data_19668 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19668 _Entry.PDB_ID 2MI7 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 19668 _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 SER HA H 2 4.560 4.560 4.360 0.200 19668 2 1 1 . 1 1 2 2 SER CA C 2 58.366 58.366 60.115 -1.749 19668 3 1 1 . 1 1 3 3 ARG N N 3 125.213 125.213 119.515 5.698 19668 4 1 1 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.349 -0.083 19668 5 1 1 . 1 1 3 3 ARG C C 3 178.381 178.381 177.247 1.134 19668 6 1 1 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.472 0.924 19668 7 1 1 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.651 1.004 19668 8 1 1 . 1 1 3 3 ARG H H 3 8.874 8.874 8.028 0.846 19668 9 1 1 . 1 1 4 4 VAL N N 4 119.320 119.320 120.886 -1.566 19668 10 1 1 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.833 -0.035 19668 11 1 1 . 1 1 4 4 VAL C C 4 177.004 177.004 177.558 -0.554 19668 12 1 1 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.975 -0.460 19668 13 1 1 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.647 0.156 19668 14 1 1 . 1 1 4 4 VAL H H 4 8.112 8.112 7.577 0.535 19668 15 1 1 . 1 1 5 5 LYS N N 5 122.279 122.279 120.394 1.885 19668 16 1 1 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.982 0.180 19668 17 1 1 . 1 1 5 5 LYS C C 5 178.547 178.547 178.228 0.319 19668 18 1 1 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.919 -0.161 19668 19 1 1 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.818 0.192 19668 20 1 1 . 1 1 5 5 LYS H H 5 7.847 7.847 7.788 0.059 19668 21 1 1 . 1 1 6 6 ALA N N 6 120.295 120.295 121.509 -1.214 19668 22 1 1 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.109 0.102 19668 23 1 1 . 1 1 6 6 ALA C C 6 180.834 180.834 179.770 1.064 19668 24 1 1 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.865 0.038 19668 25 1 1 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.936 0.197 19668 26 1 1 . 1 1 6 6 ALA H H 6 7.975 7.975 8.097 -0.122 19668 27 1 1 . 1 1 7 7 LEU N N 7 119.570 119.570 118.322 1.248 19668 28 1 1 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.041 0.131 19668 29 1 1 . 1 1 7 7 LEU C C 7 178.431 178.431 178.596 -0.165 19668 30 1 1 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.922 -0.243 19668 31 1 1 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.207 0.828 19668 32 1 1 . 1 1 7 7 LEU H H 7 7.650 7.650 7.659 -0.009 19668 33 1 1 . 1 1 8 8 GLU N N 8 119.934 119.934 118.323 1.611 19668 34 1 1 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.048 -0.189 19668 35 1 1 . 1 1 8 8 GLU C C 8 179.534 179.534 178.617 0.917 19668 36 1 1 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.401 0.636 19668 37 1 1 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.743 0.724 19668 38 1 1 . 1 1 8 8 GLU H H 8 8.411 8.411 7.809 0.602 19668 39 1 1 . 1 1 9 9 GLU N N 9 118.234 118.234 119.188 -0.954 19668 40 1 1 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.089 -0.029 19668 41 1 1 . 1 1 9 9 GLU C C 9 179.596 179.596 178.869 0.727 19668 42 1 1 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.334 -0.004 19668 43 1 1 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.449 -0.031 19668 44 1 1 . 1 1 9 9 GLU H H 9 8.206 8.206 7.730 0.476 19668 45 1 1 . 1 1 10 10 LYS N N 10 121.042 121.042 118.937 2.105 19668 46 1 1 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.152 0.031 19668 47 1 1 . 1 1 10 10 LYS C C 10 179.380 179.380 179.180 0.200 19668 48 1 1 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.192 0.133 19668 49 1 1 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.127 0.283 19668 50 1 1 . 1 1 10 10 LYS H H 10 7.931 7.931 7.552 0.379 19668 51 1 1 . 1 1 11 11 VAL N N 11 118.662 118.662 119.954 -1.292 19668 52 1 1 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.902 -0.088 19668 53 1 1 . 1 1 11 11 VAL C C 11 178.845 178.845 178.265 0.580 19668 54 1 1 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.463 1.525 19668 55 1 1 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.095 0.559 19668 56 1 1 . 1 1 11 11 VAL H H 11 8.371 8.371 7.620 0.751 19668 57 1 1 . 1 1 12 12 LYS N N 12 123.188 123.188 119.905 3.283 19668 58 1 1 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.968 0.258 19668 59 1 1 . 1 1 12 12 LYS C C 12 179.098 179.098 178.459 0.639 19668 60 1 1 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.456 0.027 19668 61 1 1 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.324 -0.117 19668 62 1 1 . 1 1 12 12 LYS H H 12 8.276 8.276 7.553 0.723 19668 63 1 1 . 1 1 13 13 ALA N N 13 121.169 121.169 121.654 -0.485 19668 64 1 1 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.068 0.190 19668 65 1 1 . 1 1 13 13 ALA C C 13 180.169 180.169 179.710 0.459 19668 66 1 1 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.809 -0.173 19668 67 1 1 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.257 -0.150 19668 68 1 1 . 1 1 13 13 ALA H H 13 7.829 7.829 7.461 0.368 19668 69 1 1 . 1 1 14 14 LEU N N 14 118.104 118.104 118.206 -0.102 19668 70 1 1 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.012 0.144 19668 71 1 1 . 1 1 14 14 LEU C C 14 177.614 177.614 177.881 -0.267 19668 72 1 1 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.131 -0.526 19668 73 1 1 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.937 0.858 19668 74 1 1 . 1 1 14 14 LEU H H 14 7.781 7.781 7.414 0.367 19668 75 1 1 . 1 1 15 15 GLU N N 15 120.632 120.632 118.827 1.805 19668 76 1 1 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.363 0.004 19668 77 1 1 . 1 1 15 15 GLU C C 15 178.243 178.243 178.492 -0.249 19668 78 1 1 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.560 1.026 19668 79 1 1 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.209 0.620 19668 80 1 1 . 1 1 15 15 GLU H H 15 7.873 7.873 7.318 0.555 19668 81 1 1 . 1 1 16 16 GLU N N 16 115.775 115.775 117.089 -1.314 19668 82 1 1 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.990 -0.031 19668 83 1 1 . 1 1 16 16 GLU C C 16 179.006 179.006 178.541 0.465 19668 84 1 1 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.221 -0.129 19668 85 1 1 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.013 0.340 19668 86 1 1 . 1 1 16 16 GLU H H 16 7.926 7.926 7.826 0.100 19668 87 1 1 . 1 1 17 17 LYS N N 17 118.801 118.801 119.150 -0.349 19668 88 1 1 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.074 0.020 19668 89 1 1 . 1 1 17 17 LYS C C 17 178.853 178.853 178.513 0.340 19668 90 1 1 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.819 -0.348 19668 91 1 1 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.826 0.536 19668 92 1 1 . 1 1 17 17 LYS H H 17 7.518 7.518 7.575 -0.057 19668 93 1 1 . 1 1 18 18 VAL N N 18 118.034 118.034 119.766 -1.732 19668 94 1 1 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.689 -0.177 19668 95 1 1 . 1 1 18 18 VAL C C 18 178.362 178.362 178.015 0.347 19668 96 1 1 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.071 -0.052 19668 97 1 1 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.437 0.212 19668 98 1 1 . 1 1 18 18 VAL H H 18 8.048 8.048 7.050 0.998 19668 99 1 1 . 1 1 19 19 LYS N N 19 118.427 118.427 117.388 1.039 19668 100 1 1 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.062 -0.052 19668 101 1 1 . 1 1 19 19 LYS C C 19 177.706 177.706 177.185 0.521 19668 102 1 1 . 1 1 19 19 LYS CA C 19 58.985 58.985 57.901 1.084 19668 103 1 1 . 1 1 19 19 LYS CB C 19 32.424 32.424 32.212 0.213 19668 104 1 1 . 1 1 19 19 LYS H H 19 8.008 8.008 7.426 0.582 19668 105 1 1 . 1 1 20 20 ALA N N 20 119.177 119.177 118.668 0.509 19668 106 1 1 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.271 0.045 19668 107 1 1 . 1 1 20 20 ALA C C 20 178.269 178.269 179.220 -0.951 19668 108 1 1 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.997 -0.366 19668 109 1 1 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.143 -0.010 19668 110 1 1 . 1 1 20 20 ALA H H 20 7.259 7.259 7.370 -0.111 19668 111 1 1 . 1 1 21 21 LEU N N 21 118.596 118.596 116.035 2.561 19668 112 1 1 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.259 0.002 19668 113 1 1 . 1 1 21 21 LEU C C 21 177.732 177.732 177.340 0.392 19668 114 1 1 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.120 -0.463 19668 115 1 1 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.498 0.635 19668 116 1 1 . 1 1 21 21 LEU H H 21 7.373 7.373 7.280 0.093 19668 117 1 1 . 1 1 22 22 GLY N N 22 107.926 107.926 105.150 2.776 19668 118 1 1 . 1 1 22 22 GLY C C 22 173.362 173.362 172.296 1.066 19668 119 1 1 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.183 0.014 19668 120 1 1 . 1 1 22 22 GLY H H 22 8.144 8.144 7.443 0.701 19668 121 1 1 . 1 1 23 23 GLY N N 23 108.242 108.242 106.641 1.601 19668 122 1 1 . 1 1 23 23 GLY C C 23 174.110 174.110 172.986 1.124 19668 123 1 1 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.169 -0.485 19668 124 1 1 . 