 25153 18142 1 20 . 1 1 63 63 GLU C C 63 177.300 177.300 177.370 -0.070 25153 18143 1 20 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.690 2.030 25153 18144 1 20 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.297 0.824 25153 18145 1 20 . 1 1 64 64 ASP N N 64 119.060 119.060 120.112 -1.052 25153 18146 1 20 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.575 0.045 25153 18147 1 20 . 1 1 64 64 ASP C C 64 179.180 179.180 177.893 1.287 25153 18148 1 20 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.169 1.781 25153 18149 1 20 . 1 1 64 64 ASP CB C 64 40.950 40.950 41.103 -0.153 25153 18150 1 20 . 1 1 65 65 TRP N N 65 121.070 121.070 121.866 -0.796 25153 18151 1 20 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.417 -0.077 25153 18152 1 20 . 1 1 65 65 TRP C C 65 178.970 178.970 178.398 0.572 25153 18153 1 20 . 1 1 65 65 TRP CA C 65 60.820 60.820 61.045 -0.225 25153 18154 1 20 . 1 1 65 65 TRP CB C 65 30.400 30.400 29.912 0.488 25153 18155 1 20 . 1 1 65 65 TRP H H 65 7.350 7.350 8.146 -0.796 25153 18156 1 20 . 1 1 66 66 GLU N N 66 120.900 120.900 117.677 3.223 25153 18157 1 20 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.890 -0.050 25153 18158 1 20 . 1 1 66 66 GLU C C 66 178.750 178.750 178.942 -0.192 25153 18159 1 20 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.279 0.721 25153 18160 1 20 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.155 -0.295 25153 18161 1 20 . 1 1 67 67 ALA N N 67 119.130 119.130 119.751 -0.621 25153 18162 1 20 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.269 -0.016 25153 18163 1 20 . 1 1 67 67 ALA C C 67 179.410 179.410 179.105 0.305 25153 18164 1 20 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.650 -0.070 25153 18165 1 20 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.864 -0.054 25153 18166 1 20 . 1 1 67 67 ALA H H 67 7.640 7.640 7.612 0.028 25153 18167 1 20 . 1 1 68 68 VAL N N 68 106.845 106.845 112.549 -5.704 25153 18168 1 20 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.424 0.386 25153 18169 1 20 . 1 1 68 68 VAL C C 68 176.750 176.750 176.973 -0.223 25153 18170 1 20 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.806 -3.196 25153 18171 1 20 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.185 0.435 25153 18172 1 20 . 1 1 68 68 VAL H H 68 7.219 7.219 7.492 -0.273 25153 18173 1 20 . 1 1 69 69 TRP N N 69 127.630 127.630 123.776 3.854 25153 18174 1 20 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.262 -0.024 25153 18175 1 20 . 1 1 69 69 TRP C C 69 178.670 178.670 177.024 1.646 25153 18176 1 20 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.645 -1.425 25153 18177 1 20 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.831 1.799 25153 18178 1 20 . 1 1 69 69 TRP H H 69 7.832 7.832 8.372 -0.540 25153 18179 1 20 . 1 1 70 70 ASP N N 70 114.544 114.544 118.204 -3.660 25153 18180 1 20 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.465 0.057 25153 18181 1 20 . 1 1 70 70 ASP C C 70 178.670 178.670 178.998 -0.328 25153 18182 1 20 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.206 -1.206 25153 18183 1 20 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.995 -1.145 25153 18184 1 20 . 1 1 71 71 GLN N N 71 120.040 120.040 119.491 0.549 25153 18185 1 20 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.129 0.055 25153 18186 1 20 . 1 1 71 71 GLN C C 71 178.910 178.910 178.814 0.096 25153 18187 1 20 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.353 -0.743 25153 18188 1 20 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.856 0.244 25153 18189 1 20 . 1 1 71 71 GLN H H 71 7.995 7.995 7.704 0.291 25153 18190 1 20 . 1 1 72 72 LEU N N 72 117.400 117.400 119.085 -1.685 25153 18191 1 20 . 1 1 72 72 LEU HA H 72 3.813 3.813 4.008 -0.195 25153 18192 1 20 . 1 1 72 72 LEU C C 72 178.650 178.650 178.308 0.342 25153 18193 1 20 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.324 -0.124 25153 18194 1 20 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.243 0.167 25153 18195 1 20 . 1 1 72 72 LEU H H 72 7.450 7.450 7.850 -0.400 25153 18196 1 20 . 1 1 73 73 ASP N N 73 115.750 115.750 118.431 -2.681 25153 18197 1 20 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.408 -0.240 25153 18198 1 20 . 1 1 73 73 ASP C C 73 177.560 177.560 177.578 -0.018 25153 18199 1 20 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.638 0.762 25153 18200 1 20 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.161 -1.061 25153 18201 1 20 . 1 1 74 74 ASP N N 74 117.223 117.223 119.836 -2.613 25153 18202 1 20 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.591 0.112 25153 18203 1 20 . 1 1 74 74 ASP C C 74 176.388 176.388 177.049 -0.661 25153 18204 1 20 . 1 1 74 74 ASP CA C 74 54.500 54.500 55.096 -0.596 25153 18205 1 20 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.587 0.114 25153 18206 1 20 . 1 1 75 75 LEU N N 75 118.316 118.316 119.449 -1.133 25153 18207 1 20 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.374 -0.089 25153 18208 1 20 . 1 1 75 75 LEU C C 75 176.820 176.820 175.793 1.027 25153 18209 1 20 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.433 -0.033 25153 18210 1 20 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.510 0.770 25153 18211 1 20 . 1 1 75 75 LEU H H 75 6.960 6.960 7.298 -0.338 25153 18212 1 20 . 1 1 76 76 ASN N N 76 123.045 123.045 118.100 4.945 25153 18213 1 20 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.790 0.100 25153 18214 1 20 . 1 1 76 76 ASN C C 76 174.950 174.950 174.779 0.171 25153 18215 1 20 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.670 -0.620 25153 18216 1 20 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.520 -1.020 25153 18217 1 20 . 1 1 76 76 ASN H H 76 9.890 9.890 8.813 1.077 25153 18218 1 20 . 1 1 77 77 LEU N N 77 123.494 123.494 123.309 0.185 25153 18219 1 20 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.545 -0.175 25153 18220 1 20 . 1 1 77 77 LEU C C 77 175.040 175.040 176.340 -1.300 25153 18221 1 20 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.891 -1.641 25153 18222 1 20 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.403 0.497 25153 18223 1 20 . 1 1 77 77 LEU H H 77 8.730 8.730 8.090 0.640 25153 18224 1 20 . 1 1 78 78 GLU N N 78 120.870 120.870 121.652 -0.782 25153 18225 1 20 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.391 -0.491 25153 18226 1 20 . 1 1 78 78 GLU C C 78 178.660 178.660 177.831 0.829 25153 18227 1 20 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.634 1.126 25153 18228 1 20 . 1 1 78 78 GLU CB C 78 29.400 29.400 29.210 0.190 25153 18229 1 20 . 1 1 79 79 GLY N N 79 113.240 113.240 114.064 -0.824 25153 18230 1 20 . 1 1 79 79 GLY C C 79 174.460 174.460 174.271 0.189 25153 18231 1 20 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.341 0.089 25153 18232 1 20 . 1 1 79 79 GLY H H 79 8.474 8.474 8.875 -0.401 25153 18233 1 20 . 1 1 80 80 LYS N N 80 120.295 120.295 119.915 0.380 25153 18234 1 20 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.592 -0.234 25153 18235 1 20 . 1 1 80 80 LYS C C 80 175.360 175.360 176.257 -0.897 25153 18236 1 20 . 1 1 80 80 LYS CA C 80 56.970 56.970 56.243 0.727 25153 18237 1 20 . 1 1 80 80 LYS CB C 80 33.200 33.200 33.688 -0.487 25153 18238 1 20 . 1 1 81 81 ILE N N 81 122.400 122.400 123.217 -0.817 25153 18239 1 20 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.615 0.178 25153 18240 1 20 . 1 1 81 81 ILE C C 81 174.760 174.760 175.473 -0.713 25153 18241 1 20 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.623 -1.793 25153 18242 1 20 . 1 1 81 81 ILE CB C 81 38.700 38.700 38.783 -0.083 25153 18243 1 20 . 1 1 81 81 ILE H H 81 7.400 7.400 7.954 -0.554 25153 18244 1 20 . 1 1 82 82 VAL N N 82 127.840 127.840 125.961 1.879 25153 18245 1 20 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.065 0.197 25153 18246 1 20 . 1 1 82 82 VAL C C 82 172.724 172.724 174.418 -1.694 25153 18247 1 20 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.271 0.139 25153 18248 1 20 . 1 1 82 82 VAL CB C 82 35.400 35.400 34.999 0.401 25153 18249 1 20 . 1 1 82 82 VAL H H 82 8.790 8.790 8.861 -0.071 25153 18250 1 20 . 1 1 83 83 ALA N N 83 131.347 131.347 130.508 0.839 25153 18251 1 20 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.274 0.108 25153 18252 1 20 . 1 1 83 83 ALA C C 83 175.750 175.750 176.433 -0.683 25153 18253 1 20 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.167 -0.297 25153 18254 1 20 . 1 1 83 83 ALA CB C 83 23.450 23.450 21.013 2.437 25153 18255 1 20 . 1 1 83 83 ALA H H 83 9.300 9.300 8.965 0.335 25153 18256 1 20 . 1 1 84 84 LEU N N 84 124.200 124.200 126.636 -2.436 25153 18257 1 20 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.709 -0.189 25153 18258 1 20 . 1 1 84 84 LEU C C 84 175.760 175.760 176.862 -1.102 25153 18259 1 20 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.837 -0.337 25153 18260 1 20 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.465 1.435 25153 18261 1 20 . 1 1 84 84 LEU H H 84 10.287 10.287 9.040 1.247 25153 18262 1 20 . 1 1 85 85 TYR N N 85 115.912 115.912 119.065 -3.153 25153 18263 1 20 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.410 -0.450 25153 18264 1 20 . 1 1 85 85 TYR C C 85 172.372 172.372 173.817 -1.445 25153 18265 1 20 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.100 1.000 25153 18266 1 20 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.510 1.520 25153 18267 1 20 . 1 1 85 85 TYR H H 85 9.257 9.257 8.820 0.437 25153 18268 1 20 . 1 1 86 86 GLY N N 86 107.800 107.800 105.712 2.088 25153 18269 1 20 . 1 1 86 86 GLY C C 86 170.330 170.330 171.575 -1.245 25153 18270 1 20 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.780 -0.410 25153 18271 1 20 . 1 1 86 86 GLY H H 86 9.027 9.027 8.687 0.340 25153 18272 1 20 . 1 1 87 87 LEU N N 87 123.458 123.458 118.467 4.991 25153 18273 1 20 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.258 0.207 25153 18274 1 20 . 1 1 87 87 LEU C C 87 178.100 178.100 175.999 2.101 25153 18275 1 20 . 1 1 87 87 LEU CA C 87 53.590 53.590 53.252 0.338 25153 18276 1 20 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.893 -0.553 25153 18277 1 20 . 1 1 87 87 LEU H H 87 6.580 6.580 7.756 -1.176 25153 18278 1 20 . 1 1 88 88 GLY N N 88 108.966 108.966 107.224 1.742 25153 18279 1 20 . 1 1 88 88 GLY C C 88 172.820 172.820 171.520 1.300 25153 18280 1 20 . 1 1 88 88 GLY CA C 88 46.660 46.660 46.215 0.445 25153 18281 1 20 . 1 1 88 88 GLY H H 88 8.070 8.070 8.143 -0.073 25153 18282 1 20 . 1 1 89 89 ASP N N 89 121.150 121.150 119.985 1.165 25153 18283 1 20 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.439 -0.193 25153 18284 1 20 . 1 1 89 89 ASP C C 89 176.220 176.220 175.831 0.389 25153 18285 1 20 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.230 0.240 25153 18286 1 20 . 1 1 89 89 ASP CB C 89 42.480 42.480 42.834 -0.353 25153 18287 1 20 . 1 1 90 90 GLN N N 90 123.970 123.970 123.283 0.687 25153 18288 1 20 . 1 1 90 90 GLN HA H 90 3.488 3.488 3.702 -0.214 25153 18289 1 20 . 1 1 90 90 GLN C C 90 173.646 173.646 176.552 -2.906 25153 18290 1 20 . 1 1 90 90 GLN CA C 90 58.310 58.310 56.788 1.522 25153 18291 1 20 . 1 1 90 90 GLN CB C 90 28.210 28.210 29.063 -0.853 25153 18292 1 20 . 1 1 90 90 GLN H H 90 8.623 8.623 8.792 -0.169 25153 18293 1 20 . 1 1 91 91 LEU N N 91 118.017 118.017 120.401 -2.384 25153 18294 1 20 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.139 0.236 25153 18295 1 20 . 1 1 91 91 LEU C C 91 180.160 180.160 178.764 1.396 25153 18296 1 20 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.588 -0.528 25153 18297 1 20 . 1 1 91 91 LEU CB C 91 41.550 41.550 41.994 -0.444 25153 18298 1 20 . 1 1 91 91 LEU H H 91 7.046 7.046 7.932 -0.886 25153 18299 1 20 . 1 1 92 92 GLY N N 92 110.028 110.028 107.521 2.507 25153 18300 1 20 . 1 1 92 92 GLY C C 92 174.912 174.912 174.570 0.342 25153 18301 1 20 . 1 1 92 92 GLY CA C 92 46.180 46.180 46.476 -0.296 25153 18302 1 20 . 1 1 92 92 GLY H H 92 9.238 9.238 8.739 0.499 25153 18303 1 20 . 1 1 93 93 TYR N N 93 115.910 115.910 117.777 -1.867 25153 18304 1 20 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.008 0.001 25153 18305 1 20 . 1 1 93 93 TYR C C 93 176.850 176.850 175.662 1.188 25153 18306 1 20 . 1 1 93 93 TYR CA C 93 56.730 56.730 54.453 2.277 25153 18307 1 20 . 1 1 93 93 TYR CB C 93 38.130 38.130 36.760 1.370 25153 18308 1 20 . 1 1 93 93 TYR H H 93 6.962 6.962 7.582 -0.620 25153 18309 1 20 . 1 1 94 94 GLY N N 94 111.630 111.630 111.100 0.530 25153 18310 1 20 . 1 1 94 94 GLY C C 94 177.777 177.777 174.925 2.852 25153 18311 1 20 . 1 1 94 94 GLY CA C 94 50.030 50.030 46.727 3.303 25153 18312 1 20 . 1 1 94 94 GLY H H 94 7.835 7.835 7.840 -0.005 25153 18313 1 20 . 1 1 95 95 GLU N N 95 122.450 122.450 120.358 2.092 25153 18314 1 20 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.785 0.133 25153 18315 1 20 . 1 1 95 95 GLU C C 95 175.300 175.300 177.733 -2.433 25153 18316 1 20 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.858 -0.758 25153 18317 1 20 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.459 -0.948 25153 18318 1 20 . 1 1 96 96 TRP N N 96 118.790 118.790 117.215 1.575 25153 18319 1 20 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.556 0.888 25153 18320 1 20 . 1 1 96 96 TRP C C 96 179.280 179.280 177.135 2.145 25153 18321 1 20 . 1 1 96 96 TRP CA C 96 57.015 57.015 57.237 -0.222 25153 18322 1 20 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.535 -0.515 25153 18323 1 20 . 1 1 96 96 TRP H H 96 8.070 8.070 7.668 0.402 25153 18324 1 20 . 1 1 97 97 PHE N N 97 128.067 128.067 121.576 6.491 25153 18325 1 20 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.340 0.965 25153 18326 1 20 . 1 1 97 97 PHE C C 97 173.227 173.227 175.711 -2.484 25153 18327 1 20 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.144 -2.424 25153 18328 1 20 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.033 0.907 25153 18329 1 20 . 1 1 97 97 PHE H H 97 7.165 7.165 7.282 -0.117 25153 18330 1 20 . 1 1 98 98 LEU N N 98 114.306 114.306 122.863 -8.557 25153 18331 1 20 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.726 -0.236 25153 18332 1 20 . 