1 1 23 23 GLY H H 23 8.157 8.157 7.972 0.185 19668 125 1 1 . 1 1 24 24 GLY N N 24 106.969 106.969 109.783 -2.814 19668 126 1 1 . 1 1 24 24 GLY C C 24 175.172 175.172 174.629 0.543 19668 127 1 1 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.229 -0.790 19668 128 1 1 . 1 1 24 24 GLY H H 24 8.466 8.466 7.872 0.594 19668 129 1 1 . 1 1 25 25 GLY N N 25 108.946 108.946 107.497 1.449 19668 130 1 1 . 1 1 25 25 GLY C C 25 176.321 176.321 176.042 0.279 19668 131 1 1 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.182 0.917 19668 132 1 1 . 1 1 25 25 GLY H H 25 8.618 8.618 8.381 0.237 19668 133 1 1 . 1 1 26 26 ARG N N 26 123.559 123.559 120.807 2.752 19668 134 1 1 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.492 -0.213 19668 135 1 1 . 1 1 26 26 ARG C C 26 178.076 178.076 178.162 -0.086 19668 136 1 1 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.632 -0.717 19668 137 1 1 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.283 -0.373 19668 138 1 1 . 1 1 26 26 ARG H H 26 8.789 8.789 8.324 0.465 19668 139 1 1 . 1 1 27 27 ILE N N 27 118.726 118.726 118.871 -0.145 19668 140 1 1 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.880 -0.094 19668 141 1 1 . 1 1 27 27 ILE C C 27 177.639 177.639 178.328 -0.689 19668 142 1 1 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.370 0.254 19668 143 1 1 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.586 0.369 19668 144 1 1 . 1 1 27 27 ILE H H 27 7.762 7.762 8.062 -0.300 19668 145 1 1 . 1 1 28 28 GLU N N 28 119.843 119.843 118.506 1.337 19668 146 1 1 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.980 0.033 19668 147 1 1 . 1 1 28 28 GLU C C 28 179.447 179.447 179.034 0.413 19668 148 1 1 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.674 -0.091 19668 149 1 1 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.365 -0.305 19668 150 1 1 . 1 1 28 28 GLU H H 28 7.867 7.867 7.905 -0.038 19668 151 1 1 . 1 1 29 29 GLU N N 29 118.447 118.447 118.958 -0.511 19668 152 1 1 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.099 -0.012 19668 153 1 1 . 1 1 29 29 GLU C C 29 179.310 179.310 178.866 0.444 19668 154 1 1 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.562 0.717 19668 155 1 1 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.101 0.235 19668 156 1 1 . 1 1 29 29 GLU H H 29 7.755 7.755 7.640 0.115 19668 157 1 1 . 1 1 30 30 LEU N N 30 121.135 121.135 121.527 -0.392 19668 158 1 1 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.997 0.099 19668 159 1 1 . 1 1 30 30 LEU C C 30 178.928 178.928 178.734 0.194 19668 160 1 1 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.164 -0.059 19668 161 1 1 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.139 -0.459 19668 162 1 1 . 1 1 30 30 LEU H H 30 7.785 7.785 7.606 0.179 19668 163 1 1 . 1 1 31 31 LYS N N 31 119.130 119.130 117.768 1.362 19668 164 1 1 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.093 -0.223 19668 165 1 1 . 1 1 31 31 LYS C C 31 179.104 179.104 178.971 0.133 19668 166 1 1 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.443 1.273 19668 167 1 1 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.834 0.422 19668 168 1 1 . 1 1 31 31 LYS H H 31 8.413 8.413 7.627 0.786 19668 169 1 1 . 1 1 32 32 LYS N N 32 119.200 119.200 118.718 0.482 19668 170 1 1 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.996 0.106 19668 171 1 1 . 1 1 32 32 LYS C C 32 179.420 179.420 178.886 0.534 19668 172 1 1 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.340 0.117 19668 173 1 1 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.183 0.083 19668 174 1 1 . 1 1 32 32 LYS H H 32 7.826 7.826 7.599 0.227 19668 175 1 1 . 1 1 33 33 LYS N N 33 120.322 120.322 119.098 1.224 19668 176 1 1 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.077 0.086 19668 177 1 1 . 1 1 33 33 LYS C C 33 179.174 179.174 178.919 0.255 19668 178 1 1 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.567 0.181 19668 179 1 1 . 1 1 33 33 LYS CB C 33 31.739 31.739 31.840 -0.101 19668 180 1 1 . 1 1 33 33 LYS H H 33 8.003 8.003 7.735 0.268 19668 181 1 1 . 1 1 34 34 TYR N N 34 120.223 120.223 117.976 2.247 19668 182 1 1 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.143 -0.087 19668 183 1 1 . 1 1 34 34 TYR C C 34 176.356 176.356 177.663 -1.307 19668 184 1 1 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.922 -0.867 19668 185 1 1 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.235 -0.208 19668 186 1 1 . 1 1 34 34 TYR H H 34 8.614 8.614 7.488 1.126 19668 187 1 1 . 1 1 35 35 GLU N N 35 118.813 118.813 117.304 1.509 19668 188 1 1 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.965 -0.240 19668 189 1 1 . 1 1 35 35 GLU C C 35 179.787 179.787 178.943 0.844 19668 190 1 1 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.086 -0.647 19668 191 1 1 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.994 0.134 19668 192 1 1 . 1 1 35 35 GLU H H 35 8.103 8.103 7.829 0.274 19668 193 1 1 . 1 1 36 36 GLU N N 36 119.670 119.670 119.482 0.188 19668 194 1 1 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.085 -0.071 19668 195 1 1 . 1 1 36 36 GLU C C 36 179.295 179.295 178.985 0.310 19668 196 1 1 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.325 -0.062 19668 197 1 1 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.461 0.108 19668 198 1 1 . 1 1 36 36 GLU H H 36 8.028 8.028 7.603 0.425 19668 199 1 1 . 1 1 37 37 LEU N N 37 121.416 121.416 119.729 1.687 19668 200 1 1 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.031 -0.012 19668 201 1 1 . 1 1 37 37 LEU C C 37 178.277 178.277 179.222 -0.945 19668 202 1 1 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.012 -0.172 19668 203 1 1 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.354 0.275 19668 204 1 1 . 1 1 37 37 LEU H H 37 8.176 8.176 7.387 0.789 19668 205 1 1 . 1 1 38 38 LYS N N 38 118.998 118.998 118.469 0.529 19668 206 1 1 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.947 -0.287 19668 207 1 1 . 1 1 38 38 LYS C C 38 178.923 178.923 179.284 -0.361 19668 208 1 1 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.019 0.381 19668 209 1 1 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.102 -0.040 19668 210 1 1 . 1 1 38 38 LYS H H 38 8.260 8.260 7.658 0.602 19668 211 1 1 . 1 1 39 39 LYS N N 39 118.070 118.070 118.908 -0.838 19668 212 1 1 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.005 0.075 19668 213 1 1 . 1 1 39 39 LYS C C 39 178.687 178.687 179.030 -0.343 19668 214 1 1 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.355 -0.419 19668 215 1 1 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.233 -0.084 19668 216 1 1 . 1 1 39 39 LYS H H 39 7.380 7.380 7.617 -0.237 19668 217 1 1 . 1 1 40 40 LYS N N 40 118.894 118.894 120.150 -1.256 19668 218 1 1 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.060 -0.001 19668 219 1 1 . 1 1 40 40 LYS C C 40 179.758 179.758 179.105 0.653 19668 220 1 1 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.352 -0.290 19668 221 1 1 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.398 -0.010 19668 222 1 1 . 1 1 40 40 LYS H H 40 7.919 7.919 7.470 0.449 19668 223 1 1 . 1 1 41 41 ILE N N 41 118.270 118.270 118.223 0.047 19668 224 1 1 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.806 -0.109 19668 225 1 1 . 1 1 41 41 ILE C C 41 178.211 178.211 177.653 0.558 19668 226 1 1 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.514 0.200 19668 227 1 1 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.822 0.017 19668 228 1 1 . 1 1 41 41 ILE H H 41 8.199 8.199 7.518 0.681 19668 229 1 1 . 1 1 42 42 GLU N N 42 120.117 120.117 117.937 2.180 19668 230 1 1 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.101 -0.010 19668 231 1 1 . 1 1 42 42 GLU C C 42 178.736 178.736 177.320 1.416 19668 232 1 1 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.601 0.279 19668 233 1 1 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.908 -0.517 19668 234 1 1 . 1 1 42 42 GLU H H 42 7.738 7.738 7.563 0.175 19668 235 1 1 . 1 1 43 43 GLU N N 43 117.194 117.194 117.223 -0.029 19668 236 1 1 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.201 0.098 19668 237 1 1 . 1 1 43 43 GLU C C 43 177.658 177.658 177.275 0.383 19668 238 1 1 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.767 0.026 19668 239 1 1 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.282 -0.348 19668 240 1 1 . 1 1 43 43 GLU H H 43 7.698 7.698 7.515 0.183 19668 241 1 1 . 1 1 44 44 LEU N N 44 120.812 120.812 121.656 -0.844 19668 242 1 1 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.134 0.105 19668 243 1 1 . 1 1 44 44 LEU C C 44 178.682 178.682 178.050 0.632 19668 244 1 1 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.605 0.891 19668 245 1 1 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.029 0.618 19668 246 1 1 . 1 1 44 44 LEU H H 44 7.593 7.593 7.625 -0.032 19668 247 1 1 . 1 1 45 45 GLY N N 45 108.681 108.681 111.525 -2.844 19668 248 1 1 . 1 1 45 45 GLY C C 45 174.957 174.957 173.814 1.143 19668 249 1 1 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.425 0.661 19668 250 1 1 . 1 1 45 45 GLY H H 45 8.234 8.234 8.382 -0.148 19668 251 1 1 . 1 1 46 46 GLY N N 46 108.057 108.057 106.698 1.359 19668 252 1 1 . 1 1 46 46 GLY C C 46 174.777 174.777 173.446 1.331 19668 253 1 1 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.771 0.593 19668 254 1 1 . 1 1 46 46 GLY H H 46 8.182 8.182 7.653 0.529 19668 255 1 1 . 1 1 47 47 GLY N N 47 108.494 108.494 109.524 -1.030 19668 256 1 1 . 1 1 47 47 GLY C C 47 174.572 174.572 174.422 0.150 19668 257 1 1 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.583 -0.428 19668 258 1 1 . 1 1 47 47 GLY H H 47 8.087 8.087 7.997 0.090 19668 259 1 1 . 1 1 48 48 GLY N N 48 108.285 108.285 107.198 1.087 19668 260 1 1 . 1 1 48 48 GLY C C 48 174.495 174.495 174.417 0.078 19668 261 1 1 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.159 0.295 19668 262 1 1 . 1 1 48 48 GLY H H 48 8.323 8.323 8.318 0.005 19668 263 1 1 . 1 1 49 49 GLU N N 49 121.070 121.070 120.222 0.848 19668 264 1 1 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.490 -0.073 19668 265 1 1 . 1 1 49 49 GLU C C 49 177.226 177.226 178.007 -0.781 19668 266 1 1 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.178 -0.607 19668 267 1 1 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.009 -0.343 19668 268 1 1 . 1 1 49 49 GLU H H 49 8.483 8.483 8.242 0.241 19668 269 1 1 . 1 1 50 50 VAL N N 50 121.794 121.794 117.394 4.400 19668 270 1 1 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.644 0.137 19668 271 1 1 . 1 1 50 50 VAL C C 50 176.860 176.860 177.397 -0.537 19668 272 1 1 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.644 -0.564 19668 273 1 1 . 1 1 50 50 VAL CB C 50 32.253 32.253 30.977 1.276 19668 274 1 1 . 1 1 50 50 VAL H H 50 8.068 8.068 7.687 0.381 19668 275 1 1 . 1 1 51 51 LYS N N 51 120.593 120.593 119.097 1.496 19668 276 1 1 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.376 -0.169 19668 277 1 1 . 1 1 51 51 LYS C C 51 178.667 178.667 178.592 0.075 19668 278 1 1 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.749 0.586 19668 279 1 1 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.903 0.355 19668 280 1 1 . 1 1 51 51 LYS H H 51 8.253 8.253 8.370 -0.117 19668 281 1 1 . 1 1 52 52 LYS N N 52 117.572 117.572 120.126 -2.554 19668 282 1 1 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.057 0.111 19668 283 1 1 . 1 1 52 52 LYS C C 52 179.248 179.248 178.919 0.329 19668 284 1 1 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.480 -0.466 19668 285 1 1 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.324 -0.144 19668 286 1 1 . 1 1 52 52 LYS H H 52 7.629 7.629 7.647 -0.018 19668 287 1 1 . 1 1 53 53 VAL N N 53 119.059 119.059 119.120 -0.061 19668 288 1 1 . 1 1 53 53 VAL HA H 53 3.792 3.792 4.019 -0.228 19668 289 1 1 . 1 1 53 53 VAL C C 53 177.987 177.987 178.236 -0.249 19668 290 1 1 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.879 1.153 19668 291 1 1 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.286 0.085 19668 292 1 1 . 1 1 53 53 VAL H H 53 7.638 7.638 7.438 0.200 19668 293 1 1 . 1 1 54 54 GLU N N 54 120.388 120.388 119.556 0.832 19668 294 1 1 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.951 -0.107 19668 295 1 1 . 1 1 54 54 GLU C C 54 179.624 179.624 178.841 0.783 19668 296 1 1 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.833 0.408 19668 297 1 1 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.198 0.620 19668 298 1 1 . 1 1 54 54 GLU H H 54 8.603 8.603 7.679 0.924 19668 299 1 1 . 1 1 55 55 GLU N N 55 118.533 118.533 119.297 -0.764 19668 300 1 1 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.027 0.062 19668 301 1 1 . 1 1 55 55 GLU C C 55 179.158 179.158 178.760 0.398 19668 302 1 1 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.368 -0.035 19668 303 1 1 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.769 -0.432 19668 304 1 1 . 1 1 55 55 GLU H H 55 7.904 7.904 7.667 0.237 19668 305 1 1 . 1 1 56 56 GLU N N 56 120.258 120.258 118.907 1.351 19668 306 1 1 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.028 0.072 19668 307 1 1 . 1 1 56 56 GLU C C 56 179.867 179.867 178.833 1.034 19668 308 1 1 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.802 0.861 19668 309 1 1 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.201 0.849 19668 310 1 1 . 1 1 56 56 GLU H H 56 7.902 7.902 7.626 0.276 19668 311 1 1 . 1 1 57 57 VAL N N 57 121.168 121.168 120.718 0.450 19668 312 1 1 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.486 0.082 19668 313 1 1 . 1 1 57 57 VAL C C 57 176.994 176.994 177.290 -0.296 19668 314 1 1 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.523 1.373 19668 315 1 1 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.526 0.001 19668 316 1 1 . 1 1 57 57 VAL H H 57 8.613 8.613 7.458 1.155 19668 317 1 1 . 1 1 58 58 LYS N N 58 120.234 120.234 118.150 2.084 19668 318 1 1 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.982 0.220 19668 319 1 1 . 1 1 58 58 LYS C C 58 179.131 179.131 178.854 0.277 19668 320 1 1 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.342 0.245 19668 321 1 1 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.034 0.257 19668 322 1 1 . 1 1 58 58 LYS H H 58 7.810 7.810 7.567 0.243 19668 323 1 1 . 1 1 59 59 LYS N N 59 118.301 118.301 118.825 -0.524 19668 324 1 1 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.024 0.069 19668 325 1 1 . 1 1 59 59 LYS C C 59 179.281 179.281 178.474 0.807 19668 326 1 1 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.120 0.308 19668 327 1 1 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.102 0.277 19668 328 1 1 . 1 1 59 59 LYS H H 59 7.876 7.876 7.458 0.418 19668 329 1 1 . 1 1 60 60 LEU N N 60 121.224 121.224 120.210 1.014 19668 330 1 1 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.009 0.225 19668 331 1 1 . 1 1 60 60 LEU C C 60 178.636 178.636 178.758 -0.122 19668 332 1 1 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.807 0.350 19668 333 1 1 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.299 0.335 19668 334 1 1 . 1 1 60 60 LEU H H 60 7.893 7.893 7.559 0.334 19668 335 1 1 . 1 1 61 61 GLU N N 61 118.660 118.660 118.095 0.565 19668 336 1 1 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.079 -0.280 19668 337 1 1 . 1 1 61 61 GLU C C 61 179.094 179.094 178.804 0.290 19668 338 1 1 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.991 1.281 19668 339 1 1 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.534 1.469 19668 340 1 1 . 1 1 61 61 GLU H H 61 8.644 8.644 7.813 0.831 19668 341 1 1 . 1 1 62 62 GLU N N 62 117.555 117.555 119.744 -2.189 19668 342 1 1 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.010 -0.014 19668 343 1 1 . 1 1 62 62 GLU C C 62 178.940 178.940 179.035 -0.095 19668 344 1 1 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.498 -0.330 19668 345 1 1 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.356 0.191 19668 346 1 1 . 1 1 62 62 GLU H H 62 7.995 7.995 7.534 0.461 19668 347 1 1 . 1 1 63 63 GLU N N 63 119.097 119.097 118.223 0.874 19668 348 1 1 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.139 -0.110 19668 349 1 1 . 1 1 63 63 GLU C C 63 179.890 179.890 179.093 0.797 19668 350 1 1 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.647 0.694 19668 351 1 1 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.983 0.684 19668 352 1 1 . 1 1 63 63 GLU H H 63 7.983 7.983 7.751 0.232 19668 353 1 1 . 1 1 64 64 ILE N N 64 118.247 118.247 118.055 0.192 19668 354 1 1 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.826 -0.106 19668 355 1 1 . 1 1 64 64 ILE C C 64 177.858 177.858 177.716 0.142 19668 356 1 1 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.330 0.166 19668 357 1 1 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.537 0.444 19668 358 1 1 . 1 1 64 64 ILE H H 64 8.261 8.261 7.298 0.963 19668 359 1 1 . 1 1 65 65 LYS N N 65 118.693 118.693 118.549 0.144 19668 360 1 1 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.132 -0.034 19668 361 1 1 . 1 1 65 65 LYS C C 65 177.244 177.244 177.832 -0.588 19668 362 1 1 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.750 -0.097 19668 363 1 1 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.373 0.332 19668 364 1 1 . 1 1 65 65 LYS H H 65 7.661 7.661 7.516 0.145 19668 365 1 1 . 1 1 66 66 LYS N N 66 116.933 116.933 117.060 -0.127 19668 366 1 1 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.052 0.286 19668 367 1 1 . 