1 1 98 98 LEU C C 98 179.365 179.365 177.182 2.183 25153 18333 1 20 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.430 0.030 25153 18334 1 20 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.561 -0.331 25153 18335 1 20 . 1 1 98 98 LEU H H 98 7.453 7.453 8.857 -1.404 25153 18336 1 20 . 1 1 99 99 ASP N N 99 122.354 122.354 121.096 1.258 25153 18337 1 20 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.389 -0.456 25153 18338 1 20 . 1 1 99 99 ASP C C 99 178.800 178.800 177.374 1.426 25153 18339 1 20 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.723 1.457 25153 18340 1 20 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.381 -0.951 25153 18341 1 20 . 1 1 100 100 ALA N N 100 118.568 118.568 121.572 -3.004 25153 18342 1 20 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.095 -0.255 25153 18343 1 20 . 1 1 100 100 ALA C C 100 178.500 178.500 179.065 -0.565 25153 18344 1 20 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.133 -0.216 25153 18345 1 20 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.576 1.084 25153 18346 1 20 . 1 1 100 100 ALA H H 100 8.682 8.682 7.898 0.784 25153 18347 1 20 . 1 1 101 101 LEU N N 101 118.815 118.815 120.604 -1.789 25153 18348 1 20 . 1 1 101 101 LEU HA H 101 3.680 3.680 4.015 -0.335 25153 18349 1 20 . 1 1 101 101 LEU C C 101 178.930 178.930 178.851 0.079 25153 18350 1 20 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.847 -0.147 25153 18351 1 20 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.579 0.821 25153 18352 1 20 . 1 1 101 101 LEU H H 101 6.637 6.637 7.409 -0.772 25153 18353 1 20 . 1 1 102 102 GLY N N 102 103.700 103.700 106.372 -2.672 25153 18354 1 20 . 1 1 102 102 GLY C C 102 175.530 175.530 176.125 -0.595 25153 18355 1 20 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.302 0.698 25153 18356 1 20 . 1 1 102 102 GLY H H 102 7.330 7.330 7.854 -0.524 25153 18357 1 20 . 1 1 103 103 MET N N 103 120.330 120.330 121.668 -1.338 25153 18358 1 20 . 1 1 103 103 MET HA H 103 4.254 4.254 4.261 -0.007 25153 18359 1 20 . 1 1 103 103 MET C C 103 179.688 179.688 178.655 1.033 25153 18360 1 20 . 1 1 103 103 MET CA C 103 59.615 59.615 59.617 -0.002 25153 18361 1 20 . 1 1 103 103 MET CB C 103 33.290 33.290 32.613 0.677 25153 18362 1 20 . 1 1 103 103 MET H H 103 8.407 8.407 7.907 0.500 25153 18363 1 20 . 1 1 104 104 LEU N N 104 123.450 123.450 119.876 3.574 25153 18364 1 20 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.721 0.475 25153 18365 1 20 . 1 1 104 104 LEU C C 104 177.620 177.620 178.761 -1.141 25153 18366 1 20 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.978 -0.008 25153 18367 1 20 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.282 0.018 25153 18368 1 20 . 1 1 104 104 LEU H H 104 8.330 8.330 8.767 -0.437 25153 18369 1 20 . 1 1 105 105 HIS N N 105 119.040 119.040 119.285 -0.245 25153 18370 1 20 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.054 -0.177 25153 18371 1 20 . 1 1 105 105 HIS C C 105 177.100 177.100 177.024 0.076 25153 18372 1 20 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.834 0.136 25153 18373 1 20 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.827 -1.234 25153 18374 1 20 . 1 1 105 105 HIS H H 105 8.050 8.050 8.407 -0.357 25153 18375 1 20 . 1 1 106 106 ASP N N 106 119.950 119.950 119.131 0.819 25153 18376 1 20 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.381 -0.051 25153 18377 1 20 . 1 1 106 106 ASP C C 106 179.300 179.300 178.405 0.895 25153 18378 1 20 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.283 0.527 25153 18379 1 20 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.154 -0.754 25153 18380 1 20 . 1 1 107 107 LYS N N 107 122.060 122.060 119.983 2.077 25153 18381 1 20 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.057 0.076 25153 18382 1 20 . 1 1 107 107 LYS C C 107 178.100 178.100 179.463 -1.363 25153 18383 1 20 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.700 -0.500 25153 18384 1 20 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.152 0.208 25153 18385 1 20 . 1 1 108 108 LEU N N 108 115.610 115.610 117.882 -2.272 25153 18386 1 20 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.146 -0.078 25153 18387 1 20 . 1 1 108 108 LEU C C 108 178.866 178.866 178.262 0.604 25153 18388 1 20 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.831 -0.877 25153 18389 1 20 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.563 0.597 25153 18390 1 20 . 1 1 108 108 LEU H H 108 7.828 7.828 8.488 -0.660 25153 18391 1 20 . 1 1 109 109 SER N N 109 116.362 116.362 115.226 1.136 25153 18392 1 20 . 1 1 109 109 SER HA H 109 4.299 4.299 4.308 -0.009 25153 18393 1 20 . 1 1 109 109 SER C C 109 175.660 175.660 176.841 -1.181 25153 18394 1 20 . 1 1 109 109 SER CA C 109 62.350 62.350 61.323 1.027 25153 18395 1 20 . 1 1 109 109 SER CB C 109 62.815 62.815 63.076 -0.261 25153 18396 1 20 . 1 1 109 109 SER H H 109 8.278 8.278 8.583 -0.305 25153 18397 1 20 . 1 1 110 110 THR N N 110 110.230 110.230 116.325 -6.095 25153 18398 1 20 . 1 1 110 110 THR HA H 110 4.615 4.615 4.258 0.357 25153 18399 1 20 . 1 1 110 110 THR C C 110 175.990 175.990 175.469 0.521 25153 18400 1 20 . 1 1 110 110 THR CA C 110 62.090 62.090 64.535 -2.445 25153 18401 1 20 . 1 1 110 110 THR CB C 110 68.800 68.800 68.798 0.002 25153 18402 1 20 . 1 1 110 110 THR H H 110 7.211 7.211 7.834 -0.623 25153 18403 1 20 . 1 1 111 111 LYS N N 111 119.900 119.900 119.579 0.321 25153 18404 1 20 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.374 0.138 25153 18405 1 20 . 1 1 111 111 LYS C C 111 176.916 176.916 176.401 0.515 25153 18406 1 20 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.327 0.327 25153 18407 1 20 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.231 -1.388 25153 18408 1 20 . 1 1 112 112 GLY N N 112 107.910 107.910 108.270 -0.360 25153 18409 1 20 . 1 1 112 112 GLY C C 112 176.250 176.250 174.152 2.098 25153 18410 1 20 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.672 1.367 25153 18411 1 20 . 1 1 112 112 GLY H H 112 8.366 8.366 7.535 0.831 25153 18412 1 20 . 1 1 113 113 VAL N N 113 113.530 113.530 116.692 -3.162 25153 18413 1 20 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.496 -0.022 25153 18414 1 20 . 1 1 113 113 VAL C C 113 174.630 174.630 174.726 -0.096 25153 18415 1 20 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.270 -0.820 25153 18416 1 20 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.749 -0.199 25153 18417 1 20 . 1 1 113 113 VAL H H 113 6.903 6.903 6.996 -0.093 25153 18418 1 20 . 1 1 114 114 LYS N N 114 123.020 123.020 119.401 3.619 25153 18419 1 20 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.478 0.027 25153 18420 1 20 . 1 1 114 114 LYS C C 114 175.000 175.000 174.689 0.311 25153 18421 1 20 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.497 -0.297 25153 18422 1 20 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.534 -1.194 25153 18423 1 20 . 1 1 115 115 PHE N N 115 123.290 123.290 120.161 3.129 25153 18424 1 20 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.713 0.000 25153 18425 1 20 . 1 1 115 115 PHE C C 115 177.605 177.605 176.337 1.268 25153 18426 1 20 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.700 1.910 25153 18427 1 20 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.935 -0.935 25153 18428 1 20 . 1 1 115 115 PHE H H 115 8.494 8.494 8.450 0.044 25153 18429 1 20 . 1 1 116 116 VAL N N 116 115.790 115.790 115.455 0.335 25153 18430 1 20 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.224 0.268 25153 18431 1 20 . 1 1 116 116 VAL C C 116 175.414 175.414 175.956 -0.542 25153 18432 1 20 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.438 -0.452 25153 18433 1 20 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.444 -0.344 25153 18434 1 20 . 1 1 116 116 VAL H H 116 8.889 8.889 8.438 0.451 25153 18435 1 20 . 1 1 117 117 GLY N N 117 108.300 108.300 107.879 0.421 25153 18436 1 20 . 1 1 117 117 GLY C C 117 176.180 176.180 174.739 1.441 25153 18437 1 20 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.535 2.265 25153 18438 1 20 . 1 1 117 117 GLY H H 117 9.810 9.810 8.630 1.180 25153 18439 1 20 . 1 1 118 118 TYR N N 118 120.050 120.050 119.548 0.502 25153 18440 1 20 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.767 0.187 25153 18441 1 20 . 1 1 118 118 TYR C C 118 177.450 177.450 175.951 1.499 25153 18442 1 20 . 1 1 118 118 TYR CA C 118 56.240 56.240 57.493 -1.253 25153 18443 1 20 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.086 -2.975 25153 18444 1 20 . 1 1 118 118 TYR H H 118 8.592 8.592 7.439 1.153 25153 18445 1 20 . 1 1 119 119 TRP N N 119 125.500 125.500 121.468 4.032 25153 18446 1 20 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.098 0.930 25153 18447 1 20 . 1 1 119 119 TRP C C 119 173.090 173.090 174.160 -1.070 25153 18448 1 20 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.352 -0.452 25153 18449 1 20 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.026 3.224 25153 18450 1 20 . 1 1 119 119 TRP H H 119 7.926 7.926 8.159 -0.233 25153 18451 1 20 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.769 0.041 25153 18452 1 20 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.755 0.925 25153 18453 1 20 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.624 -0.374 25153 18454 1 20 . 1 1 121 121 THR N N 121 109.114 109.114 111.860 -2.746 25153 18455 1 20 . 1 1 121 121 THR HA H 121 4.142 4.142 3.415 0.727 25153 18456 1 20 . 1 1 121 121 THR C C 121 176.300 176.300 175.290 1.010 25153 18457 1 20 . 1 1 121 121 THR CA C 121 61.230 61.230 63.029 -1.799 25153 18458 1 20 . 1 1 121 121 THR CB C 121 69.890 69.890 68.225 1.665 25153 18459 1 20 . 1 1 121 121 THR H H 121 7.356 7.356 8.327 -0.971 25153 18460 1 20 . 1 1 122 122 GLU N N 122 123.980 123.980 122.006 1.974 25153 18461 1 20 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.053 0.185 25153 18462 1 20 . 1 1 122 122 GLU C C 122 177.830 177.830 177.832 -0.002 25153 18463 1 20 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.487 0.743 25153 18464 1 20 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.587 0.183 25153 18465 1 20 . 1 1 123 123 GLY N N 123 114.570 114.570 112.030 2.540 25153 18466 1 20 . 1 1 123 123 GLY C C 123 173.700 173.700 173.650 0.050 25153 18467 1 20 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.612 -0.212 25153 18468 1 20 . 1 1 123 123 GLY H H 123 9.181 9.181 8.898 0.283 25153 18469 1 20 . 1 1 124 124 TYR N N 124 118.923 118.923 119.258 -0.335 25153 18470 1 20 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.881 0.429 25153 18471 1 20 . 1 1 124 124 TYR C C 124 175.680 175.680 174.089 1.591 25153 18472 1 20 . 1 1 124 124 TYR CA C 124 56.470 56.470 57.096 -0.626 25153 18473 1 20 . 1 1 124 124 TYR CB C 124 41.000 41.000 42.296 -1.296 25153 18474 1 20 . 1 1 124 124 TYR H H 124 7.877 7.877 7.629 0.248 25153 18475 1 20 . 1 1 125 125 GLU N N 125 124.890 124.890 121.589 3.301 25153 18476 1 20 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.704 -0.004 25153 18477 1 20 . 1 1 125 125 GLU C C 125 172.880 172.880 175.128 -2.248 25153 18478 1 20 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.729 -0.299 25153 18479 1 20 . 1 1 125 125 GLU CB C 125 31.420 31.420 32.244 -0.824 25153 18480 1 20 . 1 1 126 126 PHE N N 126 119.166 119.166 120.022 -0.856 25153 18481 1 20 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.807 0.002 25153 18482 1 20 . 1 1 126 126 PHE C C 126 173.750 173.750 174.359 -0.609 25153 18483 1 20 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.435 -1.645 25153 18484 1 20 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.135 0.915 25153 18485 1 20 . 1 1 126 126 PHE H H 126 7.716 7.716 8.017 -0.301 25153 18486 1 20 . 1 1 127 127 THR N N 127 106.800 106.800 115.970 -9.170 25153 18487 1 20 . 1 1 127 127 THR HA H 127 4.400 4.400 3.152 1.248 25153 18488 1 20 . 1 1 127 127 THR C C 127 175.300 175.300 174.185 1.115 25153 18489 1 20 . 1 1 127 127 THR CA C 127 61.100 61.100 63.089 -1.989 25153 18490 1 20 . 1 1 127 127 THR CB C 127 70.600 70.600 68.112 2.488 25153 18491 1 20 . 1 1 127 127 THR H H 127 7.220 7.220 6.202 1.018 25153 18492 1 20 . 1 1 128 128 SER N N 128 118.360 118.360 115.358 3.002 25153 18493 1 20 . 1 1 128 128 SER HA H 128 4.680 4.680 4.650 0.030 25153 18494 1 20 . 1 1 128 128 SER C C 128 175.720 175.720 173.822 1.898 25153 18495 1 20 . 1 1 128 128 SER CA C 128 56.250 56.250 57.105 -0.855 25153 18496 1 20 . 1 1 128 128 SER CB C 128 65.635 65.635 63.521 2.114 25153 18497 1 20 . 1 1 128 128 SER H H 128 7.411 7.411 7.642 -0.231 25153 18498 1 20 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.590 0.185 25153 18499 1 20 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.339 -1.839 25153 18500 1 20 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.321 0.079 25153 18501 1 20 . 1 1 130 130 LYS N N 130 122.014 122.014 119.716 2.298 25153 18502 1 20 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.339 -0.106 25153 18503 1 20 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.587 3.114 25153 18504 1 20 . 1 1 130 130 LYS CB C 130 30.570 30.570 31.160 -0.590 25153 18505 1 20 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.561 -0.043 25153 18506 1 20 . 1 1 131 131 PRO C C 131 174.000 174.000 175.050 -1.050 25153 18507 1 20 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.237 2.463 25153 18508 1 20 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.135 1.065 25153 18509 1 20 . 1 1 132 132 VAL N N 132 113.260 113.260 117.215 -3.955 25153 18510 1 20 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.816 0.384 25153 18511 1 20 . 1 1 132 132 VAL C C 132 175.210 175.210 174.899 0.311 25153 18512 1 20 . 1 1 132 132 VAL CA C 132 59.620 59.620 59.896 -0.276 25153 18513 1 20 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.827 -0.847 25153 18514 1 20 . 1 1 132 132 VAL H H 132 6.697 6.697 7.548 -0.851 25153 18515 1 20 . 1 1 133 133 ILE N N 133 119.940 119.940 117.374 2.566 25153 18516 1 20 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.456 -0.076 25153 18517 1 20 . 1 1 133 133 ILE C C 133 175.440 175.440 175.182 0.258 25153 18518 1 20 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.925 1.525 25153 18519 1 20 . 