1 1 66 66 LYS C C 66 176.011 176.011 176.728 -0.717 19668 368 1 1 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.336 -1.877 19668 369 1 1 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.936 0.195 19668 370 1 1 . 1 1 66 66 LYS H H 66 7.261 7.261 7.681 -0.420 19668 371 1 2 . 1 1 2 2 SER HA H 2 4.560 4.560 4.009 0.551 19668 372 1 2 . 1 1 2 2 SER CA C 2 58.366 58.366 60.720 -2.354 19668 373 1 2 . 1 1 3 3 ARG N N 3 125.213 125.213 121.534 3.679 19668 374 1 2 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.225 0.041 19668 375 1 2 . 1 1 3 3 ARG C C 3 178.381 178.381 178.039 0.342 19668 376 1 2 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.775 -0.379 19668 377 1 2 . 1 1 3 3 ARG CB C 3 30.655 30.655 30.032 0.623 19668 378 1 2 . 1 1 3 3 ARG H H 3 8.874 8.874 8.454 0.420 19668 379 1 2 . 1 1 4 4 VAL N N 4 119.320 119.320 120.063 -0.743 19668 380 1 2 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.749 0.049 19668 381 1 2 . 1 1 4 4 VAL C C 4 177.004 177.004 177.842 -0.838 19668 382 1 2 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.501 -0.986 19668 383 1 2 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.527 0.276 19668 384 1 2 . 1 1 4 4 VAL H H 4 8.112 8.112 7.585 0.527 19668 385 1 2 . 1 1 5 5 LYS N N 5 122.279 122.279 120.391 1.888 19668 386 1 2 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.063 0.099 19668 387 1 2 . 1 1 5 5 LYS C C 5 178.547 178.547 178.125 0.422 19668 388 1 2 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.792 -0.034 19668 389 1 2 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.693 0.317 19668 390 1 2 . 1 1 5 5 LYS H H 5 7.847 7.847 8.209 -0.362 19668 391 1 2 . 1 1 6 6 ALA N N 6 120.295 120.295 121.648 -1.353 19668 392 1 2 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.085 0.126 19668 393 1 2 . 1 1 6 6 ALA C C 6 180.834 180.834 179.446 1.388 19668 394 1 2 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.969 -0.066 19668 395 1 2 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.184 -0.052 19668 396 1 2 . 1 1 6 6 ALA H H 6 7.975 7.975 7.672 0.303 19668 397 1 2 . 1 1 7 7 LEU N N 7 119.570 119.570 118.261 1.309 19668 398 1 2 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.070 0.102 19668 399 1 2 . 1 1 7 7 LEU C C 7 178.431 178.431 178.522 -0.091 19668 400 1 2 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.917 -0.238 19668 401 1 2 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.088 0.947 19668 402 1 2 . 1 1 7 7 LEU H H 7 7.650 7.650 7.665 -0.015 19668 403 1 2 . 1 1 8 8 GLU N N 8 119.934 119.934 118.648 1.286 19668 404 1 2 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.038 -0.179 19668 405 1 2 . 1 1 8 8 GLU C C 8 179.534 179.534 178.432 1.102 19668 406 1 2 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.177 0.860 19668 407 1 2 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.905 0.562 19668 408 1 2 . 1 1 8 8 GLU H H 8 8.411 8.411 7.891 0.520 19668 409 1 2 . 1 1 9 9 GLU N N 9 118.234 118.234 119.601 -1.367 19668 410 1 2 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.020 0.040 19668 411 1 2 . 1 1 9 9 GLU C C 9 179.596 179.596 179.004 0.592 19668 412 1 2 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.190 0.140 19668 413 1 2 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.237 0.181 19668 414 1 2 . 1 1 9 9 GLU H H 9 8.206 8.206 7.768 0.438 19668 415 1 2 . 1 1 10 10 LYS N N 10 121.042 121.042 119.226 1.816 19668 416 1 2 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.109 0.074 19668 417 1 2 . 1 1 10 10 LYS C C 10 179.380 179.380 178.946 0.434 19668 418 1 2 . 1 1 10 10 LYS CA C 10 59.325 59.325 58.902 0.423 19668 419 1 2 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.208 0.202 19668 420 1 2 . 1 1 10 10 LYS H H 10 7.931 7.931 7.561 0.370 19668 421 1 2 . 1 1 11 11 VAL N N 11 118.662 118.662 120.666 -2.004 19668 422 1 2 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.826 -0.012 19668 423 1 2 . 1 1 11 11 VAL C C 11 178.845 178.845 178.306 0.539 19668 424 1 2 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.872 0.116 19668 425 1 2 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.721 -0.067 19668 426 1 2 . 1 1 11 11 VAL H H 11 8.371 8.371 7.597 0.774 19668 427 1 2 . 1 1 12 12 LYS N N 12 123.188 123.188 119.260 3.928 19668 428 1 2 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.851 0.375 19668 429 1 2 . 1 1 12 12 LYS C C 12 179.098 179.098 178.304 0.794 19668 430 1 2 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.725 -0.242 19668 431 1 2 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.180 0.026 19668 432 1 2 . 1 1 12 12 LYS H H 12 8.276 8.276 7.552 0.724 19668 433 1 2 . 1 1 13 13 ALA N N 13 121.169 121.169 121.763 -0.594 19668 434 1 2 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.044 0.214 19668 435 1 2 . 1 1 13 13 ALA C C 13 180.169 180.169 179.418 0.751 19668 436 1 2 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.889 -0.253 19668 437 1 2 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.417 -0.310 19668 438 1 2 . 1 1 13 13 ALA H H 13 7.829 7.829 7.418 0.411 19668 439 1 2 . 1 1 14 14 LEU N N 14 118.104 118.104 118.326 -0.222 19668 440 1 2 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.010 0.146 19668 441 1 2 . 1 1 14 14 LEU C C 14 177.614 177.614 177.851 -0.237 19668 442 1 2 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.148 -0.543 19668 443 1 2 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.907 0.888 19668 444 1 2 . 1 1 14 14 LEU H H 14 7.781 7.781 7.404 0.377 19668 445 1 2 . 1 1 15 15 GLU N N 15 120.632 120.632 118.918 1.714 19668 446 1 2 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.367 -0.000 19668 447 1 2 . 1 1 15 15 GLU C C 15 178.243 178.243 178.702 -0.459 19668 448 1 2 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.559 1.027 19668 449 1 2 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.971 0.858 19668 450 1 2 . 1 1 15 15 GLU H H 15 7.873 7.873 7.277 0.596 19668 451 1 2 . 1 1 16 16 GLU N N 16 115.775 115.775 117.248 -1.473 19668 452 1 2 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.001 -0.042 19668 453 1 2 . 1 1 16 16 GLU C C 16 179.006 179.006 178.684 0.322 19668 454 1 2 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.885 0.207 19668 455 1 2 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.439 -0.086 19668 456 1 2 . 1 1 16 16 GLU H H 16 7.926 7.926 7.667 0.259 19668 457 1 2 . 1 1 17 17 LYS N N 17 118.801 118.801 119.313 -0.512 19668 458 1 2 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.094 0.000 19668 459 1 2 . 1 1 17 17 LYS C C 17 178.853 178.853 178.751 0.102 19668 460 1 2 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.962 -0.491 19668 461 1 2 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.908 0.454 19668 462 1 2 . 1 1 17 17 LYS H H 17 7.518 7.518 7.347 0.171 19668 463 1 2 . 1 1 18 18 VAL N N 18 118.034 118.034 119.773 -1.739 19668 464 1 2 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.712 -0.200 19668 465 1 2 . 1 1 18 18 VAL C C 18 178.362 178.362 177.760 0.602 19668 466 1 2 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.965 0.054 19668 467 1 2 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.434 0.215 19668 468 1 2 . 1 1 18 18 VAL H H 18 8.048 8.048 7.513 0.535 19668 469 1 2 . 1 1 19 19 LYS N N 19 118.427 118.427 117.603 0.824 19668 470 1 2 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.194 -0.184 19668 471 1 2 . 1 1 19 19 LYS C C 19 177.706 177.706 178.569 -0.863 19668 472 1 2 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.207 0.778 19668 473 1 2 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.465 0.959 19668 474 1 2 . 1 1 19 19 LYS H H 19 8.008 8.008 7.427 0.581 19668 475 1 2 . 1 1 20 20 ALA N N 20 119.177 119.177 121.341 -2.164 19668 476 1 2 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.339 -0.023 19668 477 1 2 . 1 1 20 20 ALA C C 20 178.269 178.269 178.980 -0.711 19668 478 1 2 . 1 1 20 20 ALA CA C 20 52.631 52.631 54.022 -1.391 19668 479 1 2 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.573 0.560 19668 480 1 2 . 1 1 20 20 ALA H H 20 7.259 7.259 7.554 -0.295 19668 481 1 2 . 1 1 21 21 LEU N N 21 118.596 118.596 114.559 4.037 19668 482 1 2 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.233 0.028 19668 483 1 2 . 1 1 21 21 LEU C C 21 177.732 177.732 176.974 0.758 19668 484 1 2 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.600 0.057 19668 485 1 2 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.209 0.924 19668 486 1 2 . 1 1 21 21 LEU H H 21 7.373 7.373 7.341 0.032 19668 487 1 2 . 1 1 22 22 GLY N N 22 107.926 107.926 104.791 3.135 19668 488 1 2 . 1 1 22 22 GLY C C 22 173.362 173.362 172.340 1.022 19668 489 1 2 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.252 0.945 19668 490 1 2 . 1 1 22 22 GLY H H 22 8.144 8.144 7.144 1.000 19668 491 1 2 . 1 1 23 23 GLY N N 23 108.242 108.242 105.324 2.918 19668 492 1 2 . 1 1 23 23 GLY C C 23 174.110 174.110 172.820 1.290 19668 493 1 2 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.943 -0.259 19668 494 1 2 . 1 1 23 23 GLY H H 23 8.157 8.157 8.102 0.055 19668 495 1 2 . 1 1 24 24 GLY N N 24 106.969 106.969 109.005 -2.036 19668 496 1 2 . 1 1 24 24 GLY C C 24 175.172 175.172 174.499 0.673 19668 497 1 2 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.087 -0.648 19668 498 1 2 . 1 1 24 24 GLY H H 24 8.466 8.466 8.320 0.146 19668 499 1 2 . 1 1 25 25 GLY N N 25 108.946 108.946 110.880 -1.934 19668 500 1 2 . 1 1 25 25 GLY C C 25 176.321 176.321 174.506 1.815 19668 501 1 2 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.285 1.814 19668 502 1 2 . 1 1 25 25 GLY H H 25 8.618 8.618 7.830 0.788 19668 503 1 2 . 1 1 26 26 ARG N N 26 123.559 123.559 122.728 0.831 19668 504 1 2 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.367 -0.088 19668 505 1 2 . 1 1 26 26 ARG C C 26 178.076 178.076 178.428 -0.352 19668 506 1 2 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.953 -1.038 19668 507 1 2 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.119 -0.209 19668 508 1 2 . 1 1 26 26 ARG H H 26 8.789 8.789 8.588 0.201 19668 509 1 2 . 1 1 27 27 ILE N N 27 118.726 118.726 118.791 -0.065 19668 510 1 2 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.802 -0.016 19668 511 1 2 . 1 1 27 27 ILE C C 27 177.639 177.639 178.006 -0.367 19668 512 1 2 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.945 -1.321 19668 513 1 2 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.269 -0.313 19668 514 1 2 . 1 1 27 27 ILE H H 27 7.762 7.762 8.038 -0.276 19668 515 1 2 . 1 1 28 28 GLU N N 28 119.843 119.843 119.242 0.601 19668 516 1 2 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.945 0.068 19668 517 1 2 . 1 1 28 28 GLU C C 28 179.447 179.447 179.014 0.433 19668 518 1 2 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.140 -0.557 19668 519 1 2 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.263 -0.203 19668 520 1 2 . 1 1 28 28 GLU H H 28 7.867 7.867 8.497 -0.630 19668 521 1 2 . 1 1 29 29 GLU N N 29 118.447 118.447 118.879 -0.432 19668 522 1 2 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.053 0.034 19668 523 1 2 . 1 1 29 29 GLU C C 29 179.310 179.310 178.976 0.334 19668 524 1 2 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.816 0.464 19668 525 1 2 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.228 0.108 19668 526 1 2 . 1 1 29 29 GLU H H 29 7.755 7.755 8.044 -0.289 19668 527 1 2 . 1 1 30 30 LEU N N 30 121.135 121.135 121.528 -0.393 19668 528 1 2 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.996 0.100 19668 529 1 2 . 1 1 30 30 LEU C C 30 178.928 178.928 178.749 0.179 19668 530 1 2 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.156 -0.051 19668 531 1 2 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.093 -0.413 19668 532 1 2 . 1 1 30 30 LEU H H 30 7.785 7.785 7.619 0.166 19668 533 1 2 . 1 1 31 31 LYS N N 31 119.130 119.130 117.773 1.357 19668 534 1 2 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.104 -0.234 19668 535 1 2 . 1 1 31 31 LYS C C 31 179.104 179.104 178.995 0.109 19668 536 1 2 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.389 1.327 19668 537 1 2 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.834 0.422 19668 538 1 2 . 1 1 31 31 LYS H H 31 8.413 8.413 7.638 0.775 19668 539 1 2 . 1 1 32 32 LYS N N 32 119.200 119.200 119.717 -0.517 19668 540 1 2 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.994 0.108 19668 541 1 2 . 1 1 32 32 LYS C C 32 179.420 179.420 179.009 0.411 19668 542 1 2 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.518 -0.061 19668 543 1 2 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.168 0.098 19668 544 1 2 . 1 1 32 32 LYS H H 32 7.826 7.826 7.542 0.284 19668 545 1 2 . 1 1 33 33 LYS N N 33 120.322 120.322 119.283 1.039 19668 546 1 2 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.060 0.103 19668 547 1 2 . 1 1 33 33 LYS C C 33 179.174 179.174 178.767 0.407 19668 548 1 2 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.989 -0.241 19668 549 1 2 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.320 -0.581 19668 550 1 2 . 1 1 33 33 LYS H H 33 8.003 8.003 7.472 0.531 19668 551 1 2 . 1 1 34 34 TYR N N 34 120.223 120.223 119.725 0.498 19668 552 1 2 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.100 -0.044 19668 553 1 2 . 1 1 34 34 TYR C C 34 176.356 176.356 178.086 -1.730 19668 554 1 2 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.511 -0.456 19668 555 1 2 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.315 -0.288 19668 556 1 2 . 1 1 34 34 TYR H H 34 8.614 8.614 7.569 1.045 19668 557 1 2 . 1 1 35 35 GLU N N 35 118.813 118.813 117.367 1.446 19668 558 1 2 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.950 -0.225 19668 559 1 2 . 1 1 35 35 GLU C C 35 179.787 179.787 178.979 0.808 19668 560 1 2 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.880 -0.442 19668 561 1 2 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.996 0.132 19668 562 1 2 . 1 1 35 35 GLU H H 35 8.103 8.103 7.945 0.158 19668 563 1 2 . 1 1 36 36 GLU N N 36 119.670 119.670 119.578 0.092 19668 564 1 2 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.091 -0.077 19668 565 1 2 . 1 1 36 36 GLU C C 36 179.295 179.295 179.108 0.187 19668 566 1 2 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.424 -0.161 19668 567 1 2 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.332 0.237 19668 568 1 2 . 1 1 36 36 GLU H H 36 8.028 8.028 7.720 0.308 19668 569 1 2 . 1 1 37 37 LEU N N 37 121.416 121.416 119.150 2.266 19668 570 1 2 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.951 0.068 19668 571 1 2 . 1 1 37 37 LEU C C 37 178.277 178.277 178.806 -0.529 19668 572 1 2 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.162 -0.322 19668 573 1 2 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.402 0.227 19668 574 1 2 . 1 1 37 37 LEU H H 37 8.176 8.176 7.452 0.724 19668 575 1 2 . 1 1 38 38 LYS N N 38 118.998 118.998 118.176 0.822 19668 576 1 2 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.957 -0.297 19668 577 1 2 . 1 1 38 38 LYS C C 38 178.923 178.923 179.240 -0.317 19668 578 1 2 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.748 0.652 19668 579 1 2 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.077 -0.015 19668 580 1 2 . 1 1 38 38 LYS H H 38 8.260 8.260 7.637 0.623 19668 581 1 2 . 1 1 39 39 LYS N N 39 118.070 118.070 118.440 -0.370 19668 582 1 2 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.075 0.005 19668 583 1 2 . 1 1 39 39 LYS C C 39 178.687 178.687 179.031 -0.344 19668 584 1 2 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.142 -0.206 19668 585 1 2 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.118 0.030 19668 586 1 2 . 1 1 39 39 LYS H H 39 7.380 7.380 7.563 -0.183 19668 587 1 2 . 1 1 40 40 LYS N N 40 118.894 118.894 120.093 -1.199 19668 588 1 2 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.082 -0.023 19668 589 1 2 . 1 1 40 40 LYS C C 40 179.758 179.758 179.193 0.565 19668 590 1 2 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.325 -0.263 19668 591 1 2 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.423 -0.035 19668 592 1 2 . 1 1 40 40 LYS H H 40 7.919 7.919 7.445 0.474 19668 593 1 2 . 1 1 41 41 ILE N N 41 118.270 118.270 118.862 -0.592 19668 594 1 2 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.752 -0.055 19668 595 1 2 . 1 1 41 41 ILE C C 41 178.211 178.211 177.121 1.090 19668 596 1 2 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.697 0.017 19668 597 1 2 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.698 0.141 19668 598 1 2 . 1 1 41 41 ILE H H 41 8.199 8.199 7.478 0.721 19668 599 1 2 . 1 1 42 42 GLU N N 42 120.117 120.117 117.278 2.839 19668 600 1 2 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.074 0.017 19668 601 1 2 . 1 1 42 42 GLU C C 42 178.736 178.736 177.469 1.267 19668 602 1 2 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.626 0.254 19668 603 1 2 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.979 -0.588 19668 604 1 2 . 1 1 42 42 GLU H H 42 7.738 7.738 7.616 0.122 19668 605 1 2 . 1 1 43 43 GLU N N 43 117.194 117.194 117.039 0.155 19668 606 1 2 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.199 0.100 19668 607 1 2 . 1 1 43 43 GLU C C 43 177.658 177.658 177.394 0.264 19668 608 1 2 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.743 0.050 19668 609 1 2 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.220 -0.287 19668 610 1 2 . 1 1 43 43 GLU H H 43 7.698 7.698 7.480 0.218 19668 611 1 2 . 1 1 44 44 LEU N N 44 120.812 120.812 121.625 -0.813 19668 612 1 2 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.061 0.178 19668 613 1 2 . 1 1 44 44 LEU C C 44 178.682 178.682 177.354 1.328 19668 614 1 2 . 