1 1 133 133 ILE CB C 133 42.100 42.100 39.912 2.188 25153 18520 1 20 . 1 1 133 133 ILE H H 133 8.756 8.756 8.640 0.116 25153 18521 1 20 . 1 1 134 134 ALA N N 134 122.632 122.632 123.881 -1.249 25153 18522 1 20 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.893 0.067 25153 18523 1 20 . 1 1 134 134 ALA C C 134 178.312 178.312 177.220 1.092 25153 18524 1 20 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.575 -1.495 25153 18525 1 20 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.215 -0.379 25153 18526 1 20 . 1 1 134 134 ALA H H 134 8.523 8.523 8.463 0.060 25153 18527 1 20 . 1 1 135 135 ASP N N 135 117.366 117.366 122.697 -5.331 25153 18528 1 20 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.656 -0.404 25153 18529 1 20 . 1 1 135 135 ASP C C 135 176.387 176.387 176.640 -0.253 25153 18530 1 20 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.350 1.860 25153 18531 1 20 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.252 -1.552 25153 18532 1 20 . 1 1 136 136 GLY N N 136 104.310 104.310 108.052 -3.742 25153 18533 1 20 . 1 1 136 136 GLY C C 136 174.922 174.922 174.895 0.027 25153 18534 1 20 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.358 -0.258 25153 18535 1 20 . 1 1 136 136 GLY H H 136 7.610 7.610 8.298 -0.688 25153 18536 1 20 . 1 1 137 137 GLN N N 137 118.784 118.784 117.639 1.145 25153 18537 1 20 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.409 -0.354 25153 18538 1 20 . 1 1 137 137 GLN C C 137 176.390 176.390 175.399 0.991 25153 18539 1 20 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.786 1.853 25153 18540 1 20 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.232 -0.002 25153 18541 1 20 . 1 1 137 137 GLN H H 137 7.870 7.870 7.850 0.020 25153 18542 1 20 . 1 1 138 138 LEU N N 138 118.040 118.040 115.828 2.212 25153 18543 1 20 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.025 -0.038 25153 18544 1 20 . 1 1 138 138 LEU C C 138 175.913 175.913 175.046 0.867 25153 18545 1 20 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.170 0.430 25153 18546 1 20 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.901 1.499 25153 18547 1 20 . 1 1 138 138 LEU H H 138 7.356 7.356 7.160 0.196 25153 18548 1 20 . 1 1 139 139 PHE N N 139 119.060 119.060 119.115 -0.055 25153 18549 1 20 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.862 0.448 25153 18550 1 20 . 1 1 139 139 PHE C C 139 178.780 178.780 177.648 1.132 25153 18551 1 20 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.347 -0.497 25153 18552 1 20 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.832 3.628 25153 18553 1 20 . 1 1 139 139 PHE H H 139 10.094 10.094 8.907 1.187 25153 18554 1 20 . 1 1 140 140 VAL N N 140 109.690 109.690 115.126 -5.436 25153 18555 1 20 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.442 0.039 25153 18556 1 20 . 1 1 140 140 VAL C C 140 172.790 172.790 175.608 -2.818 25153 18557 1 20 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.964 -1.964 25153 18558 1 20 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.455 -0.905 25153 18559 1 20 . 1 1 140 140 VAL H H 140 7.470 7.470 8.062 -0.592 25153 18560 1 20 . 1 1 141 141 GLY N N 141 107.060 107.060 105.183 1.877 25153 18561 1 20 . 1 1 141 141 GLY C C 141 171.513 171.513 172.558 -1.045 25153 18562 1 20 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.327 1.103 25153 18563 1 20 . 1 1 141 141 GLY H H 141 7.137 7.137 7.335 -0.198 25153 18564 1 20 . 1 1 142 142 LEU N N 142 117.863 117.863 120.748 -2.885 25153 18565 1 20 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.064 -1.089 25153 18566 1 20 . 1 1 142 142 LEU C C 142 173.640 173.640 175.100 -1.460 25153 18567 1 20 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.706 1.214 25153 18568 1 20 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.051 -4.501 25153 18569 1 20 . 1 1 142 142 LEU H H 142 7.517 7.517 7.814 -0.297 25153 18570 1 20 . 1 1 143 143 ALA N N 143 126.990 126.990 129.190 -2.200 25153 18571 1 20 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.467 -0.190 25153 18572 1 20 . 1 1 143 143 ALA C C 143 175.730 175.730 175.786 -0.056 25153 18573 1 20 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.286 -0.846 25153 18574 1 20 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.546 3.764 25153 18575 1 20 . 1 1 143 143 ALA H H 143 5.186 5.186 8.164 -2.978 25153 18576 1 20 . 1 1 144 144 LEU N N 144 125.477 125.477 123.870 1.607 25153 18577 1 20 . 1 1 144 144 LEU HA H 144 4.780 4.780 5.082 -0.302 25153 18578 1 20 . 1 1 144 144 LEU C C 144 174.473 174.473 175.582 -1.109 25153 18579 1 20 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.402 -0.162 25153 18580 1 20 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.863 -0.563 25153 18581 1 20 . 1 1 144 144 LEU H H 144 8.758 8.758 8.389 0.369 25153 18582 1 20 . 1 1 145 145 ASP N N 145 118.915 118.915 119.380 -0.465 25153 18583 1 20 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.403 0.129 25153 18584 1 20 . 1 1 145 145 ASP C C 145 176.470 176.470 175.840 0.630 25153 18585 1 20 . 1 1 145 145 ASP CA C 145 52.630 52.630 53.185 -0.555 25153 18586 1 20 . 1 1 145 145 ASP CB C 145 43.000 43.000 44.415 -1.415 25153 18587 1 20 . 1 1 146 146 GLU N N 146 124.813 124.813 124.745 0.068 25153 18588 1 20 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.726 -0.350 25153 18589 1 20 . 1 1 146 146 GLU C C 146 177.290 177.290 176.479 0.811 25153 18590 1 20 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.632 0.488 25153 18591 1 20 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.942 0.207 25153 18592 1 20 . 1 1 147 147 THR N N 147 118.328 118.328 113.461 4.867 25153 18593 1 20 . 1 1 147 147 THR HA H 147 4.200 4.200 4.602 -0.402 25153 18594 1 20 . 1 1 147 147 THR C C 147 175.683 175.683 174.087 1.596 25153 18595 1 20 . 1 1 147 147 THR CA C 147 66.250 66.250 63.222 3.028 25153 18596 1 20 . 1 1 147 147 THR CB C 147 69.600 69.600 70.333 -0.733 25153 18597 1 20 . 1 1 147 147 THR H H 147 8.562 8.562 8.524 0.038 25153 18598 1 20 . 1 1 148 148 ASN N N 148 115.550 115.550 116.915 -1.365 25153 18599 1 20 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.703 0.284 25153 18600 1 20 . 1 1 148 148 ASN C C 148 175.870 175.870 176.724 -0.854 25153 18601 1 20 . 1 1 148 148 ASN CA C 148 53.700 53.700 53.569 0.131 25153 18602 1 20 . 1 1 148 148 ASN CB C 148 41.880 41.880 40.006 1.874 25153 18603 1 20 . 1 1 148 148 ASN H H 148 9.118 9.118 8.877 0.240 25153 18604 1 20 . 1 1 149 149 GLN N N 149 117.400 117.400 119.718 -2.318 25153 18605 1 20 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.259 0.584 25153 18606 1 20 . 1 1 149 149 GLN C C 149 177.780 177.780 176.827 0.953 25153 18607 1 20 . 1 1 149 149 GLN CA C 149 53.900 53.900 56.046 -2.146 25153 18608 1 20 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.113 1.187 25153 18609 1 20 . 1 1 149 149 GLN H H 149 7.555 7.555 8.903 -1.348 25153 18610 1 20 . 1 1 150 150 TYR N N 150 120.674 120.674 117.899 2.775 25153 18611 1 20 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.267 0.261 25153 18612 1 20 . 1 1 150 150 TYR C C 150 177.830 177.830 176.235 1.595 25153 18613 1 20 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.471 0.016 25153 18614 1 20 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.628 -0.028 25153 18615 1 20 . 1 1 150 150 TYR H H 150 6.983 6.983 7.836 -0.853 25153 18616 1 20 . 1 1 151 151 ASP N N 151 120.810 120.810 119.596 1.214 25153 18617 1 20 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.656 -0.141 25153 18618 1 20 . 1 1 151 151 ASP C C 151 176.400 176.400 177.223 -0.823 25153 18619 1 20 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.942 -0.542 25153 18620 1 20 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.448 -2.368 25153 18621 1 20 . 1 1 152 152 LEU N N 152 118.083 118.083 113.431 4.652 25153 18622 1 20 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.664 0.012 25153 18623 1 20 . 1 1 152 152 LEU C C 152 178.470 178.470 178.264 0.206 25153 18624 1 20 . 1 1 152 152 LEU CA C 152 54.600 54.600 56.061 -1.461 25153 18625 1 20 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.127 -0.527 25153 18626 1 20 . 1 1 152 152 LEU H H 152 7.453 7.453 7.671 -0.218 25153 18627 1 20 . 1 1 153 153 SER N N 153 116.407 116.407 118.614 -2.207 25153 18628 1 20 . 1 1 153 153 SER HA H 153 3.960 3.960 4.010 -0.050 25153 18629 1 20 . 1 1 153 153 SER C C 153 174.590 174.590 175.621 -1.031 25153 18630 1 20 . 1 1 153 153 SER CA C 153 63.400 63.400 63.339 0.061 25153 18631 1 20 . 1 1 153 153 SER CB C 153 63.100 63.100 62.947 0.153 25153 18632 1 20 . 1 1 153 153 SER H H 153 7.360 7.360 8.621 -1.261 25153 18633 1 20 . 1 1 154 154 ASP N N 154 121.960 121.960 120.667 1.293 25153 18634 1 20 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.317 -0.007 25153 18635 1 20 . 1 1 154 154 ASP C C 154 178.640 178.640 177.712 0.928 25153 18636 1 20 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.167 1.833 25153 18637 1 20 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.953 -1.383 25153 18638 1 20 . 1 1 155 155 GLU N N 155 121.310 121.310 117.993 3.317 25153 18639 1 20 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.058 0.127 25153 18640 1 20 . 1 1 155 155 GLU C C 155 179.600 179.600 178.792 0.808 25153 18641 1 20 . 1 1 155 155 GLU CA C 155 59.450 59.450 58.916 0.534 25153 18642 1 20 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.523 -0.123 25153 18643 1 20 . 1 1 156 156 ARG N N 156 121.394 121.394 118.973 2.421 25153 18644 1 20 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.244 0.056 25153 18645 1 20 . 1 1 156 156 ARG C C 156 177.330 177.330 178.647 -1.317 25153 18646 1 20 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.288 2.172 25153 18647 1 20 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.309 0.451 25153 18648 1 20 . 1 1 157 157 ILE N N 157 118.390 118.390 121.285 -2.895 25153 18649 1 20 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.740 -0.306 25153 18650 1 20 . 1 1 157 157 ILE C C 157 178.814 178.814 177.734 1.080 25153 18651 1 20 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.695 0.999 25153 18652 1 20 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.812 1.040 25153 18653 1 20 . 1 1 157 157 ILE H H 157 8.966 8.966 7.588 1.378 25153 18654 1 20 . 1 1 158 158 GLN N N 158 120.060 120.060 118.609 1.451 25153 18655 1 20 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.978 -0.022 25153 18656 1 20 . 1 1 158 158 GLN C C 158 178.843 178.843 178.960 -0.117 25153 18657 1 20 . 1 1 158 158 GLN CA C 158 60.600 60.600 58.917 1.683 25153 18658 1 20 . 1 1 158 158 GLN CB C 158 28.390 28.390 27.892 0.498 25153 18659 1 20 . 1 1 158 158 GLN H H 158 8.394 8.394 7.877 0.517 25153 18660 1 20 . 1 1 159 159 SER N N 159 115.613 115.613 115.812 -0.199 25153 18661 1 20 . 1 1 159 159 SER HA H 159 4.455 4.455 4.497 -0.042 25153 18662 1 20 . 1 1 159 159 SER C C 159 177.330 177.330 176.766 0.564 25153 18663 1 20 . 1 1 159 159 SER CA C 159 62.400 62.400 61.025 1.375 25153 18664 1 20 . 1 1 159 159 SER CB C 159 63.760 63.760 63.386 0.373 25153 18665 1 20 . 1 1 159 159 SER H H 159 8.460 8.460 7.777 0.683 25153 18666 1 20 . 1 1 160 160 TRP N N 160 126.820 126.820 125.012 1.808 25153 18667 1 20 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.113 0.352 25153 18668 1 20 . 1 1 160 160 TRP C C 160 178.050 178.050 177.497 0.553 25153 18669 1 20 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.873 0.827 25153 18670 1 20 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.348 0.012 25153 18671 1 20 . 1 1 160 160 TRP H H 160 9.318 9.318 8.408 0.910 25153 18672 1 20 . 1 1 161 161 CYS N N 161 116.750 116.750 117.820 -1.070 25153 18673 1 20 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.760 0.123 25153 18674 1 20 . 1 1 161 161 CYS C C 161 176.270 176.270 176.731 -0.461 25153 18675 1 20 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.246 1.114 25153 18676 1 20 . 1 1 161 161 CYS CB C 161 27.880 27.880 27.100 0.780 25153 18677 1 20 . 1 1 161 161 CYS H H 161 8.950 8.950 9.024 -0.074 25153 18678 1 20 . 1 1 162 162 GLU N N 162 118.096 118.096 119.936 -1.840 25153 18679 1 20 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.021 -0.091 25153 18680 1 20 . 1 1 162 162 GLU C C 162 178.680 178.680 177.447 1.233 25153 18681 1 20 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.058 0.672 25153 18682 1 20 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.344 0.086 25153 18683 1 20 . 1 1 163 163 GLN N N 163 120.790 120.790 117.692 3.098 25153 18684 1 20 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.120 0.057 25153 18685 1 20 . 1 1 163 163 GLN C C 163 179.690 179.690 178.242 1.448 25153 18686 1 20 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.713 1.827 25153 18687 1 20 . 1 1 163 163 GLN CB C 163 29.000 29.000 29.165 -0.165 25153 18688 1 20 . 1 1 163 163 GLN H H 163 8.205 8.205 7.511 0.694 25153 18689 1 20 . 1 1 164 164 ILE N N 164 114.860 114.860 118.910 -4.050 25153 18690 1 20 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.857 0.186 25153 18691 1 20 . 1 1 164 164 ILE C C 164 178.680 178.680 177.230 1.450 25153 18692 1 20 . 1 1 164 164 ILE CA C 164 66.210 66.210 63.996 2.214 25153 18693 1 20 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.623 0.077 25153 18694 1 20 . 1 1 164 164 ILE H H 164 9.005 9.005 8.046 0.959 25153 18695 1 20 . 1 1 165 165 LEU N N 165 123.900 123.900 117.026 6.874 25153 18696 1 20 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.201 -0.051 25153 18697 1 20 . 1 1 165 165 LEU C C 165 180.520 180.520 177.568 2.952 25153 18698 1 20 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.083 1.217 25153 18699 1 20 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.092 -0.042 25153 18700 1 20 . 1 1 165 165 LEU H H 165 7.825 7.825 7.909 -0.084 25153 18701 1 20 . 1 1 166 166 ASN N N 166 120.112 120.112 118.110 2.002 25153 18702 1 20 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.638 -0.055 25153 18703 1 20 . 1 1 166 166 ASN C C 166 178.440 178.440 177.146 1.294 25153 18704 1 20 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.417 1.003 25153 18705 1 20 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.598 -1.178 25153 18706 1 20 . 1 1 166 166 ASN H H 166 7.760 7.760 7.976 -0.216 25153 18707 1 20 . 1 1 167 167 GLU N N 167 121.370 121.370 120.730 0.640 25153 18708 1 20 . 1 1 167 167 GLU HA H 167 4.103 4.103 3.991 0.112 25153 18709 1 20 . 1 1 167 167 GLU C C 167 180.332 180.332 179.005 1.327 25153 18710 1 20 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.293 0.857 25153 18711 1 20 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.525 1.495 25153 18712 1 20 . 1 1 168 168 MET N N 168 118.532 118.532 116.942 1.590 25153 18713 1 20 . 1 1 168 168 MET HA H 168 4.015 4.015 4.374 -0.359 25153 18714 1 20 . 1 1 168 168 MET C C 168 176.600 176.600 177.869 -1.269 25153 18715 1 20 . 1 1 168 168 MET CA C 168 59.300 59.300 58.967 0.333 25153 18716 1 20 . 1 1 168 168 MET CB C 168 33.400 33.400 33.154 0.246 25153 18717 1 20 . 1 1 168 168 MET H H 168 8.718 8.718 8.193 0.525 25153 18718 1 20 . 1 1 169 169 ALA N N 169 121.922 121.922 121.931 -0.009 25153 18719 1 20 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.288 -0.114 25153 18720 1 20 . 1 1 169 169 ALA C C 169 179.410 179.410 179.441 -0.031 25153 18721 1 20 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.468 -0.068 25153 18722 1 20 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.682 -0.272 25153 18723 1 20 . 1 1 169 169 ALA H H 169 7.448 7.448 7.855 -0.407 25153 18724 1 20 . 1 1 170 170 GLU N N 170 117.300 117.300 116.483 0.817 25153 18725 1 20 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.125 -0.030 25153 18726 1 20 . 1 1 170 170 GLU C C 170 177.470 177.470 178.811 -1.341 25153 18727 1 20 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.408 -0.459 25153 18728 1 20 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.490 0.285 25153 18729 1 20 . 1 1 171 171 HIS N N 171 117.944 117.944 119.129 -1.185 25153 18730 1 20 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.319 0.181 25153 18731 1 20 . 1 1 171 171 HIS C C 171 175.120 175.120 176.663 -1.543 25153 18732 1 20 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.796 -1.596 25153 18733 1 20 . 1 1 171 171 HIS CB C 171 30.600 30.600 29.691 0.909 25153 18734 1 20 . 1 1 171 171 HIS H H 171 7.788 7.788 7.912 -0.124 25153 18735 1 20 . 1 1 172 172 TYR N N 172 120.040 120.040 118.341 1.699 25153 18736 1 20 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.266 0.327 25153 18737 1 20 . 1 1 172 172 TYR C C 172 174.612 174.612 175.768 -1.156 25153 18738 1 20 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.180 -0.200 25153 18739 1 20 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.455 0.525 25153 18740 1 20 . 1 1 172 172 TYR H H 172 7.820 7.820 7.751 0.069 25153 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 165 3.306 -0.477 3.281 25153 2 1 1 "Average Difference" HA 186 0.454 -0.005 0.455 25153 3 1 1 "Average Difference" C 168 1.218 -0.005 1.222 25153 4 1 1 "Average Difference" CA 171 1.226 -0.109 1.225 25153 5 1 1 "Average Difference" CB 155 1.297 -0.079 1.298 25153 6 1 1 "Average Difference" HN 123 0.840 0.014 0.843 25153 7 1 2 "Average Difference" N 165 3.109 -0.431 3.088 25153 8 1 2 "Average Difference" HA 186 0.454 -0.001 0.455 25153 9 1 2 "Average Difference" C 168 1.211 0.003 1.215 25153 10 1 2 "Average Difference" CA 171 1.268 -0.129 1.265 25153 11 1 2 "Average Difference" CB 155 1.316 -0.123 1.314 25153 12 1 2 "Average Difference" HN 123 0.882 0.006 0.885 25153 13 1 3 "Average Difference" N 165 3.220 -0.428 3.201 25153 14 1 3 "Average Difference" HA 186 0.465 -0.008 0.466 25153 15 1 3 "Average Difference" C 168 1.211 -0.013 1.215 25153 16 1 3 "Average Difference" CA 171 1.274 -0.144 1.269 25153 17 1 3 "Average Difference" CB 155 1.259 -0.078 1.261 25153 18 1 3 "Average Difference" HN 123 0.880 0.018 0.883 25153 19 1 4 "Average Difference" N 165 3.128 -0.352 3.118 25153 20 1 4 "Average Difference" HA 186 0.453 -0.002 0.454 25153 21 1 4 "Average Difference" C 168 1.176 0.009 1.180 25153 22 1 4 "Average Difference" CA 171 1.262 -0.173 1.254 25153 23 1 4 "Average Difference" CB 155 1.260 -0.098 1.260 25153 24 1 4 "Average Difference" HN 123 0.863 0.017 0.867 25153 25 1 5 "Average Difference" N 165 3.247 -0.436 3.227 25153 26 1 5 "Average Difference" HA 186 0.452 -0.002 0.453 25153 27 1 5 "Average Difference" C 168 1.204 -0.013 1.208 25153 28 1 5 "Average Difference" CA 171 1.243 -0.147 1.238 25153 29 1 5 "Average Difference" CB 155 1.335 -0.095 1.336 25153 30 1 5 "Average Difference" HN 123 0.877 0.041 0.879 25153 31 1 6 "Average Difference" N 165 3.090 -0.400 3.074 25153 32 1 6 "Average Difference" HA 186 0.472 -0.018 0.473 25153 33 1 6 "Average Difference" C 168 1.211 0.044 1.213 25153 34 1 6 "Average Difference" CA 171 1.231 -0.126 1.228 25153 35 1 6 "Average Difference" CB 155 1.259 -0.101 1.259 25153 36 1 6 "Average Difference" HN 123 0.857 0.021 0.861 25153 37 1 7 "Average Difference" N 165 3.238 -0.570 3.197 25153 38 1 7 "Average Difference" HA 186 0.452 0.008 0.453 25153 39 1 7 "Average Difference" C 168 1.218 -0.037 1.221 25153 40 1 7 "Average Difference" CA 171 1.223 -0.146 1.217 25153 41 1 7 "Average Difference" CB 155 1.282 -0.032 1.286 25153 42 1 7 "Average Difference" HN 123 0.855 0.021 0.858 25153 43 1 8 "Average Difference" N 165 3.216 -0.403 3.201 25153 44 1 8 "Average Difference" HA 186 0.452 -0.011 0.453 25153 45 1 8 "Average Difference" C 168 1.198 0.006 1.202 25153 46 1 8 "Average Difference" CA 171 1.226 -0.111 1.224 25153 47 1 8 "Average Difference" CB 155 1.265 -0.133 1.262 25153 48 1 8 "Average Difference" HN 123 0.871 0.042 0.874 25153 49 1 9 "Average Difference" N 165 3.219 -0.379 3.206 25153 50 1 9 "Average Difference" HA 186 0.439 -0.007 0.440 25153 51 1 9 "Average Difference" C 168 1.183 0.042 1.186 25153 52 1 9 "Average Difference" CA 171 1.238 -0.113 1.237 25153 53 1 9 "Average Difference" CB 155 1.273 -0.097 1.273 25153 54 1 9 "Average Difference" HN 123 0.889 0.030 0.892 25153 55 1 10 "Average Difference" N 165 3.286 -0.427 3.268 25153 56 1 10 "Average Difference" HA 186 0.440 -0.007 0.441 25153 57 1 10 "Average Difference" C 168 1.181 -0.012 1.184 25153 58 1 10 "Average Difference" CA 171 1.260 -0.160 1.254 25153 59 1 10 "Average Difference" CB 155 1.249 -0.087 1.250 25153 60 1 10 "Average Difference" HN 123 0.864 0.007 0.867 25153 61 1 11 "Average Difference" N 165 3.318 -0.456 3.296 25153 62 1 11 "Average Difference" HA 186 0.445 -0.015 0.446 25153 63 1 11 "Average Difference" C 168 1.210 0.007 1.214 25153 64 1 11 "Average Difference" CA 171 1.251 -0.094 1.251 25153 65 1 11 "Average Difference" CB 155 1.265 -0.127 1.263 25153 66 1 11 "Average Difference" HN 123 0.873 0.054 0.875 25153 67 1 12 "Average Difference" N 165 3.191 -0.413 3.174 25153 68 1 12 "Average Difference" HA 186 0.458 -0.013 0.459 25153 69 1 12 "Average Difference" C 168 1.222 0.019 1.226 25153 70 1 12 "Average Difference" CA 171 1.245 -0.064 1.247 25153 71 1 12 "Average Difference" CB 155 1.301 -0.107 1.301 25153 72 1 12 "Average Difference" HN 123 0.855 0.024 0.858 25153 73 1 13 "Average Difference" N 165 3.101 -0.256 3.100 25153 74 1 13 "Average Difference" HA 186 0.474 -0.016 0.475 25153 75 1 13 "Average Difference" C 168 1.203 -0.003 1.207 25153 76 1 13 "Average Difference" CA 171 1.245 -0.186 1.235 25153 77 1 13 "Average Difference" CB 155 1.283 -0.108 1.283 25153 78 1 13 "Average Difference" HN 123 0.894 0.023 0.898 25153 79 1 14 "Average Difference" N 165 3.190 -0.356 3.180 25153 80 1 14 "Average Difference" HA 186 0.456 -0.013 0.457 25153 81 1 14 "Average Difference" C 168 1.194 0.045 1.197 25153 82 1 14 "Average Difference" CA 171 1.279 -0.077 1.281 25153 83 1 14 "Average Difference" CB 155 1.284 -0.130 1.281 25153 84 1 14 "Average Difference" HN 123 0.866 -0.000 0.870 25153 85 1 15 "Average Difference" N 165 3.153 -0.411 3.136 25153 86 1 15 "Average Difference" HA 186 0.451 -0.014 0.452 25153 87 1 15 "Average Difference" C 168 1.183 0.003 1.187 25153 88 1 15 "Average Difference" CA 171 1.258 -0.147 1.253 25153 89 1 15 "Average Difference" CB 155 1.290 -0.125 1.289 25153 90 1 15 "Average Difference" HN 123 0.846 0.016 0.850 25153 91 1 16 "Average Difference" N 165 3.342 -0.395 3.328 25153 92 1 16 "Average Difference" HA 186 0.463 -0.019 0.464 25153 93 1 16 "Average Difference" C 168 1.199 0.028 1.202 25153 94 1 16 "Average Difference" CA 171 1.238 -0.104 1.237 25153 95 1 16 "Average Difference" CB 155 1.307 -0.145 1.303 25153 96 1 16 "Average Difference" HN 123 0.878 0.006 0.882 25153 97 1 17 "Average Difference" N 165 3.353 -0.333 3.347 25153 98 1 17 "Average Difference" HA 186 0.459 -0.014 0.460 25153 99 1 17 "Average Difference" C 168 1.210 0.001 1.214 25153 100 1 17 "Average Difference" CA 171 1.225 -0.084 1.225 25153 101 1 17 "Average Difference" CB 155 1.322 -0.147 1.319 25153 102 1 17 "Average Difference" HN 123 0.855 0.046 0.858 25153 103 1 18 "Average Difference" N 165 3.204 -0.405 3.188 25153 104 1 18 "Average Difference" HA 186 0.450 -0.011 0.451 25153 105 1 18 "Average Difference" C 168 1.184 -0.006 1.187 25153 106 1 18 "Average Difference" CA 171 1.194 -0.116 1.192 25153 107 1 18 "Average Difference" CB 155 1.258 -0.090 1.259 25153 108 1 18 "Average Difference" HN 123 0.863 0.012 0.867 25153 109 1 19 "Average Difference" N 165 3.317 -0.517 3.286 25153 110 1 19 "Average Difference" HA 186 0.452 -0.009 0.453 25153 111 1 19 "Average Difference" C 168 1.180 0.014 1.183 25153 112 1 19 "Average Difference" CA 171 1.263 -0.074 1.265 25153 113 1 19 "Average Difference" CB 155 1.238 -0.096 1.238 25153 114 1 19 "Average Difference" HN 123 0.858 0.032 0.860 25153 115 1 20 "Average Difference" N 165 3.218 -0.374 3.206 25153 116 1 20 "Average Difference" HA 186 0.457 -0.001 0.459 25153 117 1 20 "Average Difference" C 168 1.196 -0.012 1.199 25153 118 1 20 "Average Difference" CA 171 1.298 -0.149 1.293 25153 119 1 20 "Average Difference" CB 155 1.257 -0.094 1.258 25153 120 1 20 "Average Difference" HN 123 0.844 0.004 0.847 25153 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 25153 _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 ASN N N 2 123.320 123.320 119.599 3.721 25153 2 1 . 1 1 2 2 ASN HA H 2 5.208 5.208 5.159 0.049 25153 3 1 . 1 1 2 2 ASN C C 2 174.590 174.590 174.233 0.357 25153 4 1 . 1 1 2 2 ASN CA C 2 53.000 53.000 52.663 0.337 25153 5 1 . 1 1 2 2 ASN CB C 2 39.970 39.970 40.730 -0.760 25153 6 1 . 1 1 2 2 ASN H H 2 9.428 9.428 8.638 0.790 25153 7 1 . 1 1 3 3 MET N N 3 120.920 120.920 118.747 2.173 25153 8 1 . 1 1 3 3 MET HA H 3 5.530 5.530 5.315 0.215 25153 9 1 . 1 1 3 3 MET C C 3 174.400 174.400 174.959 -0.559 25153 10 1 . 1 1 3 3 MET CA C 3 54.643 54.643 54.233 0.410 25153 11 1 . 1 1 3 3 MET CB C 3 34.637 34.637 37.500 -2.863 25153 12 1 . 1 1 3 3 MET H H 3 8.751 8.751 9.177 -0.426 25153 13 1 . 1 1 4 4 GLY N N 4 115.542 115.542 109.193 6.348 25153 14 1 . 1 1 4 4 GLY C C 4 170.413 170.413 172.180 -1.767 25153 15 1 . 1 1 4 4 GLY CA C 4 43.102 43.102 43.800 -0.698 25153 16 1 . 1 1 4 4 GLY H H 4 8.927 8.927 8.879 0.048 25153 17 1 . 1 1 5 5 LEU N N 5 131.030 131.030 128.154 2.876 25153 18 1 . 1 1 5 5 LEU HA H 5 6.402 6.402 5.274 1.128 25153 19 1 . 1 1 5 5 LEU C C 5 175.952 175.952 174.554 1.398 25153 20 1 . 1 1 5 5 LEU CA C 5 53.450 53.450 52.804 0.646 25153 21 1 . 1 1 5 5 LEU CB C 5 44.592 44.592 41.796 2.796 25153 22 1 . 1 1 5 5 LEU H H 5 8.928 8.928 8.648 0.280 25153 23 1 . 1 1 6 6 PHE N N 6 125.790 125.790 126.320 -0.530 25153 24 1 . 1 1 6 6 PHE HA H 6 5.740 5.740 5.736 0.004 25153 25 1 . 1 1 6 6 PHE C C 6 174.300 174.300 175.867 -1.567 25153 26 1 . 1 1 6 6 PHE CA C 6 55.320 55.320 56.443 -1.123 25153 27 1 . 1 1 6 6 PHE CB C 6 41.230 41.230 41.517 -0.287 25153 28 1 . 1 1 6 6 PHE H H 6 9.237 9.237 9.455 -0.218 25153 29 1 . 1 1 7 7 TYR N N 7 117.289 117.289 116.965 0.324 25153 30 1 . 1 1 7 7 TYR HA H 7 5.965 5.965 5.912 0.053 25153 31 1 . 1 1 7 7 TYR C C 7 171.262 171.262 173.365 -2.103 25153 32 1 . 1 1 7 7 TYR CA C 7 55.400 55.400 56.320 -0.920 25153 33 1 . 1 1 7 7 TYR CB C 7 41.240 41.240 41.117 0.123 25153 34 1 . 1 1 7 7 TYR H H 7 8.125 8.125 8.363 -0.238 25153 35 1 . 1 1 8 8 GLY N N 8 107.420 107.420 106.361 1.059 25153 36 1 . 1 1 8 8 GLY C C 8 172.000 172.000 172.334 -0.334 25153 37 1 . 1 1 8 8 GLY CA C 8 43.944 43.944 44.395 -0.451 25153 38 1 . 1 1 8 8 GLY H H 8 7.031 7.031 8.490 -1.459 25153 39 1 . 1 1 9 9 SER N N 9 118.150 118.150 116.751 1.399 25153 40 1 . 1 1 9 9 SER HA H 9 5.200 5.200 5.117 0.083 25153 41 1 . 1 1 9 9 SER C C 9 175.000 175.000 174.209 0.791 25153 42 1 . 1 1 9 9 SER CA C 9 57.570 57.570 57.337 0.233 25153 43 1 . 1 1 9 9 SER CB C 9 66.700 66.700 65.685 1.015 25153 44 1 . 1 1 9 9 SER H H 9 9.604 9.604 8.323 1.281 25153 45 1 . 1 1 10 10 SER N N 10 131.193 131.193 120.208 10.985 25153 46 1 . 1 1 10 10 SER HA H 10 4.775 4.775 4.542 0.233 25153 47 1 . 1 1 10 10 SER C C 10 175.730 175.730 175.677 0.053 25153 48 1 . 1 1 10 10 SER CA C 10 61.750 61.750 60.156 1.594 25153 49 1 . 1 1 10 10 SER CB C 10 64.400 64.400 63.757 0.643 25153 50 1 . 1 1 10 10 SER H H 10 11.636 11.636 9.055 2.581 25153 51 1 . 1 1 11 11 THR N N 11 115.848 115.848 114.523 1.325 25153 52 1 . 1 1 11 11 THR HA H 11 4.770 4.770 4.272 0.498 25153 53 1 . 1 1 11 11 THR C C 11 173.700 173.700 174.633 -0.933 25153 54 1 . 1 1 11 11 THR CA C 11 60.700 60.700 62.566 -1.866 25153 55 1 . 1 1 11 11 THR CB C 11 67.430 67.430 69.171 -1.741 25153 56 1 . 1 1 11 11 THR H H 11 9.550 9.550 8.401 1.149 25153 57 1 . 1 1 12 12 CYS N N 12 109.780 109.780 115.914 -6.134 25153 58 1 . 1 1 12 12 CYS HA H 12 4.070 4.070 4.455 -0.385 25153 59 1 . 1 1 12 12 CYS C C 12 176.220 176.220 175.391 0.829 25153 60 1 . 1 1 12 12 CYS CA C 12 63.600 63.600 59.360 4.240 25153 61 1 . 1 1 12 12 CYS CB C 12 26.400 26.400 27.115 -0.715 25153 62 1 . 1 1 12 12 CYS H H 12 7.437 7.437 7.745 -0.309 25153 63 1 . 1 1 13 13 TYR N N 13 127.830 127.830 121.671 6.159 25153 64 1 . 1 1 13 13 TYR HA H 13 4.103 4.103 4.267 -0.164 25153 65 1 . 1 1 13 13 TYR C C 13 180.880 180.880 177.949 2.931 25153 66 1 . 1 1 13 13 TYR CA C 13 65.100 65.100 61.070 4.030 25153 67 1 . 1 1 13 13 TYR CB C 13 36.835 36.835 37.546 -0.711 25153 68 1 . 1 1 13 13 TYR H H 13 10.886 10.886 7.435 3.451 25153 69 1 . 