1 1 44 44 LEU CA C 44 56.496 56.496 56.018 0.478 19668 615 1 2 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.553 1.094 19668 616 1 2 . 1 1 44 44 LEU H H 44 7.593 7.593 7.535 0.058 19668 617 1 2 . 1 1 45 45 GLY N N 45 108.681 108.681 112.858 -4.177 19668 618 1 2 . 1 1 45 45 GLY C C 45 174.957 174.957 174.579 0.378 19668 619 1 2 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.213 0.873 19668 620 1 2 . 1 1 45 45 GLY H H 45 8.234 8.234 8.161 0.073 19668 621 1 2 . 1 1 46 46 GLY N N 46 108.057 108.057 110.121 -2.064 19668 622 1 2 . 1 1 46 46 GLY C C 46 174.777 174.777 173.862 0.915 19668 623 1 2 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.290 1.074 19668 624 1 2 . 1 1 46 46 GLY H H 46 8.182 8.182 8.174 0.008 19668 625 1 2 . 1 1 47 47 GLY N N 47 108.494 108.494 104.542 3.952 19668 626 1 2 . 1 1 47 47 GLY C C 47 174.572 174.572 173.896 0.676 19668 627 1 2 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.799 0.356 19668 628 1 2 . 1 1 47 47 GLY H H 47 8.087 8.087 7.983 0.104 19668 629 1 2 . 1 1 48 48 GLY N N 48 108.285 108.285 110.957 -2.672 19668 630 1 2 . 1 1 48 48 GLY C C 48 174.495 174.495 174.915 -0.420 19668 631 1 2 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.350 0.104 19668 632 1 2 . 1 1 48 48 GLY H H 48 8.323 8.323 8.447 -0.124 19668 633 1 2 . 1 1 49 49 GLU N N 49 121.070 121.070 120.961 0.109 19668 634 1 2 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.456 -0.039 19668 635 1 2 . 1 1 49 49 GLU C C 49 177.226 177.226 178.082 -0.856 19668 636 1 2 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.926 -0.355 19668 637 1 2 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.752 -0.086 19668 638 1 2 . 1 1 49 49 GLU H H 49 8.483 8.483 8.491 -0.008 19668 639 1 2 . 1 1 50 50 VAL N N 50 121.794 121.794 116.829 4.965 19668 640 1 2 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.768 0.013 19668 641 1 2 . 1 1 50 50 VAL C C 50 176.860 176.860 177.597 -0.737 19668 642 1 2 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.749 -0.669 19668 643 1 2 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.143 1.110 19668 644 1 2 . 1 1 50 50 VAL H H 50 8.068 8.068 8.274 -0.206 19668 645 1 2 . 1 1 51 51 LYS N N 51 120.593 120.593 118.448 2.145 19668 646 1 2 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.184 0.024 19668 647 1 2 . 1 1 51 51 LYS C C 51 178.667 178.667 179.050 -0.383 19668 648 1 2 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.546 0.789 19668 649 1 2 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.539 0.719 19668 650 1 2 . 1 1 51 51 LYS H H 51 8.253 8.253 8.217 0.036 19668 651 1 2 . 1 1 52 52 LYS N N 52 117.572 117.572 119.496 -1.924 19668 652 1 2 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.096 0.072 19668 653 1 2 . 1 1 52 52 LYS C C 52 179.248 179.248 179.084 0.164 19668 654 1 2 . 1 1 52 52 LYS CA C 52 59.014 59.014 58.751 0.264 19668 655 1 2 . 1 1 52 52 LYS CB C 52 32.180 32.180 31.982 0.198 19668 656 1 2 . 1 1 52 52 LYS H H 52 7.629 7.629 7.555 0.074 19668 657 1 2 . 1 1 53 53 VAL N N 53 119.059 119.059 118.995 0.064 19668 658 1 2 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.727 0.065 19668 659 1 2 . 1 1 53 53 VAL C C 53 177.987 177.987 177.976 0.011 19668 660 1 2 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.488 0.543 19668 661 1 2 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.114 0.257 19668 662 1 2 . 1 1 53 53 VAL H H 53 7.638 7.638 7.671 -0.033 19668 663 1 2 . 1 1 54 54 GLU N N 54 120.388 120.388 119.720 0.668 19668 664 1 2 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.921 -0.077 19668 665 1 2 . 1 1 54 54 GLU C C 54 179.624 179.624 179.074 0.550 19668 666 1 2 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.963 0.278 19668 667 1 2 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.357 0.462 19668 668 1 2 . 1 1 54 54 GLU H H 54 8.603 8.603 7.651 0.952 19668 669 1 2 . 1 1 55 55 GLU N N 55 118.533 118.533 118.627 -0.094 19668 670 1 2 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.063 0.026 19668 671 1 2 . 1 1 55 55 GLU C C 55 179.158 179.158 179.045 0.113 19668 672 1 2 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.204 0.130 19668 673 1 2 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.407 -0.070 19668 674 1 2 . 1 1 55 55 GLU H H 55 7.904 7.904 7.610 0.294 19668 675 1 2 . 1 1 56 56 GLU N N 56 120.258 120.258 119.424 0.834 19668 676 1 2 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.039 0.061 19668 677 1 2 . 1 1 56 56 GLU C C 56 179.867 179.867 179.276 0.591 19668 678 1 2 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.170 0.493 19668 679 1 2 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.493 0.557 19668 680 1 2 . 1 1 56 56 GLU H H 56 7.902 7.902 7.471 0.431 19668 681 1 2 . 1 1 57 57 VAL N N 57 121.168 121.168 120.105 1.063 19668 682 1 2 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.530 0.038 19668 683 1 2 . 1 1 57 57 VAL C C 57 176.994 176.994 177.115 -0.121 19668 684 1 2 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.129 1.767 19668 685 1 2 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.837 -0.310 19668 686 1 2 . 1 1 57 57 VAL H H 57 8.613 8.613 7.525 1.088 19668 687 1 2 . 1 1 58 58 LYS N N 58 120.234 120.234 118.986 1.248 19668 688 1 2 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.899 0.303 19668 689 1 2 . 1 1 58 58 LYS C C 58 179.131 179.131 178.734 0.397 19668 690 1 2 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.466 0.121 19668 691 1 2 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.135 0.156 19668 692 1 2 . 1 1 58 58 LYS H H 58 7.810 7.810 7.473 0.337 19668 693 1 2 . 1 1 59 59 LYS N N 59 118.301 118.301 117.565 0.736 19668 694 1 2 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.069 0.024 19668 695 1 2 . 1 1 59 59 LYS C C 59 179.281 179.281 178.323 0.958 19668 696 1 2 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.172 0.256 19668 697 1 2 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.727 0.653 19668 698 1 2 . 1 1 59 59 LYS H H 59 7.876 7.876 7.476 0.400 19668 699 1 2 . 1 1 60 60 LEU N N 60 121.224 121.224 121.372 -0.148 19668 700 1 2 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.021 0.213 19668 701 1 2 . 1 1 60 60 LEU C C 60 178.636 178.636 178.865 -0.229 19668 702 1 2 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.819 0.338 19668 703 1 2 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.274 0.360 19668 704 1 2 . 1 1 60 60 LEU H H 60 7.893 7.893 7.612 0.281 19668 705 1 2 . 1 1 61 61 GLU N N 61 118.660 118.660 118.177 0.483 19668 706 1 2 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.082 -0.283 19668 707 1 2 . 1 1 61 61 GLU C C 61 179.094 179.094 178.778 0.316 19668 708 1 2 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.025 1.247 19668 709 1 2 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.549 1.454 19668 710 1 2 . 1 1 61 61 GLU H H 61 8.644 8.644 7.815 0.829 19668 711 1 2 . 1 1 62 62 GLU N N 62 117.555 117.555 119.794 -2.239 19668 712 1 2 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.005 -0.009 19668 713 1 2 . 1 1 62 62 GLU C C 62 178.940 178.940 179.036 -0.096 19668 714 1 2 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.452 -0.284 19668 715 1 2 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.289 0.258 19668 716 1 2 . 1 1 62 62 GLU H H 62 7.995 7.995 7.540 0.455 19668 717 1 2 . 1 1 63 63 GLU N N 63 119.097 119.097 118.327 0.770 19668 718 1 2 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.142 -0.113 19668 719 1 2 . 1 1 63 63 GLU C C 63 179.890 179.890 179.043 0.847 19668 720 1 2 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.997 0.344 19668 721 1 2 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.217 0.450 19668 722 1 2 . 1 1 63 63 GLU H H 63 7.983 7.983 7.728 0.255 19668 723 1 2 . 1 1 64 64 ILE N N 64 118.247 118.247 119.272 -1.025 19668 724 1 2 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.837 -0.117 19668 725 1 2 . 1 1 64 64 ILE C C 64 177.858 177.858 177.838 0.020 19668 726 1 2 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.210 0.286 19668 727 1 2 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.494 0.487 19668 728 1 2 . 1 1 64 64 ILE H H 64 8.261 8.261 7.203 1.058 19668 729 1 2 . 1 1 65 65 LYS N N 65 118.693 118.693 119.638 -0.945 19668 730 1 2 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.181 -0.083 19668 731 1 2 . 1 1 65 65 LYS C C 65 177.244 177.244 178.113 -0.869 19668 732 1 2 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.984 0.668 19668 733 1 2 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.356 0.349 19668 734 1 2 . 1 1 65 65 LYS H H 65 7.661 7.661 7.570 0.091 19668 735 1 2 . 1 1 66 66 LYS N N 66 116.933 116.933 117.302 -0.369 19668 736 1 2 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.091 0.247 19668 737 1 2 . 