1 1 14 14 THR N N 14 124.428 124.428 113.727 10.701 25153 70 1 . 1 1 14 14 THR HA H 14 4.160 4.160 4.133 0.027 25153 71 1 . 1 1 14 14 THR C C 14 177.760 177.760 176.285 1.475 25153 72 1 . 1 1 14 14 THR CA C 14 67.823 67.823 66.693 1.130 25153 73 1 . 1 1 14 14 THR CB C 14 68.040 68.040 68.363 -0.323 25153 74 1 . 1 1 14 14 THR H H 14 11.405 11.405 8.449 2.956 25153 75 1 . 1 1 15 15 GLU N N 15 123.050 123.050 123.031 0.019 25153 76 1 . 1 1 15 15 GLU HA H 15 2.890 2.890 3.214 -0.324 25153 77 1 . 1 1 15 15 GLU C C 15 176.392 176.392 178.249 -1.857 25153 78 1 . 1 1 15 15 GLU CA C 15 59.200 59.200 59.506 -0.306 25153 79 1 . 1 1 15 15 GLU CB C 15 30.450 30.450 29.332 1.118 25153 80 1 . 1 1 16 16 MET N N 16 120.173 120.173 118.407 1.766 25153 81 1 . 1 1 16 16 MET HA H 16 4.050 4.050 4.153 -0.103 25153 82 1 . 1 1 16 16 MET C C 16 179.940 179.940 178.668 1.272 25153 83 1 . 1 1 16 16 MET CA C 16 59.240 59.240 59.226 0.014 25153 84 1 . 1 1 16 16 MET CB C 16 32.970 32.970 32.844 0.126 25153 85 1 . 1 1 16 16 MET H H 16 8.469 8.469 8.420 0.049 25153 86 1 . 1 1 17 17 ALA N N 17 121.930 121.930 121.761 0.169 25153 87 1 . 1 1 17 17 ALA HA H 17 3.836 3.836 3.854 -0.018 25153 88 1 . 1 1 17 17 ALA C C 17 177.900 177.900 178.736 -0.836 25153 89 1 . 1 1 17 17 ALA CA C 17 55.200 55.200 55.131 0.069 25153 90 1 . 1 1 17 17 ALA CB C 17 18.000 18.000 18.100 -0.100 25153 91 1 . 1 1 17 17 ALA H H 17 7.880 7.880 8.179 -0.299 25153 92 1 . 1 1 18 18 ALA N N 18 121.477 121.477 121.403 0.074 25153 93 1 . 1 1 18 18 ALA HA H 18 3.737 3.737 3.803 -0.066 25153 94 1 . 1 1 18 18 ALA C C 18 179.380 179.380 179.503 -0.123 25153 95 1 . 1 1 18 18 ALA CA C 18 55.000 55.000 55.175 -0.175 25153 96 1 . 1 1 18 18 ALA CB C 18 18.830 18.830 17.799 1.031 25153 97 1 . 1 1 18 18 ALA H H 18 7.374 7.374 8.084 -0.710 25153 98 1 . 1 1 19 19 GLU N N 19 116.650 116.650 118.095 -1.445 25153 99 1 . 1 1 19 19 GLU HA H 19 3.616 3.616 3.849 -0.232 25153 100 1 . 1 1 19 19 GLU C C 19 178.479 178.479 179.338 -0.859 25153 101 1 . 1 1 19 19 GLU CA C 19 59.730 59.730 59.525 0.205 25153 102 1 . 1 1 19 19 GLU CB C 19 29.300 29.300 29.377 -0.077 25153 103 1 . 1 1 20 20 LYS N N 20 119.470 119.470 119.867 -0.397 25153 104 1 . 1 1 20 20 LYS HA H 20 4.050 4.050 4.010 0.040 25153 105 1 . 1 1 20 20 LYS C C 20 179.116 179.116 179.036 0.080 25153 106 1 . 1 1 20 20 LYS CA C 20 59.830 59.830 59.527 0.303 25153 107 1 . 1 1 20 20 LYS CB C 20 32.850 32.850 32.443 0.407 25153 108 1 . 1 1 21 21 ILE N N 21 121.030 121.030 120.728 0.302 25153 109 1 . 1 1 21 21 ILE HA H 21 3.390 3.390 3.680 -0.290 25153 110 1 . 1 1 21 21 ILE C C 21 177.580 177.580 178.193 -0.613 25153 111 1 . 1 1 21 21 ILE CA C 21 65.820 65.820 65.755 0.065 25153 112 1 . 1 1 21 21 ILE CB C 21 38.348 38.348 37.902 0.446 25153 113 1 . 1 1 21 21 ILE H H 21 8.100 8.100 8.608 -0.508 25153 114 1 . 1 1 22 22 ARG N N 22 119.720 119.720 119.487 0.233 25153 115 1 . 1 1 22 22 ARG HA H 22 3.555 3.555 3.850 -0.295 25153 116 1 . 1 1 22 22 ARG C C 22 177.320 177.320 178.135 -0.815 25153 117 1 . 1 1 22 22 ARG CA C 22 59.720 59.720 59.667 0.054 25153 118 1 . 1 1 22 22 ARG CB C 22 28.932 28.932 29.679 -0.746 25153 119 1 . 1 1 23 23 ASP N N 23 118.730 118.730 119.350 -0.620 25153 120 1 . 1 1 23 23 ASP HA H 23 4.363 4.363 4.416 -0.053 25153 121 1 . 1 1 23 23 ASP C C 23 178.330 178.330 178.781 -0.451 25153 122 1 . 1 1 23 23 ASP CA C 23 56.950 56.950 57.337 -0.387 25153 123 1 . 1 1 23 23 ASP CB C 23 40.240 40.240 40.865 -0.625 25153 124 1 . 1 1 24 24 ILE N N 24 121.090 121.090 119.432 1.658 25153 125 1 . 1 1 24 24 ILE HA H 24 3.796 3.796 3.779 0.017 25153 126 1 . 1 1 24 24 ILE C C 24 178.250 178.250 177.917 0.333 25153 127 1 . 1 1 24 24 ILE CA C 24 64.150 64.150 64.846 -0.696 25153 128 1 . 1 1 24 24 ILE CB C 24 38.480 38.480 38.297 0.183 25153 129 1 . 1 1 24 24 ILE H H 24 7.910 7.910 8.198 -0.288 25153 130 1 . 1 1 25 25 ILE N N 25 121.406 121.406 117.286 4.120 25153 131 1 . 1 1 25 25 ILE HA H 25 3.646 3.646 3.869 -0.223 25153 132 1 . 1 1 25 25 ILE C C 25 176.800 176.800 176.771 0.029 25153 133 1 . 1 1 25 25 ILE CA C 25 65.700 65.700 63.042 2.658 25153 134 1 . 1 1 25 25 ILE CB C 25 38.190 38.190 38.941 -0.751 25153 135 1 . 1 1 25 25 ILE H H 25 8.476 8.476 8.078 0.398 25153 136 1 . 1 1 26 26 GLY N N 26 108.900 108.900 105.149 3.751 25153 137 1 . 1 1 26 26 GLY C C 26 173.710 173.710 172.265 1.445 25153 138 1 . 1 1 26 26 GLY CA C 26 44.330 44.330 44.679 -0.349 25153 139 1 . 1 1 26 26 GLY H H 26 8.016 8.016 7.800 0.216 25153 140 1 . 1 1 27 27 PRO HA H 27 4.338 4.338 4.678 -0.340 25153 141 1 . 1 1 27 27 PRO C C 27 177.200 177.200 177.188 0.012 25153 142 1 . 1 1 27 27 PRO CA C 27 64.686 64.686 63.545 1.141 25153 143 1 . 1 1 27 27 PRO CB C 27 32.200 32.200 32.053 0.147 25153 144 1 . 1 1 28 28 GLU N N 28 116.295 116.295 118.108 -1.813 25153 145 1 . 1 1 28 28 GLU HA H 28 4.270 4.270 4.200 0.070 25153 146 1 . 1 1 28 28 GLU C C 28 176.980 176.980 177.259 -0.279 25153 147 1 . 1 1 28 28 GLU CA C 28 57.740 57.740 58.372 -0.631 25153 148 1 . 1 1 28 28 GLU CB C 28 28.670 28.670 29.536 -0.866 25153 149 1 . 1 1 29 29 LEU N N 29 120.250 120.250 111.992 8.258 25153 150 1 . 1 1 29 29 LEU HA H 29 4.636 4.636 4.685 -0.049 25153 151 1 . 1 1 29 29 LEU C C 29 175.770 175.770 175.708 0.062 25153 152 1 . 1 1 29 29 LEU CA C 29 55.800 55.800 55.269 0.531 25153 153 1 . 1 1 29 29 LEU CB C 29 45.100 45.100 43.916 1.184 25153 154 1 . 1 1 29 29 LEU H H 29 7.940 7.940 7.577 0.363 25153 155 1 . 1 1 30 30 VAL N N 30 118.693 118.693 121.117 -2.424 25153 156 1 . 1 1 30 30 VAL HA H 30 4.648 4.648 4.875 -0.226 25153 157 1 . 1 1 30 30 VAL C C 30 174.347 174.347 175.854 -1.507 25153 158 1 . 1 1 30 30 VAL CA C 30 60.868 60.868 61.645 -0.776 25153 159 1 . 1 1 30 30 VAL CB C 30 34.580 34.580 32.982 1.598 25153 160 1 . 1 1 30 30 VAL H H 30 7.434 7.434 8.002 -0.568 25153 161 1 . 1 1 31 31 THR N N 31 123.800 123.800 121.697 2.103 25153 162 1 . 1 1 31 31 THR HA H 31 4.362 4.362 4.556 -0.194 25153 163 1 . 1 1 31 31 THR C C 31 172.964 172.964 173.271 -0.307 25153 164 1 . 1 1 31 31 THR CA C 31 61.720 61.720 60.912 0.808 25153 165 1 . 1 1 31 31 THR CB C 31 70.485 70.485 70.872 -0.387 25153 166 1 . 1 1 31 31 THR H H 31 7.844 7.844 8.244 -0.400 25153 167 1 . 1 1 32 32 LEU N N 32 127.800 127.800 126.693 1.107 25153 168 1 . 1 1 32 32 LEU HA H 32 4.684 4.684 4.634 0.050 25153 169 1 . 1 1 32 32 LEU C C 32 176.600 176.600 176.345 0.255 25153 170 1 . 1 1 32 32 LEU CA C 32 55.155 55.155 54.925 0.230 25153 171 1 . 1 1 32 32 LEU CB C 32 43.850 43.850 42.830 1.020 25153 172 1 . 1 1 32 32 LEU H H 32 8.660 8.660 8.545 0.115 25153 173 1 . 1 1 33 33 HIS N N 33 119.670 119.670 119.824 -0.154 25153 174 1 . 1 1 33 33 HIS HA H 33 4.400 4.400 4.772 -0.372 25153 175 1 . 1 1 33 33 HIS C C 33 171.667 171.667 173.258 -1.591 25153 176 1 . 1 1 33 33 HIS CA C 33 55.200 55.200 55.018 0.182 25153 177 1 . 1 1 33 33 HIS CB C 33 32.200 32.200 31.742 0.458 25153 178 1 . 1 1 33 33 HIS H H 33 9.060 9.060 8.711 0.349 25153 179 1 . 1 1 34 34 ASN N N 34 124.068 124.068 123.321 0.747 25153 180 1 . 1 1 34 34 ASN HA H 34 3.434 3.434 4.067 -0.633 25153 181 1 . 1 1 34 34 ASN C C 34 178.000 178.000 175.948 2.052 25153 182 1 . 1 1 34 34 ASN CA C 34 51.429 51.429 52.039 -0.610 25153 183 1 . 1 1 34 34 ASN CB C 34 38.560 38.560 39.083 -0.523 25153 184 1 . 1 1 34 34 ASN H H 34 8.780 8.780 8.528 0.252 25153 185 1 . 1 1 35 35 LEU N N 35 129.040 129.040 126.233 2.807 25153 186 1 . 1 1 35 35 LEU HA H 35 4.315 4.315 4.193 0.122 25153 187 1 . 1 1 35 35 LEU C C 35 177.700 177.700 177.782 -0.083 25153 188 1 . 1 1 35 35 LEU CA C 35 56.480 56.480 56.453 0.027 25153 189 1 . 1 1 35 35 LEU CB C 35 42.300 42.300 40.927 1.373 25153 190 1 . 1 1 35 35 LEU H H 35 8.821 8.821 8.393 0.428 25153 191 1 . 1 1 36 36 LYS N N 36 121.043 121.043 116.286 4.757 25153 192 1 . 1 1 36 36 LYS HA H 36 3.880 3.880 4.027 -0.148 25153 193 1 . 1 1 36 36 LYS C C 36 176.230 176.230 177.064 -0.834 25153 194 1 . 1 1 36 36 LYS CA C 36 59.420 59.420 58.358 1.062 25153 195 1 . 1 1 36 36 LYS CB C 36 33.270 33.270 32.425 0.845 25153 196 1 . 1 1 37 37 ASP N N 37 114.965 114.965 118.207 -3.241 25153 197 1 . 1 1 37 37 ASP HA H 37 4.777 4.777 4.781 -0.005 25153 198 1 . 1 1 37 37 ASP C C 37 175.440 175.440 175.885 -0.444 25153 199 1 . 1 1 37 37 ASP CA C 37 54.711 54.711 54.590 0.121 25153 200 1 . 1 1 37 37 ASP CB C 37 44.700 44.700 43.450 1.250 25153 201 1 . 1 1 38 38 ASP N N 38 121.650 121.650 121.160 0.489 25153 202 1 . 1 1 38 38 ASP HA H 38 4.870 4.870 4.876 -0.006 25153 203 1 . 1 1 38 38 ASP C C 38 174.852 174.852 175.888 -1.036 25153 204 1 . 1 1 38 38 ASP CA C 38 53.080 53.080 54.387 -1.307 25153 205 1 . 1 1 38 38 ASP CB C 38 42.110 42.110 42.586 -0.476 25153 206 1 . 1 1 39 39 SER N N 39 115.207 115.207 117.493 -2.286 25153 207 1 . 1 1 39 39 SER HA H 39 4.585 4.585 4.698 -0.113 25153 208 1 . 1 1 39 39 SER C C 39 175.040 175.040 174.272 0.768 25153 209 1 . 1 1 39 39 SER CA C 39 54.960 54.960 56.332 -1.372 25153 210 1 . 1 1 39 39 SER CB C 39 64.720 64.720 63.620 1.100 25153 211 1 . 1 1 39 39 SER H H 39 8.351 8.351 8.572 -0.221 25153 212 1 . 1 1 40 40 PRO HA H 40 4.005 4.005 4.261 -0.256 25153 213 1 . 1 1 40 40 PRO C C 40 176.730 176.730 177.838 -1.108 25153 214 1 . 1 1 40 40 PRO CA C 40 63.900 63.900 63.993 -0.093 25153 215 1 . 1 1 40 40 PRO CB C 40 31.400 31.400 31.788 -0.388 25153 216 1 . 1 1 41 41 LYS N N 41 121.150 121.150 119.829 1.321 25153 217 1 . 1 1 41 41 LYS HA H 41 3.912 3.912 4.009 -0.097 25153 218 1 . 1 1 41 41 LYS C C 41 179.600 179.600 178.571 1.029 25153 219 1 . 1 1 41 41 LYS CA C 41 58.200 58.200 59.363 -1.163 25153 220 1 . 1 1 41 41 LYS CB C 41 32.000 32.000 31.671 0.329 25153 221 1 . 1 1 42 42 LEU N N 42 118.103 118.103 116.307 1.796 25153 222 1 . 1 1 42 42 LEU HA H 42 4.037 4.037 4.190 -0.153 25153 223 1 . 1 1 42 42 LEU C C 42 178.760 178.760 178.798 -0.038 25153 224 1 . 1 1 42 42 LEU CA C 42 57.180 57.180 57.273 -0.093 25153 225 1 . 1 1 42 42 LEU CB C 42 41.973 41.973 40.712 1.261 25153 226 1 . 1 1 42 42 LEU H H 42 7.600 7.600 7.535 0.065 25153 227 1 . 1 1 43 43 MET N N 43 118.917 118.917 117.373 1.544 25153 228 1 . 1 1 43 43 MET HA H 43 3.750 3.750 4.378 -0.628 25153 229 1 . 1 1 43 43 MET C C 43 177.680 177.680 176.842 0.838 25153 230 1 . 1 1 43 43 MET CA C 43 59.730 59.730 58.011 1.719 25153 231 1 . 1 1 43 43 MET CB C 43 32.700 32.700 31.905 0.795 25153 232 1 . 1 1 43 43 MET H H 43 8.202 8.202 7.992 0.210 25153 233 1 . 1 1 44 44 GLU N N 44 110.924 110.924 117.370 -6.446 25153 234 1 . 1 1 44 44 GLU HA H 44 3.740 3.740 4.263 -0.523 25153 235 1 . 1 1 44 44 GLU C C 44 178.130 178.130 178.915 -0.785 25153 236 1 . 1 1 44 44 GLU CA C 44 59.400 59.400 58.245 1.155 25153 237 1 . 1 1 44 44 GLU CB C 44 29.550 29.550 29.957 -0.407 25153 238 1 . 1 1 45 45 GLN N N 45 115.756 115.756 118.578 -2.822 25153 239 1 . 1 1 45 45 GLN HA H 45 4.183 4.183 4.033 0.150 25153 240 1 . 1 1 45 45 GLN C C 45 175.414 175.414 177.200 -1.786 25153 241 1 . 1 1 45 45 GLN CA C 45 56.180 56.180 57.582 -1.402 25153 242 1 . 1 1 45 45 GLN CB C 45 28.600 28.600 29.098 -0.498 25153 243 1 . 1 1 45 45 GLN H H 45 7.516 7.516 7.507 0.009 25153 244 1 . 1 1 46 46 TYR N N 46 117.860 117.860 118.730 -0.870 25153 245 1 . 1 1 46 46 TYR HA H 46 4.663 4.663 4.364 0.299 25153 246 1 . 1 1 46 46 TYR C C 46 175.500 175.500 177.019 -1.519 25153 247 1 . 1 1 46 46 TYR CA C 46 58.486 58.486 59.427 -0.941 25153 248 1 . 1 1 46 46 TYR CB C 46 41.470 41.470 38.278 3.192 25153 249 1 . 1 1 46 46 TYR H H 46 6.996 6.996 7.216 -0.220 25153 250 1 . 1 1 47 47 ASP N N 47 121.683 121.683 121.706 -0.022 25153 251 1 . 1 1 47 47 ASP HA H 47 4.700 4.700 4.671 0.029 25153 252 1 . 1 1 47 47 ASP C C 47 175.610 175.610 175.186 0.424 25153 253 1 . 1 1 47 47 ASP CA C 47 56.700 56.700 56.765 -0.065 25153 254 1 . 1 1 47 47 ASP CB C 47 43.000 43.000 41.944 1.056 25153 255 1 . 1 1 48 48 VAL N N 48 118.628 118.628 116.437 2.191 25153 256 1 . 1 1 48 48 VAL HA H 48 5.034 5.034 4.800 0.234 25153 257 1 . 1 1 48 48 VAL C C 48 174.190 174.190 173.983 0.207 25153 258 1 . 1 1 48 48 VAL CA C 48 60.190 60.190 61.155 -0.965 25153 259 1 . 1 1 48 48 VAL CB C 48 36.100 36.100 35.896 0.204 25153 260 1 . 1 1 48 48 VAL H H 48 7.628 7.628 7.374 0.254 25153 261 1 . 1 1 49 49 LEU N N 49 128.190 128.190 123.880 4.310 25153 262 1 . 1 1 49 49 LEU HA H 49 5.603 5.603 5.436 0.167 25153 263 1 . 1 1 49 49 LEU C C 49 174.880 174.880 175.595 -0.715 25153 264 1 . 1 1 49 49 LEU CA C 49 52.240 52.240 53.302 -1.062 25153 265 1 . 1 1 49 49 LEU CB C 49 45.340 45.340 45.998 -0.658 25153 266 1 . 1 1 49 49 LEU H H 49 9.407 9.407 9.050 0.357 25153 267 1 . 1 1 50 50 ILE N N 50 124.550 124.550 120.753 3.797 25153 268 1 . 1 1 50 50 ILE HA H 50 5.700 5.700 5.057 0.643 25153 269 1 . 1 1 50 50 ILE C C 50 175.300 175.300 174.623 0.677 25153 270 1 . 1 1 50 50 ILE CA C 50 59.864 59.864 60.944 -1.080 25153 271 1 . 1 1 50 50 ILE CB C 50 40.250 40.250 40.988 -0.738 25153 272 1 . 1 1 50 50 ILE H H 50 9.238 9.238 9.197 0.041 25153 273 1 . 1 1 51 51 LEU N N 51 127.460 127.460 128.303 -0.843 25153 274 1 . 1 1 51 51 LEU HA H 51 6.185 6.185 5.860 0.325 25153 275 1 . 1 1 51 51 LEU C C 51 174.544 174.544 175.934 -1.390 25153 276 1 . 1 1 51 51 LEU CA C 51 52.820 52.820 53.560 -0.740 25153 277 1 . 1 1 51 51 LEU CB C 51 43.637 43.637 46.131 -2.494 25153 278 1 . 1 1 51 51 LEU H H 51 9.228 9.228 9.151 0.077 25153 279 1 . 1 1 52 52 GLY N N 52 107.760 107.760 111.109 -3.349 25153 280 1 . 1 1 52 52 GLY C C 52 174.710 174.710 172.404 2.306 25153 281 1 . 1 1 52 52 GLY CA C 52 43.870 43.870 43.961 -0.091 25153 282 1 . 1 1 52 52 GLY H H 52 8.860 8.860 8.946 -0.086 25153 283 1 . 1 1 53 53 ILE N N 53 123.890 123.890 119.654 4.236 25153 284 1 . 1 1 53 53 ILE HA H 53 5.270 5.270 4.832 0.438 25153 285 1 . 1 1 53 53 ILE C C 53 172.630 172.630 173.115 -0.485 25153 286 1 . 1 1 53 53 ILE CA C 53 56.680 56.680 56.636 0.044 25153 287 1 . 1 1 53 53 ILE CB C 53 44.160 44.160 40.264 3.896 25153 288 1 . 1 1 53 53 ILE H H 53 8.458 8.458 8.045 0.413 25153 289 1 . 1 1 54 54 PRO HA H 54 5.388 5.388 4.867 0.521 25153 290 1 . 1 1 54 54 PRO C C 54 175.000 175.000 176.389 -1.389 25153 291 1 . 1 1 54 54 PRO CA C 54 61.600 61.600 61.854 -0.254 25153 292 1 . 