1 1 66 66 LYS C C 66 176.011 176.011 177.408 -1.397 19668 738 1 2 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.139 -1.680 19668 739 1 2 . 1 1 66 66 LYS CB C 66 33.131 33.131 33.015 0.116 19668 740 1 2 . 1 1 66 66 LYS H H 66 7.261 7.261 7.559 -0.298 19668 741 1 3 . 1 1 2 2 SER HA H 2 4.560 4.560 4.119 0.441 19668 742 1 3 . 1 1 2 2 SER CA C 2 58.366 58.366 60.757 -2.391 19668 743 1 3 . 1 1 3 3 ARG N N 3 125.213 125.213 120.518 4.695 19668 744 1 3 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.176 0.090 19668 745 1 3 . 1 1 3 3 ARG C C 3 178.381 178.381 178.263 0.118 19668 746 1 3 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.867 -0.471 19668 747 1 3 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.932 0.723 19668 748 1 3 . 1 1 3 3 ARG H H 3 8.874 8.874 8.444 0.430 19668 749 1 3 . 1 1 4 4 VAL N N 4 119.320 119.320 119.028 0.292 19668 750 1 3 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.743 0.055 19668 751 1 3 . 1 1 4 4 VAL C C 4 177.004 177.004 177.766 -0.762 19668 752 1 3 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.924 -0.409 19668 753 1 3 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.540 0.263 19668 754 1 3 . 1 1 4 4 VAL H H 4 8.112 8.112 7.610 0.502 19668 755 1 3 . 1 1 5 5 LYS N N 5 122.279 122.279 120.811 1.468 19668 756 1 3 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.071 0.091 19668 757 1 3 . 1 1 5 5 LYS C C 5 178.547 178.547 178.150 0.397 19668 758 1 3 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.769 -0.011 19668 759 1 3 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.703 0.306 19668 760 1 3 . 1 1 5 5 LYS H H 5 7.847 7.847 8.191 -0.344 19668 761 1 3 . 1 1 6 6 ALA N N 6 120.295 120.295 121.850 -1.555 19668 762 1 3 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.035 0.176 19668 763 1 3 . 1 1 6 6 ALA C C 6 180.834 180.834 179.173 1.661 19668 764 1 3 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.288 -0.385 19668 765 1 3 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.081 0.051 19668 766 1 3 . 1 1 6 6 ALA H H 6 7.975 7.975 7.767 0.208 19668 767 1 3 . 1 1 7 7 LEU N N 7 119.570 119.570 118.242 1.328 19668 768 1 3 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.073 0.099 19668 769 1 3 . 1 1 7 7 LEU C C 7 178.431 178.431 178.603 -0.172 19668 770 1 3 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.944 -0.265 19668 771 1 3 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.010 1.025 19668 772 1 3 . 1 1 7 7 LEU H H 7 7.650 7.650 7.591 0.059 19668 773 1 3 . 1 1 8 8 GLU N N 8 119.934 119.934 118.436 1.498 19668 774 1 3 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.067 -0.208 19668 775 1 3 . 1 1 8 8 GLU C C 8 179.534 179.534 178.531 1.003 19668 776 1 3 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.364 0.673 19668 777 1 3 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.726 0.741 19668 778 1 3 . 1 1 8 8 GLU H H 8 8.411 8.411 7.828 0.583 19668 779 1 3 . 1 1 9 9 GLU N N 9 118.234 118.234 118.994 -0.760 19668 780 1 3 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.089 -0.029 19668 781 1 3 . 1 1 9 9 GLU C C 9 179.596 179.596 178.963 0.633 19668 782 1 3 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.109 0.221 19668 783 1 3 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.200 0.218 19668 784 1 3 . 1 1 9 9 GLU H H 9 8.206 8.206 7.758 0.448 19668 785 1 3 . 1 1 10 10 LYS N N 10 121.042 121.042 119.277 1.765 19668 786 1 3 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.127 0.056 19668 787 1 3 . 1 1 10 10 LYS C C 10 179.380 179.380 179.023 0.357 19668 788 1 3 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.115 0.210 19668 789 1 3 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.118 0.291 19668 790 1 3 . 1 1 10 10 LYS H H 10 7.931 7.931 7.558 0.373 19668 791 1 3 . 1 1 11 11 VAL N N 11 118.662 118.662 120.645 -1.983 19668 792 1 3 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.801 0.013 19668 793 1 3 . 1 1 11 11 VAL C C 11 178.845 178.845 178.224 0.621 19668 794 1 3 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.964 0.024 19668 795 1 3 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.735 -0.081 19668 796 1 3 . 1 1 11 11 VAL H H 11 8.371 8.371 7.599 0.772 19668 797 1 3 . 1 1 12 12 LYS N N 12 123.188 123.188 119.607 3.581 19668 798 1 3 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.947 0.279 19668 799 1 3 . 1 1 12 12 LYS C C 12 179.098 179.098 178.164 0.934 19668 800 1 3 . 1 1 12 12 LYS CA C 12 59.483 59.483 58.848 0.635 19668 801 1 3 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.251 -0.045 19668 802 1 3 . 1 1 12 12 LYS H H 12 8.276 8.276 7.489 0.787 19668 803 1 3 . 1 1 13 13 ALA N N 13 121.169 121.169 121.740 -0.571 19668 804 1 3 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.062 0.196 19668 805 1 3 . 1 1 13 13 ALA C C 13 180.169 180.169 179.765 0.404 19668 806 1 3 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.810 -0.174 19668 807 1 3 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.238 -0.131 19668 808 1 3 . 1 1 13 13 ALA H H 13 7.829 7.829 7.434 0.395 19668 809 1 3 . 1 1 14 14 LEU N N 14 118.104 118.104 118.110 -0.006 19668 810 1 3 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.992 0.164 19668 811 1 3 . 1 1 14 14 LEU C C 14 177.614 177.614 177.963 -0.349 19668 812 1 3 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.194 -0.589 19668 813 1 3 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.972 0.823 19668 814 1 3 . 1 1 14 14 LEU H H 14 7.781 7.781 7.427 0.354 19668 815 1 3 . 1 1 15 15 GLU N N 15 120.632 120.632 118.987 1.645 19668 816 1 3 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.419 -0.052 19668 817 1 3 . 1 1 15 15 GLU C C 15 178.243 178.243 178.638 -0.395 19668 818 1 3 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.617 0.969 19668 819 1 3 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.927 0.902 19668 820 1 3 . 1 1 15 15 GLU H H 15 7.873 7.873 7.268 0.605 19668 821 1 3 . 1 1 16 16 GLU N N 16 115.775 115.775 116.957 -1.182 19668 822 1 3 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.015 -0.056 19668 823 1 3 . 1 1 16 16 GLU C C 16 179.006 179.006 178.703 0.303 19668 824 1 3 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.104 -0.012 19668 825 1 3 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.574 -0.221 19668 826 1 3 . 1 1 16 16 GLU H H 16 7.926 7.926 7.713 0.213 19668 827 1 3 . 1 1 17 17 LYS N N 17 118.801 118.801 119.401 -0.600 19668 828 1 3 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.092 0.002 19668 829 1 3 . 1 1 17 17 LYS C C 17 178.853 178.853 178.799 0.054 19668 830 1 3 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.857 -0.386 19668 831 1 3 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.860 0.502 19668 832 1 3 . 1 1 17 17 LYS H H 17 7.518 7.518 7.512 0.006 19668 833 1 3 . 1 1 18 18 VAL N N 18 118.034 118.034 120.127 -2.093 19668 834 1 3 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.647 -0.135 19668 835 1 3 . 1 1 18 18 VAL C C 18 178.362 178.362 177.637 0.725 19668 836 1 3 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.271 -0.252 19668 837 1 3 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.614 0.035 19668 838 1 3 . 1 1 18 18 VAL H H 18 8.048 8.048 7.433 0.615 19668 839 1 3 . 1 1 19 19 LYS N N 19 118.427 118.427 118.156 0.271 19668 840 1 3 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.149 -0.139 19668 841 1 3 . 1 1 19 19 LYS C C 19 177.706 177.706 177.943 -0.237 19668 842 1 3 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.502 0.483 19668 843 1 3 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.757 0.667 19668 844 1 3 . 1 1 19 19 LYS H H 19 8.008 8.008 7.450 0.558 19668 845 1 3 . 1 1 20 20 ALA N N 20 119.177 119.177 120.689 -1.512 19668 846 1 3 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.420 -0.104 19668 847 1 3 . 1 1 20 20 ALA C C 20 178.269 178.269 178.569 -0.300 19668 848 1 3 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.202 -0.571 19668 849 1 3 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.820 0.313 19668 850 1 3 . 1 1 20 20 ALA H H 20 7.259 7.259 7.601 -0.342 19668 851 1 3 . 1 1 21 21 LEU N N 21 118.596 118.596 115.706 2.890 19668 852 1 3 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.202 0.059 19668 853 1 3 . 1 1 21 21 LEU C C 21 177.732 177.732 177.255 0.477 19668 854 1 3 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.952 -0.295 19668 855 1 3 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.214 0.919 19668 856 1 3 . 1 1 21 21 LEU H H 21 7.373 7.373 7.292 0.081 19668 857 1 3 . 1 1 22 22 GLY N N 22 107.926 107.926 104.668 3.258 19668 858 1 3 . 1 1 22 22 GLY C C 22 173.362 173.362 172.470 0.892 19668 859 1 3 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.480 0.717 19668 860 1 3 . 1 1 22 22 GLY H H 22 8.144 8.144 7.307 0.837 19668 861 1 3 . 