1 1 54 54 PRO CB C 54 32.300 32.300 32.906 -0.606 25153 293 1 . 1 1 55 55 THR N N 55 112.754 112.754 118.703 -5.949 25153 294 1 . 1 1 55 55 THR HA H 55 4.452 4.452 4.735 -0.283 25153 295 1 . 1 1 55 55 THR C C 55 172.480 172.480 174.119 -1.639 25153 296 1 . 1 1 55 55 THR CA C 55 62.350 62.350 63.138 -0.788 25153 297 1 . 1 1 55 55 THR CB C 55 70.230 70.230 69.813 0.417 25153 298 1 . 1 1 55 55 THR H H 55 6.523 6.523 8.120 -1.597 25153 299 1 . 1 1 56 56 TRP N N 56 130.044 130.044 126.927 3.117 25153 300 1 . 1 1 56 56 TRP HA H 56 2.715 2.715 4.599 -1.884 25153 301 1 . 1 1 56 56 TRP C C 56 172.890 172.890 175.438 -2.548 25153 302 1 . 1 1 56 56 TRP CA C 56 56.650 56.650 56.770 -0.120 25153 303 1 . 1 1 56 56 TRP CB C 56 33.000 33.000 31.666 1.334 25153 304 1 . 1 1 56 56 TRP H H 56 8.450 8.450 8.754 -0.303 25153 305 1 . 1 1 57 57 ASP N N 57 115.275 115.275 120.783 -5.508 25153 306 1 . 1 1 57 57 ASP HA H 57 4.352 4.352 4.008 0.344 25153 307 1 . 1 1 57 57 ASP C C 57 173.660 173.660 174.886 -1.226 25153 308 1 . 1 1 57 57 ASP CA C 57 56.230 56.230 55.195 1.035 25153 309 1 . 1 1 57 57 ASP CB C 57 40.170 40.170 39.858 0.312 25153 310 1 . 1 1 58 58 PHE N N 58 112.840 112.840 116.560 -3.720 25153 311 1 . 1 1 58 58 PHE HA H 58 3.324 3.324 3.687 -0.363 25153 312 1 . 1 1 58 58 PHE C C 58 175.730 175.730 175.958 -0.228 25153 313 1 . 1 1 58 58 PHE CA C 58 58.823 58.823 57.878 0.945 25153 314 1 . 1 1 58 58 PHE CB C 58 34.754 34.754 36.962 -2.208 25153 315 1 . 1 1 58 58 PHE H H 58 7.640 7.640 7.649 -0.009 25153 316 1 . 1 1 59 59 GLY N N 59 104.940 104.940 106.207 -1.267 25153 317 1 . 1 1 59 59 GLY C C 59 173.750 173.750 174.579 -0.829 25153 318 1 . 1 1 59 59 GLY CA C 59 46.290 46.290 45.334 0.956 25153 319 1 . 1 1 59 59 GLY H H 59 8.024 8.024 8.704 -0.680 25153 320 1 . 1 1 60 60 GLU N N 60 120.045 120.045 119.345 0.700 25153 321 1 . 1 1 60 60 GLU HA H 60 4.413 4.413 4.496 -0.083 25153 322 1 . 1 1 60 60 GLU C C 60 176.050 176.050 175.922 0.128 25153 323 1 . 1 1 60 60 GLU CA C 60 54.620 54.620 55.318 -0.698 25153 324 1 . 1 1 60 60 GLU CB C 60 30.610 30.610 31.264 -0.654 25153 325 1 . 1 1 61 61 ILE N N 61 120.790 120.790 120.987 -0.197 25153 326 1 . 1 1 61 61 ILE HA H 61 3.467 3.467 4.164 -0.697 25153 327 1 . 1 1 61 61 ILE C C 61 175.130 175.130 176.126 -0.996 25153 328 1 . 1 1 61 61 ILE CA C 61 61.547 61.547 61.074 0.473 25153 329 1 . 1 1 61 61 ILE CB C 61 38.850 38.850 39.082 -0.232 25153 330 1 . 1 1 61 61 ILE H H 61 8.200 8.200 8.343 -0.143 25153 331 1 . 1 1 62 62 GLN N N 62 124.520 124.520 123.784 0.736 25153 332 1 . 1 1 62 62 GLN HA H 62 3.956 3.956 4.155 -0.199 25153 333 1 . 1 1 62 62 GLN C C 62 177.160 177.160 177.064 0.096 25153 334 1 . 1 1 62 62 GLN CA C 62 57.610 57.610 56.194 1.416 25153 335 1 . 1 1 62 62 GLN CB C 62 27.650 27.650 30.165 -2.515 25153 336 1 . 1 1 62 62 GLN H H 62 5.667 5.667 8.696 -3.029 25153 337 1 . 1 1 63 63 GLU N N 63 124.570 124.570 126.136 -1.566 25153 338 1 . 1 1 63 63 GLU HA H 63 3.986 3.986 4.204 -0.218 25153 339 1 . 1 1 63 63 GLU C C 63 177.300 177.300 177.316 -0.016 25153 340 1 . 1 1 63 63 GLU CA C 63 60.720 60.720 58.971 1.749 25153 341 1 . 1 1 63 63 GLU CB C 63 30.120 30.120 29.239 0.881 25153 342 1 . 1 1 64 64 ASP N N 64 119.060 119.060 119.616 -0.556 25153 343 1 . 1 1 64 64 ASP HA H 64 4.620 4.620 4.473 0.146 25153 344 1 . 1 1 64 64 ASP C C 64 179.180 179.180 177.480 1.700 25153 345 1 . 1 1 64 64 ASP CA C 64 57.950 57.950 56.435 1.515 25153 346 1 . 1 1 64 64 ASP CB C 64 40.950 40.950 40.432 0.518 25153 347 1 . 1 1 65 65 TRP N N 65 121.070 121.070 121.341 -0.271 25153 348 1 . 1 1 65 65 TRP HA H 65 4.340 4.340 4.502 -0.162 25153 349 1 . 1 1 65 65 TRP C C 65 178.970 178.970 178.292 0.678 25153 350 1 . 1 1 65 65 TRP CA C 65 60.820 60.820 60.667 0.153 25153 351 1 . 1 1 65 65 TRP CB C 65 30.400 30.400 30.346 0.054 25153 352 1 . 1 1 65 65 TRP H H 65 7.350 7.350 7.972 -0.622 25153 353 1 . 1 1 66 66 GLU N N 66 120.900 120.900 118.644 2.256 25153 354 1 . 1 1 66 66 GLU HA H 66 3.840 3.840 3.881 -0.041 25153 355 1 . 1 1 66 66 GLU C C 66 178.750 178.750 179.093 -0.343 25153 356 1 . 1 1 66 66 GLU CA C 66 60.000 60.000 59.452 0.548 25153 357 1 . 1 1 66 66 GLU CB C 66 28.860 28.860 29.253 -0.393 25153 358 1 . 1 1 67 67 ALA N N 67 119.130 119.130 119.899 -0.769 25153 359 1 . 1 1 67 67 ALA HA H 67 4.253 4.253 4.251 0.002 25153 360 1 . 1 1 67 67 ALA C C 67 179.410 179.410 179.117 0.293 25153 361 1 . 1 1 67 67 ALA CA C 67 54.580 54.580 54.732 -0.152 25153 362 1 . 1 1 67 67 ALA CB C 67 18.810 18.810 18.886 -0.076 25153 363 1 . 1 1 67 67 ALA H H 67 7.640 7.640 7.944 -0.305 25153 364 1 . 1 1 68 68 VAL N N 68 106.845 106.845 111.831 -4.986 25153 365 1 . 1 1 68 68 VAL HA H 68 4.810 4.810 4.481 0.329 25153 366 1 . 1 1 68 68 VAL C C 68 176.750 176.750 177.032 -0.282 25153 367 1 . 1 1 68 68 VAL CA C 68 59.610 59.610 62.517 -2.907 25153 368 1 . 1 1 68 68 VAL CB C 68 32.620 32.620 32.494 0.126 25153 369 1 . 1 1 68 68 VAL H H 68 7.219 7.219 7.555 -0.336 25153 370 1 . 1 1 69 69 TRP N N 69 127.630 127.630 124.069 3.561 25153 371 1 . 1 1 69 69 TRP HA H 69 4.238 4.238 4.283 -0.045 25153 372 1 . 1 1 69 69 TRP C C 69 178.670 178.670 177.119 1.551 25153 373 1 . 1 1 69 69 TRP CA C 69 61.220 61.220 62.521 -1.301 25153 374 1 . 1 1 69 69 TRP CB C 69 31.630 31.630 29.695 1.935 25153 375 1 . 1 1 69 69 TRP H H 69 7.832 7.832 8.564 -0.732 25153 376 1 . 1 1 70 70 ASP N N 70 114.544 114.544 118.323 -3.779 25153 377 1 . 1 1 70 70 ASP HA H 70 4.522 4.522 4.454 0.068 25153 378 1 . 1 1 70 70 ASP C C 70 178.670 178.670 178.990 -0.320 25153 379 1 . 1 1 70 70 ASP CA C 70 56.000 56.000 57.260 -1.260 25153 380 1 . 1 1 70 70 ASP CB C 70 39.850 39.850 40.976 -1.126 25153 381 1 . 1 1 71 71 GLN N N 71 120.040 120.040 119.452 0.588 25153 382 1 . 1 1 71 71 GLN HA H 71 4.184 4.184 4.117 0.067 25153 383 1 . 1 1 71 71 GLN C C 71 178.910 178.910 178.822 0.088 25153 384 1 . 1 1 71 71 GLN CA C 71 57.610 57.610 58.368 -0.758 25153 385 1 . 1 1 71 71 GLN CB C 71 29.100 29.100 28.835 0.265 25153 386 1 . 1 1 71 71 GLN H H 71 7.995 7.995 7.710 0.285 25153 387 1 . 1 1 72 72 LEU N N 72 117.400 117.400 118.799 -1.399 25153 388 1 . 1 1 72 72 LEU HA H 72 3.813 3.813 3.968 -0.155 25153 389 1 . 1 1 72 72 LEU C C 72 178.650 178.650 178.191 0.459 25153 390 1 . 1 1 72 72 LEU CA C 72 57.200 57.200 57.150 0.050 25153 391 1 . 1 1 72 72 LEU CB C 72 41.410 41.410 41.314 0.096 25153 392 1 . 1 1 72 72 LEU H H 72 7.450 7.450 7.772 -0.322 25153 393 1 . 1 1 73 73 ASP N N 73 115.750 115.750 117.959 -2.209 25153 394 1 . 1 1 73 73 ASP HA H 73 4.168 4.168 4.410 -0.242 25153 395 1 . 1 1 73 73 ASP C C 73 177.560 177.560 177.391 0.169 25153 396 1 . 1 1 73 73 ASP CA C 73 57.400 57.400 56.589 0.811 25153 397 1 . 1 1 73 73 ASP CB C 73 40.100 40.100 41.360 -1.260 25153 398 1 . 1 1 74 74 ASP N N 74 117.223 117.223 119.679 -2.456 25153 399 1 . 1 1 74 74 ASP HA H 74 4.703 4.703 4.593 0.110 25153 400 1 . 1 1 74 74 ASP C C 74 176.388 176.388 177.051 -0.663 25153 401 1 . 1 1 74 74 ASP CA C 74 54.500 54.500 54.986 -0.486 25153 402 1 . 1 1 74 74 ASP CB C 74 41.700 41.700 41.569 0.131 25153 403 1 . 1 1 75 75 LEU N N 75 118.316 118.316 119.266 -0.950 25153 404 1 . 1 1 75 75 LEU HA H 75 4.285 4.285 4.394 -0.109 25153 405 1 . 1 1 75 75 LEU C C 75 176.820 176.820 175.836 0.984 25153 406 1 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.475 -0.075 25153 407 1 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.529 0.751 25153 408 1 . 1 1 75 75 LEU H H 75 6.960 6.960 7.330 -0.370 25153 409 1 . 1 1 76 76 ASN N N 76 123.045 123.045 117.963 5.082 25153 410 1 . 1 1 76 76 ASN HA H 76 4.890 4.890 4.888 0.002 25153 411 1 . 1 1 76 76 ASN C C 76 174.950 174.950 174.766 0.184 25153 412 1 . 1 1 76 76 ASN CA C 76 52.050 52.050 52.550 -0.500 25153 413 1 . 1 1 76 76 ASN CB C 76 37.500 37.500 38.665 -1.165 25153 414 1 . 1 1 76 76 ASN H H 76 9.890 9.890 8.763 1.127 25153 415 1 . 1 1 77 77 LEU N N 77 123.494 123.494 123.093 0.401 25153 416 1 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.545 -0.175 25153 417 1 . 1 1 77 77 LEU C C 77 175.040 175.040 176.157 -1.117 25153 418 1 . 1 1 77 77 LEU CA C 77 52.250 52.250 53.741 -1.491 25153 419 1 . 1 1 77 77 LEU CB C 77 42.900 42.900 42.473 0.427 25153 420 1 . 1 1 77 77 LEU H H 77 8.730 8.730 8.134 0.596 25153 421 1 . 1 1 78 78 GLU N N 78 120.870 120.870 121.368 -0.498 25153 422 1 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.424 -0.524 25153 423 1 . 1 1 78 78 GLU C C 78 178.660 178.660 177.809 0.851 25153 424 1 . 1 1 78 78 GLU CA C 78 58.760 58.760 57.368 1.392 25153 425 1 . 1 1 78 78 GLU CB C 78 29.400 29.400 28.913 0.487 25153 426 1 . 1 1 79 79 GLY N N 79 113.240 113.240 113.871 -0.631 25153 427 1 . 1 1 79 79 GLY C C 79 174.460 174.460 174.174 0.286 25153 428 1 . 1 1 79 79 GLY CA C 79 45.430 45.430 45.339 0.091 25153 429 1 . 1 1 79 79 GLY H H 79 8.474 8.474 8.776 -0.302 25153 430 1 . 1 1 80 80 LYS N N 80 120.295 120.295 119.377 0.918 25153 431 1 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.583 -0.225 25153 432 1 . 1 1 80 80 LYS C C 80 175.360 175.360 175.867 -0.507 25153 433 1 . 1 1 80 80 LYS CA C 80 56.970 56.970 55.658 1.312 25153 434 1 . 1 1 80 80 LYS CB C 80 33.200 33.200 34.262 -1.062 25153 435 1 . 1 1 81 81 ILE N N 81 122.400 122.400 121.700 0.700 25153 436 1 . 1 1 81 81 ILE HA H 81 4.793 4.793 4.662 0.131 25153 437 1 . 1 1 81 81 ILE C C 81 174.760 174.760 175.485 -0.725 25153 438 1 . 1 1 81 81 ILE CA C 81 59.830 59.830 61.336 -1.506 25153 439 1 . 1 1 81 81 ILE CB C 81 38.700 38.700 39.024 -0.324 25153 440 1 . 1 1 81 81 ILE H H 81 7.400 7.400 7.852 -0.452 25153 441 1 . 1 1 82 82 VAL N N 82 127.840 127.840 125.505 2.335 25153 442 1 . 1 1 82 82 VAL HA H 82 5.262 5.262 5.011 0.251 25153 443 1 . 1 1 82 82 VAL C C 82 172.724 172.724 174.328 -1.604 25153 444 1 . 1 1 82 82 VAL CA C 82 60.410 60.410 60.424 -0.014 25153 445 1 . 1 1 82 82 VAL CB C 82 35.400 35.400 35.248 0.152 25153 446 1 . 1 1 82 82 VAL H H 82 8.790 8.790 8.782 0.008 25153 447 1 . 1 1 83 83 ALA N N 83 131.347 131.347 130.169 1.178 25153 448 1 . 1 1 83 83 ALA HA H 83 5.382 5.382 5.313 0.069 25153 449 1 . 1 1 83 83 ALA C C 83 175.750 175.750 176.387 -0.637 25153 450 1 . 1 1 83 83 ALA CA C 83 49.870 49.870 50.115 -0.245 25153 451 1 . 1 1 83 83 ALA CB C 83 23.450 23.450 20.911 2.539 25153 452 1 . 1 1 83 83 ALA H H 83 9.300 9.300 8.929 0.371 25153 453 1 . 1 1 84 84 LEU N N 84 124.200 124.200 126.602 -2.402 25153 454 1 . 1 1 84 84 LEU HA H 84 5.520 5.520 5.670 -0.150 25153 455 1 . 1 1 84 84 LEU C C 84 175.760 175.760 176.833 -1.073 25153 456 1 . 1 1 84 84 LEU CA C 84 53.500 53.500 53.864 -0.363 25153 457 1 . 1 1 84 84 LEU CB C 84 44.900 44.900 43.424 1.476 25153 458 1 . 1 1 84 84 LEU H H 84 10.287 10.287 9.015 1.272 25153 459 1 . 1 1 85 85 TYR N N 85 115.912 115.912 119.011 -3.099 25153 460 1 . 1 1 85 85 TYR HA H 85 4.960 4.960 5.321 -0.361 25153 461 1 . 1 1 85 85 TYR C C 85 172.372 172.372 173.773 -1.401 25153 462 1 . 1 1 85 85 TYR CA C 85 56.100 56.100 55.171 0.929 25153 463 1 . 1 1 85 85 TYR CB C 85 43.030 43.030 41.498 1.532 25153 464 1 . 1 1 85 85 TYR H H 85 9.257 9.257 8.799 0.458 25153 465 1 . 1 1 86 86 GLY N N 86 107.800 107.800 105.802 1.998 25153 466 1 . 1 1 86 86 GLY C C 86 170.330 170.330 171.497 -1.167 25153 467 1 . 1 1 86 86 GLY CA C 86 44.370 44.370 44.786 -0.416 25153 468 1 . 1 1 86 86 GLY H H 86 9.027 9.027 8.675 0.352 25153 469 1 . 1 1 87 87 LEU N N 87 123.458 123.458 118.466 4.992 25153 470 1 . 1 1 87 87 LEU HA H 87 5.465 5.465 5.275 0.190 25153 471 1 . 1 1 87 87 LEU C C 87 178.100 178.100 175.964 2.136 25153 472 1 . 1 1 87 87 LEU CA C 87 53.590 53.590 52.896 0.694 25153 473 1 . 1 1 87 87 LEU CB C 87 45.340 45.340 45.459 -0.119 25153 474 1 . 1 1 87 87 LEU H H 87 6.580 6.580 7.798 -1.218 25153 475 1 . 1 1 88 88 GLY N N 88 108.966 108.966 107.433 1.533 25153 476 1 . 1 1 88 88 GLY C C 88 172.820 172.820 171.541 1.279 25153 477 1 . 1 1 88 88 GLY CA C 88 46.660 46.660 45.508 1.152 25153 478 1 . 1 1 88 88 GLY H H 88 8.070 8.070 8.218 -0.148 25153 479 1 . 1 1 89 89 ASP N N 89 121.150 121.150 117.620 3.530 25153 480 1 . 1 1 89 89 ASP HA H 89 5.246 5.246 5.170 0.077 25153 481 1 . 1 1 89 89 ASP C C 89 176.220 176.220 176.091 0.129 25153 482 1 . 1 1 89 89 ASP CA C 89 52.470 52.470 52.806 -0.336 25153 483 1 . 1 1 89 89 ASP CB C 89 42.480 42.480 43.647 -1.167 25153 484 1 . 1 1 90 90 GLN N N 90 123.970 123.970 122.805 1.165 25153 485 1 . 1 1 90 90 GLN HA H 90 3.488 3.488 4.087 -0.599 25153 486 1 . 1 1 90 90 GLN C C 90 173.646 173.646 176.277 -2.631 25153 487 1 . 1 1 90 90 GLN CA C 90 58.310 58.310 57.478 0.832 25153 488 1 . 1 1 90 90 GLN CB C 90 28.210 28.210 28.712 -0.502 25153 489 1 . 1 1 90 90 GLN H H 90 8.623 8.623 8.727 -0.104 25153 490 1 . 1 1 91 91 LEU N N 91 118.017 118.017 119.628 -1.611 25153 491 1 . 1 1 91 91 LEU HA H 91 4.375 4.375 4.122 0.253 25153 492 1 . 1 1 91 91 LEU C C 91 180.160 180.160 178.700 1.460 25153 493 1 . 1 1 91 91 LEU CA C 91 56.060 56.060 56.363 -0.303 25153 494 1 . 1 1 91 91 LEU CB C 91 41.550 41.550 42.001 -0.451 25153 495 1 . 1 1 91 91 LEU H H 91 7.046 7.046 8.608 -1.562 25153 496 1 . 1 1 92 92 GLY N N 92 110.028 110.028 104.736 5.292 25153 497 1 . 1 1 92 92 GLY C C 92 174.912 174.912 174.336 0.576 25153 498 1 . 1 1 92 92 GLY CA C 92 46.180 46.180 45.578 0.602 25153 499 1 . 1 1 92 92 GLY H H 92 9.238 9.238 8.701 0.537 25153 500 1 . 1 1 93 93 TYR N N 93 115.910 115.910 118.876 -2.966 25153 501 1 . 1 1 93 93 TYR HA H 93 5.009 5.009 5.170 -0.161 25153 502 1 . 1 1 93 93 TYR C C 93 176.850 176.850 177.094 -0.244 25153 503 1 . 1 1 93 93 TYR CA C 93 56.730 56.730 57.057 -0.327 25153 504 1 . 1 1 93 93 TYR CB C 93 38.130 38.130 39.084 -0.954 25153 505 1 . 1 1 93 93 TYR H H 93 6.962 6.962 7.576 -0.614 25153 506 1 . 1 1 94 94 GLY N N 94 111.630 111.630 109.070 2.560 25153 507 1 . 1 1 94 94 GLY C C 94 177.777 177.777 175.676 2.101 25153 508 1 . 1 1 94 94 GLY CA C 94 50.030 50.030 47.140 2.890 25153 509 1 . 1 1 94 94 GLY H H 94 7.835 7.835 8.266 -0.431 25153 510 1 . 1 1 95 95 GLU N N 95 122.450 122.450 120.555 1.895 25153 511 1 . 1 1 95 95 GLU HA H 95 3.918 3.918 3.953 -0.035 25153 512 1 . 1 1 95 95 GLU C C 95 175.300 175.300 176.945 -1.645 25153 513 1 . 1 1 95 95 GLU CA C 95 58.100 58.100 58.550 -0.450 25153 514 1 . 1 1 95 95 GLU CB C 95 27.511 27.511 28.623 -1.112 25153 515 1 . 1 1 96 96 TRP N N 96 118.790 118.790 116.241 2.549 25153 516 1 . 1 1 96 96 TRP HA H 96 5.444 5.444 4.887 0.557 25153 517 1 . 1 1 96 96 TRP C C 96 179.280 179.280 176.223 3.057 25153 518 1 . 1 1 96 96 TRP CA C 96 57.015 57.015 56.171 0.843 25153 519 1 . 1 1 96 96 TRP CB C 96 30.020 30.020 30.187 -0.167 25153 520 1 . 1 1 96 96 TRP H H 96 8.070 8.070 8.055 0.015 25153 521 1 . 1 1 97 97 PHE N N 97 128.067 128.067 122.663 5.404 25153 522 1 . 1 1 97 97 PHE HA H 97 5.305 5.305 4.278 1.027 25153 523 1 . 1 1 97 97 PHE C C 97 173.227 173.227 176.036 -2.809 25153 524 1 . 1 1 97 97 PHE CA C 97 56.720 56.720 59.562 -2.842 25153 525 1 . 1 1 97 97 PHE CB C 97 39.940 39.940 39.204 0.736 25153 526 1 . 1 1 97 97 PHE H H 97 7.165 7.165 8.191 -1.026 25153 527 1 . 1 1 98 98 LEU N N 98 114.306 114.306 123.282 -8.976 25153 528 1 . 1 1 98 98 LEU HA H 98 3.490 3.490 3.712 -0.222 25153 529 1 . 1 1 98 98 LEU C C 98 179.365 179.365 177.379 1.986 25153 530 1 . 1 1 98 98 LEU CA C 98 55.460 55.460 55.433 0.027 25153 531 1 . 1 1 98 98 LEU CB C 98 38.230 38.230 38.697 -0.467 25153 532 1 . 1 1 98 98 LEU H H 98 7.453 7.453 8.532 -1.079 25153 533 1 . 1 1 99 99 ASP N N 99 122.354 122.354 120.803 1.551 25153 534 1 . 1 1 99 99 ASP HA H 99 3.933 3.933 4.329 -0.396 25153 535 1 . 1 1 99 99 ASP C C 99 178.800 178.800 177.241 1.559 25153 536 1 . 1 1 99 99 ASP CA C 99 59.180 59.180 57.733 1.447 25153 537 1 . 1 1 99 99 ASP CB C 99 40.430 40.430 41.403 -0.973 25153 538 1 . 1 1 100 100 ALA N N 100 118.568 118.568 121.808 -3.239 25153 539 1 . 1 1 100 100 ALA HA H 100 3.840 3.840 4.066 -0.226 25153 540 1 . 1 1 100 100 ALA C C 100 178.500 178.500 179.185 -0.685 25153 541 1 . 1 1 100 100 ALA CA C 100 54.916 54.916 55.030 -0.114 25153 542 1 . 1 1 100 100 ALA CB C 100 19.660 19.660 18.447 1.213 25153 543 1 . 1 1 100 100 ALA H H 100 8.682 8.682 7.850 0.832 25153 544 1 . 1 1 101 101 LEU N N 101 118.815 118.815 120.606 -1.791 25153 545 1 . 1 1 101 101 LEU HA H 101 3.680 3.680 3.986 -0.306 25153 546 1 . 1 1 101 101 LEU C C 101 178.930 178.930 178.848 0.082 25153 547 1 . 1 1 101 101 LEU CA C 101 57.700 57.700 57.764 -0.064 25153 548 1 . 1 1 101 101 LEU CB C 101 42.400 42.400 41.552 0.848 25153 549 1 . 1 1 101 101 LEU H H 101 6.637 6.637 7.455 -0.818 25153 550 1 . 1 1 102 102 GLY N N 102 103.700 103.700 106.420 -2.720 25153 551 1 . 1 1 102 102 GLY C C 102 175.530 175.530 176.137 -0.607 25153 552 1 . 1 1 102 102 GLY CA C 102 48.000 48.000 47.288 0.712 25153 553 1 . 1 1 102 102 GLY H H 102 7.330 7.330 7.926 -0.596 25153 554 1 . 1 1 103 103 MET N N 103 120.330 120.330 121.609 -1.279 25153 555 1 . 1 1 103 103 MET HA H 103 4.254 4.254 4.242 0.012 25153 556 1 . 1 1 103 103 MET C C 103 179.688 179.688 178.624 1.064 25153 557 1 . 1 1 103 103 MET CA C 103 59.615 59.615 59.568 0.047 25153 558 1 . 1 1 103 103 MET CB C 103 33.290 33.290 32.622 0.668 25153 559 1 . 1 1 103 103 MET H H 103 8.407 8.407 7.957 0.450 25153 560 1 . 1 1 104 104 LEU N N 104 123.450 123.450 119.904 3.546 25153 561 1 . 1 1 104 104 LEU HA H 104 4.196 4.196 3.713 0.483 25153 562 1 . 1 1 104 104 LEU C C 104 177.620 177.620 178.762 -1.142 25153 563 1 . 1 1 104 104 LEU CA C 104 57.970 57.970 57.899 0.071 25153 564 1 . 1 1 104 104 LEU CB C 104 41.300 41.300 41.274 0.026 25153 565 1 . 1 1 104 104 LEU H H 104 8.330 8.330 8.654 -0.324 25153 566 1 . 1 1 105 105 HIS N N 105 119.040 119.040 119.247 -0.207 25153 567 1 . 1 1 105 105 HIS HA H 105 3.877 3.877 4.061 -0.184 25153 568 1 . 1 1 105 105 HIS C C 105 177.100 177.100 177.049 0.051 25153 569 1 . 1 1 105 105 HIS CA C 105 60.970 60.970 60.832 0.138 25153 570 1 . 1 1 105 105 HIS CB C 105 28.593 28.593 29.805 -1.212 25153 571 1 . 1 1 105 105 HIS H H 105 8.050 8.050 8.380 -0.330 25153 572 1 . 1 1 106 106 ASP N N 106 119.950 119.950 119.212 0.738 25153 573 1 . 1 1 106 106 ASP HA H 106 4.330 4.330 4.428 -0.098 25153 574 1 . 1 1 106 106 ASP C C 106 179.300 179.300 178.430 0.870 25153 575 1 . 1 1 106 106 ASP CA C 106 57.810 57.810 57.089 0.721 25153 576 1 . 1 1 106 106 ASP CB C 106 40.400 40.400 41.159 -0.759 25153 577 1 . 1 1 107 107 LYS N N 107 122.060 122.060 120.037 2.023 25153 578 1 . 1 1 107 107 LYS HA H 107 4.133 4.133 4.060 0.073 25153 579 1 . 1 1 107 107 LYS C C 107 178.100 178.100 179.247 -1.147 25153 580 1 . 1 1 107 107 LYS CA C 107 58.200 58.200 58.689 -0.489 25153 581 1 . 1 1 107 107 LYS CB C 107 32.360 32.360 32.184 0.176 25153 582 1 . 1 1 108 108 LEU N N 108 115.610 115.610 117.592 -1.982 25153 583 1 . 1 1 108 108 LEU HA H 108 4.068 4.068 4.169 -0.102 25153 584 1 . 1 1 108 108 LEU C C 108 178.866 178.866 178.291 0.575 25153 585 1 . 1 1 108 108 LEU CA C 108 55.954 55.954 56.660 -0.706 25153 586 1 . 1 1 108 108 LEU CB C 108 42.160 42.160 41.661 0.499 25153 587 1 . 1 1 108 108 LEU H H 108 7.828 7.828 8.388 -0.560 25153 588 1 . 1 1 109 109 SER N N 109 116.362 116.362 115.287 1.075 25153 589 1 . 1 1 109 109 SER HA H 109 4.299 4.299 4.298 0.001 25153 590 1 . 1 1 109 109 SER C C 109 175.660 175.660 176.783 -1.123 25153 591 1 . 1 1 109 109 SER CA C 109 62.350 62.350 61.320 1.030 25153 592 1 . 1 1 109 109 SER CB C 109 62.815 62.815 63.029 -0.214 25153 593 1 . 1 1 109 109 SER H H 109 8.278 8.278 8.606 -0.328 25153 594 1 . 1 1 110 110 THR N N 110 110.230 110.230 116.093 -5.863 25153 595 1 . 1 1 110 110 THR HA H 110 4.615 4.615 4.245 0.370 25153 596 1 . 1 1 110 110 THR C C 110 175.990 175.990 175.464 0.525 25153 597 1 . 1 1 110 110 THR CA C 110 62.090 62.090 64.305 -2.214 25153 598 1 . 1 1 110 110 THR CB C 110 68.800 68.800 68.749 0.051 25153 599 1 . 1 1 110 110 THR H H 110 7.211 7.211 7.805 -0.594 25153 600 1 . 1 1 111 111 LYS N N 111 119.900 119.900 119.485 0.415 25153 601 1 . 1 1 111 111 LYS HA H 111 4.512 4.512 4.401 0.112 25153 602 1 . 1 1 111 111 LYS C C 111 176.916 176.916 176.516 0.400 25153 603 1 . 1 1 111 111 LYS CA C 111 55.654 55.654 55.362 0.292 25153 604 1 . 1 1 111 111 LYS CB C 111 30.843 30.843 32.030 -1.187 25153 605 1 . 1 1 112 112 GLY N N 112 107.910 107.910 108.082 -0.172 25153 606 1 . 1 1 112 112 GLY C C 112 176.250 176.250 174.089 2.161 25153 607 1 . 1 1 112 112 GLY CA C 112 47.040 47.040 45.650 1.390 25153 608 1 . 1 1 112 112 GLY H H 112 8.366 8.366 7.618 0.748 25153 609 1 . 1 1 113 113 VAL N N 113 113.530 113.530 115.487 -1.957 25153 610 1 . 1 1 113 113 VAL HA H 113 4.474 4.474 4.485 -0.011 25153 611 1 . 1 1 113 113 VAL C C 113 174.630 174.630 174.750 -0.120 25153 612 1 . 1 1 113 113 VAL CA C 113 59.450 59.450 60.612 -1.161 25153 613 1 . 1 1 113 113 VAL CB C 113 32.550 32.550 32.951 -0.401 25153 614 1 . 1 1 113 113 VAL H H 113 6.903 6.903 6.967 -0.064 25153 615 1 . 1 1 114 114 LYS N N 114 123.020 123.020 119.333 3.687 25153 616 1 . 1 1 114 114 LYS HA H 114 4.505 4.505 4.523 -0.018 25153 617 1 . 1 1 114 114 LYS C C 114 175.000 175.000 174.719 0.281 25153 618 1 . 1 1 114 114 LYS CA C 114 54.200 54.200 54.426 -0.226 25153 619 1 . 1 1 114 114 LYS CB C 114 33.340 33.340 34.712 -1.372 25153 620 1 . 1 1 115 115 PHE N N 115 123.290 123.290 120.357 2.933 25153 621 1 . 1 1 115 115 PHE HA H 115 5.713 5.713 5.717 -0.004 25153 622 1 . 1 1 115 115 PHE C C 115 177.605 177.605 176.249 1.356 25153 623 1 . 1 1 115 115 PHE CA C 115 58.610 58.610 56.849 1.761 25153 624 1 . 1 1 115 115 PHE CB C 115 41.000 41.000 41.819 -0.819 25153 625 1 . 1 1 115 115 PHE H H 115 8.494 8.494 8.522 -0.029 25153 626 1 . 1 1 116 116 VAL N N 116 115.790 115.790 114.651 1.139 25153 627 1 . 1 1 116 116 VAL HA H 116 4.492 4.492 4.419 0.073 25153 628 1 . 1 1 116 116 VAL C C 116 175.414 175.414 175.995 -0.581 25153 629 1 . 1 1 116 116 VAL CA C 116 58.986 58.986 59.426 -0.440 25153 630 1 . 1 1 116 116 VAL CB C 116 34.100 34.100 34.583 -0.483 25153 631 1 . 1 1 116 116 VAL H H 116 8.889 8.889 8.397 0.492 25153 632 1 . 1 1 117 117 GLY N N 117 108.300 108.300 107.608 0.692 25153 633 1 . 1 1 117 117 GLY C C 117 176.180 176.180 174.741 1.439 25153 634 1 . 1 1 117 117 GLY CA C 117 47.800 47.800 45.471 2.329 25153 635 1 . 1 1 117 117 GLY H H 117 9.810 9.810 8.619 1.191 25153 636 1 . 1 1 118 118 TYR N N 118 120.050 120.050 119.619 0.431 25153 637 1 . 1 1 118 118 TYR HA H 118 4.954 4.954 4.752 0.202 25153 638 1 . 1 1 118 118 TYR C C 118 177.450 177.450 175.959 1.491 25153 639 1 . 1 1 118 118 TYR CA C 118 56.240 56.240 58.041 -1.801 25153 640 1 . 1 1 118 118 TYR CB C 118 36.110 36.110 39.167 -3.057 25153 641 1 . 1 1 118 118 TYR H H 118 8.592 8.592 7.477 1.115 25153 642 1 . 1 1 119 119 TRP N N 119 125.500 125.500 121.393 4.107 25153 643 1 . 1 1 119 119 TRP HA H 119 6.028 6.028 5.142 0.886 25153 644 1 . 1 1 119 119 TRP C C 119 173.090 173.090 174.140 -1.050 25153 645 1 . 1 1 119 119 TRP CA C 119 53.900 53.900 54.406 -0.506 25153 646 1 . 1 1 119 119 TRP CB C 119 36.250 36.250 33.266 2.984 25153 647 1 . 1 1 119 119 TRP H H 119 7.926 7.926 8.205 -0.278 25153 648 1 . 1 1 120 120 PRO HA H 120 4.810 4.810 4.753 0.057 25153 649 1 . 1 1 120 120 PRO CA C 120 63.680 63.680 62.792 0.888 25153 650 1 . 1 1 120 120 PRO CB C 120 32.250 32.250 32.530 -0.280 25153 651 1 . 1 1 121 121 THR N N 121 109.114 109.114 111.768 -2.654 25153 652 1 . 1 1 121 121 THR HA H 121 4.142 4.142 3.454 0.688 25153 653 1 . 1 1 121 121 THR C C 121 176.300 176.300 175.269 1.031 25153 654 1 . 1 1 121 121 THR CA C 121 61.230 61.230 62.709 -1.479 25153 655 1 . 1 1 121 121 THR CB C 121 69.890 69.890 68.443 1.447 25153 656 1 . 1 1 121 121 THR H H 121 7.356 7.356 8.351 -0.995 25153 657 1 . 1 1 122 122 GLU N N 122 123.980 123.980 121.995 1.985 25153 658 1 . 1 1 122 122 GLU HA H 122 4.238 4.238 4.041 0.197 25153 659 1 . 1 1 122 122 GLU C C 122 177.830 177.830 177.815 0.016 25153 660 1 . 1 1 122 122 GLU CA C 122 58.230 58.230 57.700 0.530 25153 661 1 . 1 1 122 122 GLU CB C 122 29.770 29.770 29.823 -0.053 25153 662 1 . 1 1 123 123 GLY N N 123 114.570 114.570 112.769 1.801 25153 663 1 . 1 1 123 123 GLY C C 123 173.700 173.700 173.984 -0.284 25153 664 1 . 1 1 123 123 GLY CA C 123 45.400 45.400 45.498 -0.099 25153 665 1 . 1 1 123 123 GLY H H 123 9.181 9.181 8.836 0.345 25153 666 1 . 1 1 124 124 TYR N N 124 118.923 118.923 120.352 -1.429 25153 667 1 . 1 1 124 124 TYR HA H 124 5.310 5.310 4.736 0.574 25153 668 1 . 1 1 124 124 TYR C C 124 175.680 175.680 174.981 0.699 25153 669 1 . 1 1 124 124 TYR CA C 124 56.470 56.470 58.086 -1.616 25153 670 1 . 1 1 124 124 TYR CB C 124 41.000 41.000 40.959 0.041 25153 671 1 . 1 1 124 124 TYR H H 124 7.877 7.877 7.717 0.160 25153 672 1 . 1 1 125 125 GLU N N 125 124.890 124.890 121.701 3.189 25153 673 1 . 1 1 125 125 GLU HA H 125 4.700 4.700 4.656 0.044 25153 674 1 . 1 1 125 125 GLU C C 125 172.880 172.880 175.246 -2.366 25153 675 1 . 1 1 125 125 GLU CA C 125 55.430 55.430 55.709 -0.279 25153 676 1 . 1 1 125 125 GLU CB C 125 31.420 31.420 31.816 -0.396 25153 677 1 . 1 1 126 126 PHE N N 126 119.166 119.166 119.855 -0.689 25153 678 1 . 1 1 126 126 PHE HA H 126 4.809 4.809 4.604 0.205 25153 679 1 . 1 1 126 126 PHE C C 126 173.750 173.750 174.733 -0.983 25153 680 1 . 1 1 126 126 PHE CA C 126 56.790 56.790 58.352 -1.562 25153 681 1 . 1 1 126 126 PHE CB C 126 40.050 40.050 39.183 0.867 25153 682 1 . 1 1 126 126 PHE H H 126 7.716 7.716 8.046 -0.330 25153 683 1 . 1 1 127 127 THR N N 127 106.800 106.800 114.682 -7.882 25153 684 1 . 1 1 127 127 THR HA H 127 4.400 4.400 3.337 1.063 25153 685 1 . 1 1 127 127 THR C C 127 175.300 175.300 174.102 1.198 25153 686 1 . 1 1 127 127 THR CA C 127 61.100 61.100 62.982 -1.882 25153 687 1 . 1 1 127 127 THR CB C 127 70.600 70.600 67.963 2.637 25153 688 1 . 1 1 127 127 THR H H 127 7.220 7.220 6.554 0.666 25153 689 1 . 1 1 128 128 SER N N 128 118.360 118.360 115.735 2.625 25153 690 1 . 1 1 128 128 SER HA H 128 4.680 4.680 4.577 0.103 25153 691 1 . 1 1 128 128 SER C C 128 175.720 175.720 173.975 1.745 25153 692 1 . 1 1 128 128 SER CA C 128 56.250 56.250 56.892 -0.642 25153 693 1 . 1 1 128 128 SER CB C 128 65.635 65.635 64.259 1.376 25153 694 1 . 1 1 128 128 SER H H 128 7.411 7.411 8.025 -0.614 25153 695 1 . 1 1 129 129 PRO HA H 129 4.775 4.775 4.606 0.169 25153 696 1 . 1 1 129 129 PRO CA C 129 62.500 62.500 64.162 -1.662 25153 697 1 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.335 0.065 25153 698 1 . 1 1 130 130 LYS N N 130 122.014 122.014 119.802 2.212 25153 699 1 . 1 1 130 130 LYS HA H 130 4.233 4.233 4.377 -0.144 25153 700 1 . 1 1 130 130 LYS CA C 130 61.700 61.700 58.489 3.211 25153 701 1 . 1 1 130 130 LYS CB C 130 30.570 30.570 30.869 -0.299 25153 702 1 . 1 1 131 131 PRO HA H 131 4.518 4.518 4.546 -0.028 25153 703 1 . 1 1 131 131 PRO C C 131 174.000 174.000 175.132 -1.132 25153 704 1 . 1 1 131 131 PRO CA C 131 64.700 64.700 62.442 2.258 25153 705 1 . 1 1 131 131 PRO CB C 131 31.200 31.200 30.201 0.999 25153 706 1 . 1 1 132 132 VAL N N 132 113.260 113.260 116.928 -3.668 25153 707 1 . 1 1 132 132 VAL HA H 132 5.200 5.200 4.885 0.315 25153 708 1 . 1 1 132 132 VAL C C 132 175.210 175.210 174.917 0.293 25153 709 1 . 1 1 132 132 VAL CA C 132 59.620 59.620 60.081 -0.461 25153 710 1 . 1 1 132 132 VAL CB C 132 34.980 34.980 35.984 -1.004 25153 711 1 . 1 1 132 132 VAL H H 132 6.697 6.697 7.578 -0.881 25153 712 1 . 1 1 133 133 ILE N N 133 119.940 119.940 117.570 2.370 25153 713 1 . 1 1 133 133 ILE HA H 133 4.380 4.380 4.497 -0.117 25153 714 1 . 1 1 133 133 ILE C C 133 175.440 175.440 175.319 0.121 25153 715 1 . 1 1 133 133 ILE CA C 133 60.450 60.450 58.856 1.594 25153 716 1 . 1 1 133 133 ILE CB C 133 42.100 42.100 40.159 1.941 25153 717 1 . 1 1 133 133 ILE H H 133 8.756 8.756 8.665 0.091 25153 718 1 . 1 1 134 134 ALA N N 134 122.632 122.632 123.859 -1.227 25153 719 1 . 1 1 134 134 ALA HA H 134 3.960 3.960 3.879 0.081 25153 720 1 . 1 1 134 134 ALA C C 134 178.312 178.312 177.259 1.053 25153 721 1 . 1 1 134 134 ALA CA C 134 53.080 53.080 54.596 -1.516 25153 722 1 . 1 1 134 134 ALA CB C 134 16.836 16.836 17.259 -0.423 25153 723 1 . 1 1 134 134 ALA H H 134 8.523 8.523 8.455 0.068 25153 724 1 . 1 1 135 135 ASP N N 135 117.366 117.366 122.687 -5.321 25153 725 1 . 1 1 135 135 ASP HA H 135 4.252 4.252 4.664 -0.412 25153 726 1 . 1 1 135 135 ASP C C 135 176.387 176.387 176.655 -0.268 25153 727 1 . 1 1 135 135 ASP CA C 135 55.210 55.210 53.363 1.847 25153 728 1 . 1 1 135 135 ASP CB C 135 39.700 39.700 41.252 -1.552 25153 729 1 . 1 1 136 136 GLY N N 136 104.310 104.310 108.047 -3.737 25153 730 1 . 1 1 136 136 GLY C C 136 174.922 174.922 174.933 -0.011 25153 731 1 . 1 1 136 136 GLY CA C 136 45.100 45.100 45.391 -0.291 25153 732 1 . 1 1 136 136 GLY H H 136 7.610 7.610 8.316 -0.706 25153 733 1 . 1 1 137 137 GLN N N 137 118.784 118.784 117.715 1.069 25153 734 1 . 1 1 137 137 GLN HA H 137 4.055 4.055 4.431 -0.376 25153 735 1 . 1 1 137 137 GLN C C 137 176.390 176.390 175.447 0.943 25153 736 1 . 1 1 137 137 GLN CA C 137 57.640 57.640 55.831 1.809 25153 737 1 . 1 1 137 137 GLN CB C 137 30.230 30.230 30.206 0.024 25153 738 1 . 1 1 137 137 GLN H H 137 7.870 7.870 7.868 0.002 25153 739 1 . 1 1 138 138 LEU N N 138 118.040 118.040 116.071 1.969 25153 740 1 . 1 1 138 138 LEU HA H 138 4.987 4.987 5.023 -0.036 25153 741 1 . 1 1 138 138 LEU C C 138 175.913 175.913 175.135 0.778 25153 742 1 . 1 1 138 138 LEU CA C 138 53.600 53.600 53.193 0.407 25153 743 1 . 1 1 138 138 LEU CB C 138 46.400 46.400 44.870 1.530 25153 744 1 . 1 1 138 138 LEU H H 138 7.356 7.356 7.196 0.160 25153 745 1 . 1 1 139 139 PHE N N 139 119.060 119.060 119.412 -0.352 25153 746 1 . 1 1 139 139 PHE HA H 139 5.310 5.310 4.930 0.379 25153 747 1 . 1 1 139 139 PHE C C 139 178.780 178.780 177.683 1.097 25153 748 1 . 1 1 139 139 PHE CA C 139 56.850 56.850 57.326 -0.476 25153 749 1 . 1 1 139 139 PHE CB C 139 43.460 43.460 39.805 3.655 25153 750 1 . 1 1 139 139 PHE H H 139 10.094 10.094 8.930 1.164 25153 751 1 . 1 1 140 140 VAL N N 140 109.690 109.690 115.872 -6.182 25153 752 1 . 1 1 140 140 VAL HA H 140 3.481 3.481 3.572 -0.091 25153 753 1 . 1 1 140 140 VAL C C 140 172.790 172.790 175.583 -2.793 25153 754 1 . 1 1 140 140 VAL CA C 140 62.000 62.000 63.679 -1.679 25153 755 1 . 1 1 140 140 VAL CB C 140 30.550 30.550 31.312 -0.762 25153 756 1 . 1 1 140 140 VAL H H 140 7.470 7.470 8.140 -0.670 25153 757 1 . 1 1 141 141 GLY N N 141 107.060 107.060 105.258 1.802 25153 758 1 . 1 1 141 141 GLY C C 141 171.513 171.513 172.560 -1.047 25153 759 1 . 1 1 141 141 GLY CA C 141 45.430 45.430 44.428 1.002 25153 760 1 . 1 1 141 141 GLY H H 141 7.137 7.137 7.341 -0.204 25153 761 1 . 1 1 142 142 LEU N N 142 117.863 117.863 120.439 -2.576 25153 762 1 . 1 1 142 142 LEU HA H 142 2.975 2.975 4.140 -1.165 25153 763 1 . 1 1 142 142 LEU C C 142 173.640 173.640 175.135 -1.495 25153 764 1 . 1 1 142 142 LEU CA C 142 55.920 55.920 54.706 1.214 25153 765 1 . 1 1 142 142 LEU CB C 142 37.550 37.550 42.281 -4.731 25153 766 1 . 1 1 142 142 LEU H H 142 7.517 7.517 7.685 -0.168 25153 767 1 . 1 1 143 143 ALA N N 143 126.990 126.990 129.032 -2.042 25153 768 1 . 1 1 143 143 ALA HA H 143 4.277 4.277 4.494 -0.217 25153 769 1 . 1 1 143 143 ALA C C 143 175.730 175.730 175.887 -0.157 25153 770 1 . 1 1 143 143 ALA CA C 143 49.440 49.440 50.257 -0.817 25153 771 1 . 1 1 143 143 ALA CB C 143 23.310 23.310 19.426 3.884 25153 772 1 . 1 1 143 143 ALA H H 143 5.186 5.186 8.184 -2.998 25153 773 1 . 1 1 144 144 LEU N N 144 125.477 125.477 123.995 1.482 25153 774 1 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.787 -0.007 25153 775 1 . 1 1 144 144 LEU C C 144 174.473 174.473 175.272 -0.799 25153 776 1 . 1 1 144 144 LEU CA C 144 53.240 53.240 53.603 -0.363 25153 777 1 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.474 -0.174 25153 778 1 . 1 1 144 144 LEU H H 144 8.758 8.758 8.204 0.554 25153 779 1 . 1 1 145 145 ASP N N 145 118.915 118.915 119.170 -0.255 25153 780 1 . 1 1 145 145 ASP HA H 145 5.532 5.532 5.233 0.299 25153 781 1 . 1 1 145 145 ASP C C 145 176.470 176.470 175.982 0.488 25153 782 1 . 1 1 145 145 ASP CA C 145 52.630 52.630 52.998 -0.369 25153 783 1 . 1 1 145 145 ASP CB C 145 43.000 43.000 43.954 -0.954 25153 784 1 . 1 1 146 146 GLU N N 146 124.813 124.813 123.820 0.993 25153 785 1 . 1 1 146 146 GLU HA H 146 4.376 4.376 4.552 -0.176 25153 786 1 . 1 1 146 146 GLU C C 146 177.290 177.290 176.396 0.894 25153 787 1 . 1 1 146 146 GLU CA C 146 56.120 56.120 55.971 0.149 25153 788 1 . 1 1 146 146 GLU CB C 146 30.150 30.150 29.365 0.785 25153 789 1 . 1 1 147 147 THR N N 147 118.328 118.328 113.535 4.793 25153 790 1 . 1 1 147 147 THR HA H 147 4.200 4.200 4.526 -0.326 25153 791 1 . 1 1 147 147 THR C C 147 175.683 175.683 174.641 1.042 25153 792 1 . 1 1 147 147 THR CA C 147 66.250 66.250 63.172 3.078 25153 793 1 . 1 1 147 147 THR CB C 147 69.600 69.600 69.905 -0.305 25153 794 1 . 1 1 147 147 THR H H 147 8.562 8.562 8.713 -0.151 25153 795 1 . 1 1 148 148 ASN N N 148 115.550 115.550 118.018 -2.468 25153 796 1 . 1 1 148 148 ASN HA H 148 4.987 4.987 4.864 0.123 25153 797 1 . 1 1 148 148 ASN C C 148 175.870 175.870 175.814 0.056 25153 798 1 . 1 1 148 148 ASN CA C 148 53.700 53.700 54.360 -0.660 25153 799 1 . 1 1 148 148 ASN CB C 148 41.880 41.880 39.827 2.053 25153 800 1 . 1 1 148 148 ASN H H 148 9.118 9.118 8.760 0.358 25153 801 1 . 1 1 149 149 GLN N N 149 117.400 117.400 119.698 -2.298 25153 802 1 . 1 1 149 149 GLN HA H 149 4.843 4.843 4.293 0.550 25153 803 1 . 1 1 149 149 GLN C C 149 177.780 177.780 176.680 1.100 25153 804 1 . 1 1 149 149 GLN CA C 149 53.900 53.900 55.813 -1.913 25153 805 1 . 1 1 149 149 GLN CB C 149 29.300 29.300 28.472 0.828 25153 806 1 . 1 1 149 149 GLN H H 149 7.555 7.555 8.438 -0.883 25153 807 1 . 1 1 150 150 TYR N N 150 120.674 120.674 117.669 3.005 25153 808 1 . 1 1 150 150 TYR HA H 150 4.528 4.528 4.316 0.212 25153 809 1 . 1 1 150 150 TYR C C 150 177.830 177.830 176.407 1.423 25153 810 1 . 1 1 150 150 TYR CA C 150 58.487 58.487 58.579 -0.092 25153 811 1 . 1 1 150 150 TYR CB C 150 36.600 36.600 36.898 -0.298 25153 812 1 . 1 1 150 150 TYR H H 150 6.983 6.983 7.807 -0.824 25153 813 1 . 1 1 151 151 ASP N N 151 120.810 120.810 119.362 1.448 25153 814 1 . 1 1 151 151 ASP HA H 151 4.515 4.515 4.562 -0.047 25153 815 1 . 1 1 151 151 ASP C C 151 176.400 176.400 177.187 -0.787 25153 816 1 . 1 1 151 151 ASP CA C 151 55.400 55.400 55.774 -0.374 25153 817 1 . 1 1 151 151 ASP CB C 151 39.080 39.080 41.348 -2.268 25153 818 1 . 1 1 152 152 LEU N N 152 118.083 118.083 113.907 4.176 25153 819 1 . 1 1 152 152 LEU HA H 152 4.676 4.676 4.707 -0.032 25153 820 1 . 1 1 152 152 LEU C C 152 178.470 178.470 178.105 0.365 25153 821 1 . 1 1 152 152 LEU CA C 152 54.600 54.600 55.610 -1.010 25153 822 1 . 1 1 152 152 LEU CB C 152 42.600 42.600 43.187 -0.587 25153 823 1 . 1 1 152 152 LEU H H 152 7.453 7.453 7.570 -0.117 25153 824 1 . 1 1 153 153 SER N N 153 116.407 116.407 118.187 -1.780 25153 825 1 . 1 1 153 153 SER HA H 153 3.960 3.960 4.015 -0.055 25153 826 1 . 1 1 153 153 SER C C 153 174.590 174.590 175.822 -1.232 25153 827 1 . 1 1 153 153 SER CA C 153 63.400 63.400 62.812 0.588 25153 828 1 . 1 1 153 153 SER CB C 153 63.100 63.100 62.739 0.361 25153 829 1 . 1 1 153 153 SER H H 153 7.360 7.360 8.518 -1.158 25153 830 1 . 1 1 154 154 ASP N N 154 121.960 121.960 120.963 0.997 25153 831 1 . 1 1 154 154 ASP HA H 154 4.310 4.310 4.343 -0.033 25153 832 1 . 1 1 154 154 ASP C C 154 178.640 178.640 177.787 0.853 25153 833 1 . 1 1 154 154 ASP CA C 154 59.000 59.000 57.370 1.630 25153 834 1 . 1 1 154 154 ASP CB C 154 39.570 39.570 40.930 -1.360 25153 835 1 . 1 1 155 155 GLU N N 155 121.310 121.310 118.865 2.445 25153 836 1 . 1 1 155 155 GLU HA H 155 4.185 4.185 4.094 0.091 25153 837 1 . 1 1 155 155 GLU C C 155 179.600 179.600 178.948 0.652 25153 838 1 . 1 1 155 155 GLU CA C 155 59.450 59.450 59.007 0.443 25153 839 1 . 1 1 155 155 GLU CB C 155 29.400 29.400 29.544 -0.144 25153 840 1 . 1 1 156 156 ARG N N 156 121.394 121.394 119.717 1.677 25153 841 1 . 1 1 156 156 ARG HA H 156 4.300 4.300 4.341 -0.041 25153 842 1 . 1 1 156 156 ARG C C 156 177.330 177.330 178.926 -1.596 25153 843 1 . 1 1 156 156 ARG CA C 156 60.460 60.460 58.128 2.332 25153 844 1 . 1 1 156 156 ARG CB C 156 30.760 30.760 30.097 0.663 25153 845 1 . 1 1 157 157 ILE N N 157 118.390 118.390 121.235 -2.845 25153 846 1 . 1 1 157 157 ILE HA H 157 3.434 3.434 3.754 -0.320 25153 847 1 . 1 1 157 157 ILE C C 157 178.814 178.814 177.702 1.111 25153 848 1 . 1 1 157 157 ILE CA C 157 66.694 66.694 65.986 0.708 25153 849 1 . 1 1 157 157 ILE CB C 157 38.853 38.853 37.888 0.965 25153 850 1 . 1 1 157 157 ILE H H 157 8.966 8.966 8.064 0.902 25153 851 1 . 1 1 158 158 GLN N N 158 120.060 120.060 119.016 1.044 25153 852 1 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.973 -0.017 25153 853 1 . 1 1 158 158 GLN C C 158 178.843 178.843 178.644 0.199 25153 854 1 . 1 1 158 158 GLN CA C 158 60.600 60.600 59.237 1.363 25153 855 1 . 1 1 158 158 GLN CB C 158 28.390 28.390 28.193 0.197 25153 856 1 . 1 1 158 158 GLN H H 158 8.394 8.394 7.977 0.417 25153 857 1 . 1 1 159 159 SER N N 159 115.613 115.613 116.318 -0.705 25153 858 1 . 1 1 159 159 SER HA H 159 4.455 4.455 4.406 0.049 25153 859 1 . 1 1 159 159 SER C C 159 177.330 177.330 176.645 0.685 25153 860 1 . 1 1 159 159 SER CA C 159 62.400 62.400 61.477 0.923 25153 861 1 . 1 1 159 159 SER CB C 159 63.760 63.760 63.219 0.541 25153 862 1 . 1 1 159 159 SER H H 159 8.460 8.460 8.179 0.281 25153 863 1 . 1 1 160 160 TRP N N 160 126.820 126.820 124.947 1.873 25153 864 1 . 1 1 160 160 TRP HA H 160 4.465 4.465 4.069 0.396 25153 865 1 . 1 1 160 160 TRP C C 160 178.050 178.050 177.533 0.517 25153 866 1 . 1 1 160 160 TRP CA C 160 62.700 62.700 61.690 1.010 25153 867 1 . 1 1 160 160 TRP CB C 160 29.360 29.360 29.298 0.062 25153 868 1 . 1 1 160 160 TRP H H 160 9.318 9.318 8.154 1.164 25153 869 1 . 1 1 161 161 CYS N N 161 116.750 116.750 117.893 -1.143 25153 870 1 . 1 1 161 161 CYS HA H 161 3.883 3.883 3.742 0.141 25153 871 1 . 1 1 161 161 CYS C C 161 176.270 176.270 176.853 -0.583 25153 872 1 . 1 1 161 161 CYS CA C 161 65.360 65.360 64.188 1.172 25153 873 1 . 1 1 161 161 CYS CB C 161 27.880 27.880 26.893 0.987 25153 874 1 . 1 1 161 161 CYS H H 161 8.950 8.950 9.019 -0.069 25153 875 1 . 1 1 162 162 GLU N N 162 118.096 118.096 119.698 -1.602 25153 876 1 . 1 1 162 162 GLU HA H 162 3.930 3.930 4.067 -0.137 25153 877 1 . 1 1 162 162 GLU C C 162 178.680 178.680 177.597 1.083 25153 878 1 . 1 1 162 162 GLU CA C 162 59.730 59.730 59.073 0.657 25153 879 1 . 1 1 162 162 GLU CB C 162 29.430 29.430 29.395 0.035 25153 880 1 . 1 1 163 163 GLN N N 163 120.790 120.790 117.864 2.926 25153 881 1 . 1 1 163 163 GLN HA H 163 4.177 4.177 4.116 0.061 25153 882 1 . 1 1 163 163 GLN C C 163 179.690 179.690 178.105 1.585 25153 883 1 . 1 1 163 163 GLN CA C 163 59.540 59.540 57.940 1.601 25153 884 1 . 1 1 163 163 GLN CB C 163 29.000 29.000 28.944 0.056 25153 885 1 . 1 1 163 163 GLN H H 163 8.205 8.205 7.512 0.693 25153 886 1 . 1 1 164 164 ILE N N 164 114.860 114.860 118.897 -4.037 25153 887 1 . 1 1 164 164 ILE HA H 164 4.043 4.043 3.863 0.180 25153 888 1 . 1 1 164 164 ILE C C 164 178.680 178.680 177.319 1.361 25153 889 1 . 1 1 164 164 ILE CA C 164 66.210 66.210 64.015 2.195 25153 890 1 . 1 1 164 164 ILE CB C 164 37.700 37.700 37.605 0.095 25153 891 1 . 1 1 164 164 ILE H H 164 9.005 9.005 7.990 1.015 25153 892 1 . 1 1 165 165 LEU N N 165 123.900 123.900 116.438 7.462 25153 893 1 . 1 1 165 165 LEU HA H 165 4.150 4.150 4.199 -0.049 25153 894 1 . 1 1 165 165 LEU C C 165 180.520 180.520 177.497 3.023 25153 895 1 . 1 1 165 165 LEU CA C 165 58.300 58.300 57.209 1.091 25153 896 1 . 1 1 165 165 LEU CB C 165 41.050 41.050 41.210 -0.160 25153 897 1 . 1 1 165 165 LEU H H 165 7.825 7.825 8.006 -0.181 25153 898 1 . 1 1 166 166 ASN N N 166 120.112 120.112 118.100 2.012 25153 899 1 . 1 1 166 166 ASN HA H 166 4.583 4.583 4.699 -0.116 25153 900 1 . 1 1 166 166 ASN C C 166 178.440 178.440 177.098 1.342 25153 901 1 . 1 1 166 166 ASN CA C 166 56.420 56.420 55.753 0.667 25153 902 1 . 1 1 166 166 ASN CB C 166 38.420 38.420 39.659 -1.239 25153 903 1 . 1 1 166 166 ASN H H 166 7.760 7.760 7.957 -0.197 25153 904 1 . 1 1 167 167 GLU N N 167 121.370 121.370 121.555 -0.185 25153 905 1 . 1 1 167 167 GLU HA H 167 4.103 4.103 4.007 0.096 25153 906 1 . 1 1 167 167 GLU C C 167 180.332 180.332 179.194 1.138 25153 907 1 . 1 1 167 167 GLU CA C 167 60.150 60.150 59.673 0.477 25153 908 1 . 1 1 167 167 GLU CB C 167 31.020 31.020 29.660 1.360 25153 909 1 . 1 1 168 168 MET N N 168 118.532 118.532 117.268 1.264 25153 910 1 . 1 1 168 168 MET HA H 168 4.015 4.015 4.296 -0.281 25153 911 1 . 1 1 168 168 MET C C 168 176.600 176.600 178.015 -1.415 25153 912 1 . 1 1 168 168 MET CA C 168 59.300 59.300 59.247 0.053 25153 913 1 . 1 1 168 168 MET CB C 168 33.400 33.400 32.874 0.526 25153 914 1 . 1 1 168 168 MET H H 168 8.718 8.718 8.412 0.306 25153 915 1 . 1 1 169 169 ALA N N 169 121.922 121.922 122.120 -0.198 25153 916 1 . 1 1 169 169 ALA HA H 169 4.174 4.174 4.082 0.092 25153 917 1 . 1 1 169 169 ALA C C 169 179.410 179.410 179.529 -0.119 25153 918 1 . 1 1 169 169 ALA CA C 169 54.400 54.400 54.721 -0.321 25153 919 1 . 1 1 169 169 ALA CB C 169 18.410 18.410 18.450 -0.040 25153 920 1 . 1 1 169 169 ALA H H 169 7.448 7.448 7.861 -0.413 25153 921 1 . 1 1 170 170 GLU N N 170 117.300 117.300 116.678 0.622 25153 922 1 . 1 1 170 170 GLU HA H 170 4.095 4.095 4.093 0.002 25153 923 1 . 1 1 170 170 GLU C C 170 177.470 177.470 179.040 -1.570 25153 924 1 . 1 1 170 170 GLU CA C 170 57.950 57.950 58.718 -0.768 25153 925 1 . 1 1 170 170 GLU CB C 170 29.775 29.775 29.448 0.327 25153 926 1 . 1 1 171 171 HIS N N 171 117.944 117.944 119.250 -1.306 25153 927 1 . 1 1 171 171 HIS HA H 171 4.500 4.500 4.357 0.143 25153 928 1 . 1 1 171 171 HIS C C 171 175.120 175.120 176.808 -1.688 25153 929 1 . 1 1 171 171 HIS CA C 171 57.200 57.200 58.937 -1.737 25153 930 1 . 1 1 171 171 HIS CB C 171 30.600 30.600 30.047 0.553 25153 931 1 . 1 1 171 171 HIS H H 171 7.788 7.788 7.812 -0.025 25153 932 1 . 1 1 172 172 TYR N N 172 120.040 120.040 117.970 2.070 25153 933 1 . 1 1 172 172 TYR HA H 172 4.593 4.593 4.427 0.166 25153 934 1 . 1 1 172 172 TYR C C 172 174.612 174.612 175.644 -1.032 25153 935 1 . 1 1 172 172 TYR CA C 172 57.980 57.980 58.520 -0.540 25153 936 1 . 1 1 172 172 TYR CB C 172 38.980 38.980 38.666 0.314 25153 937 1 . 1 1 172 172 TYR H H 172 7.820 7.820 7.954 -0.134 25153 stop_ save_