1 1 23 23 GLY N N 23 108.242 108.242 106.858 1.384 19668 862 1 3 . 1 1 23 23 GLY C C 23 174.110 174.110 173.066 1.044 19668 863 1 3 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.887 -0.203 19668 864 1 3 . 1 1 23 23 GLY H H 23 8.157 8.157 7.989 0.168 19668 865 1 3 . 1 1 24 24 GLY N N 24 106.969 106.969 109.997 -3.028 19668 866 1 3 . 1 1 24 24 GLY C C 24 175.172 175.172 174.969 0.203 19668 867 1 3 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.184 -0.745 19668 868 1 3 . 1 1 24 24 GLY H H 24 8.466 8.466 7.906 0.560 19668 869 1 3 . 1 1 25 25 GLY N N 25 108.946 108.946 107.651 1.295 19668 870 1 3 . 1 1 25 25 GLY C C 25 176.321 176.321 175.924 0.397 19668 871 1 3 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.136 0.963 19668 872 1 3 . 1 1 25 25 GLY H H 25 8.618 8.618 8.478 0.140 19668 873 1 3 . 1 1 26 26 ARG N N 26 123.559 123.559 119.873 3.686 19668 874 1 3 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.362 -0.083 19668 875 1 3 . 1 1 26 26 ARG C C 26 178.076 178.076 178.142 -0.066 19668 876 1 3 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.093 -0.178 19668 877 1 3 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.822 0.088 19668 878 1 3 . 1 1 26 26 ARG H H 26 8.789 8.789 8.343 0.446 19668 879 1 3 . 1 1 27 27 ILE N N 27 118.726 118.726 119.474 -0.748 19668 880 1 3 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.923 -0.137 19668 881 1 3 . 1 1 27 27 ILE C C 27 177.639 177.639 178.568 -0.929 19668 882 1 3 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.281 0.343 19668 883 1 3 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.627 0.328 19668 884 1 3 . 1 1 27 27 ILE H H 27 7.762 7.762 8.159 -0.397 19668 885 1 3 . 1 1 28 28 GLU N N 28 119.843 119.843 120.025 -0.182 19668 886 1 3 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.022 -0.009 19668 887 1 3 . 1 1 28 28 GLU C C 28 179.447 179.447 178.545 0.902 19668 888 1 3 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.922 -0.339 19668 889 1 3 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.669 -0.609 19668 890 1 3 . 1 1 28 28 GLU H H 28 7.867 7.867 7.721 0.146 19668 891 1 3 . 1 1 29 29 GLU N N 29 118.447 118.447 119.395 -0.948 19668 892 1 3 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.055 0.032 19668 893 1 3 . 1 1 29 29 GLU C C 29 179.310 179.310 178.874 0.436 19668 894 1 3 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.763 0.517 19668 895 1 3 . 1 1 29 29 GLU CB C 29 29.336 29.336 28.846 0.490 19668 896 1 3 . 1 1 29 29 GLU H H 29 7.755 7.755 7.691 0.064 19668 897 1 3 . 1 1 30 30 LEU N N 30 121.135 121.135 120.706 0.429 19668 898 1 3 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.996 0.100 19668 899 1 3 . 1 1 30 30 LEU C C 30 178.928 178.928 178.684 0.244 19668 900 1 3 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.243 -0.138 19668 901 1 3 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.083 -0.403 19668 902 1 3 . 1 1 30 30 LEU H H 30 7.785 7.785 7.604 0.181 19668 903 1 3 . 1 1 31 31 LYS N N 31 119.130 119.130 117.747 1.383 19668 904 1 3 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.121 -0.251 19668 905 1 3 . 1 1 31 31 LYS C C 31 179.104 179.104 179.017 0.087 19668 906 1 3 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.378 1.338 19668 907 1 3 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.858 0.398 19668 908 1 3 . 1 1 31 31 LYS H H 31 8.413 8.413 7.546 0.867 19668 909 1 3 . 1 1 32 32 LYS N N 32 119.200 119.200 119.496 -0.296 19668 910 1 3 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.030 0.072 19668 911 1 3 . 1 1 32 32 LYS C C 32 179.420 179.420 178.845 0.575 19668 912 1 3 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.809 -0.352 19668 913 1 3 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.194 0.072 19668 914 1 3 . 1 1 32 32 LYS H H 32 7.826 7.826 7.534 0.292 19668 915 1 3 . 1 1 33 33 LYS N N 33 120.322 120.322 118.904 1.418 19668 916 1 3 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.043 0.120 19668 917 1 3 . 1 1 33 33 LYS C C 33 179.174 179.174 178.616 0.558 19668 918 1 3 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.071 -0.323 19668 919 1 3 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.333 -0.594 19668 920 1 3 . 1 1 33 33 LYS H H 33 8.003 8.003 7.507 0.496 19668 921 1 3 . 1 1 34 34 TYR N N 34 120.223 120.223 120.053 0.170 19668 922 1 3 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.090 -0.034 19668 923 1 3 . 1 1 34 34 TYR C C 34 176.356 176.356 177.976 -1.620 19668 924 1 3 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.628 -0.573 19668 925 1 3 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.163 -0.136 19668 926 1 3 . 1 1 34 34 TYR H H 34 8.614 8.614 7.599 1.015 19668 927 1 3 . 1 1 35 35 GLU N N 35 118.813 118.813 117.586 1.227 19668 928 1 3 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.943 -0.218 19668 929 1 3 . 1 1 35 35 GLU C C 35 179.787 179.787 179.023 0.764 19668 930 1 3 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.187 -0.748 19668 931 1 3 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.156 -0.028 19668 932 1 3 . 1 1 35 35 GLU H H 35 8.103 8.103 7.758 0.345 19668 933 1 3 . 1 1 36 36 GLU N N 36 119.670 119.670 119.678 -0.008 19668 934 1 3 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.111 -0.097 19668 935 1 3 . 1 1 36 36 GLU C C 36 179.295 179.295 179.060 0.235 19668 936 1 3 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.051 0.212 19668 937 1 3 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.058 0.511 19668 938 1 3 . 1 1 36 36 GLU H H 36 8.028 8.028 7.697 0.331 19668 939 1 3 . 1 1 37 37 LEU N N 37 121.416 121.416 117.724 3.692 19668 940 1 3 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.989 0.030 19668 941 1 3 . 1 1 37 37 LEU C C 37 178.277 178.277 178.738 -0.461 19668 942 1 3 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.599 0.241 19668 943 1 3 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.705 -0.076 19668 944 1 3 . 1 1 37 37 LEU H H 37 8.176 8.176 7.418 0.758 19668 945 1 3 . 1 1 38 38 LYS N N 38 118.998 118.998 118.490 0.508 19668 946 1 3 . 1 1 38 38 LYS HA H 38 3.660 3.660 4.013 -0.353 19668 947 1 3 . 1 1 38 38 LYS C C 38 178.923 178.923 178.984 -0.061 19668 948 1 3 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.465 0.935 19668 949 1 3 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.160 -0.098 19668 950 1 3 . 1 1 38 38 LYS H H 38 8.260 8.260 7.604 0.656 19668 951 1 3 . 1 1 39 39 LYS N N 39 118.070 118.070 119.081 -1.011 19668 952 1 3 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.016 0.064 19668 953 1 3 . 1 1 39 39 LYS C C 39 178.687 178.687 178.893 -0.206 19668 954 1 3 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.392 -0.456 19668 955 1 3 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.192 -0.043 19668 956 1 3 . 1 1 39 39 LYS H H 39 7.380 7.380 7.535 -0.155 19668 957 1 3 . 1 1 40 40 LYS N N 40 118.894 118.894 118.887 0.007 19668 958 1 3 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.008 0.051 19668 959 1 3 . 1 1 40 40 LYS C C 40 179.758 179.758 179.005 0.753 19668 960 1 3 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.590 -0.528 19668 961 1 3 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.362 0.026 19668 962 1 3 . 1 1 40 40 LYS H H 40 7.919 7.919 7.436 0.483 19668 963 1 3 . 1 1 41 41 ILE N N 41 118.270 118.270 118.055 0.215 19668 964 1 3 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.808 -0.111 19668 965 1 3 . 1 1 41 41 ILE C C 41 178.211 178.211 177.003 1.208 19668 966 1 3 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.049 0.665 19668 967 1 3 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.666 0.173 19668 968 1 3 . 1 1 41 41 ILE H H 41 8.199 8.199 7.337 0.862 19668 969 1 3 . 1 1 42 42 GLU N N 42 120.117 120.117 117.700 2.417 19668 970 1 3 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.046 0.045 19668 971 1 3 . 1 1 42 42 GLU C C 42 178.736 178.736 177.778 0.958 19668 972 1 3 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.799 0.081 19668 973 1 3 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.850 -0.459 19668 974 1 3 . 1 1 42 42 GLU H H 42 7.738 7.738 7.492 0.246 19668 975 1 3 . 1 1 43 43 GLU N N 43 117.194 117.194 116.604 0.590 19668 976 1 3 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.241 0.058 19668 977 1 3 . 1 1 43 43 GLU C C 43 177.658 177.658 177.475 0.183 19668 978 1 3 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.723 0.070 19668 979 1 3 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.314 -0.381 19668 980 1 3 . 1 1 43 43 GLU H H 43 7.698 7.698 7.521 0.177 19668 981 1 3 . 1 1 44 44 LEU N N 44 120.812 120.812 121.408 -0.596 19668 982 1 3 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.078 0.161 19668 983 1 3 . 1 1 44 44 LEU C C 44 178.682 178.682 177.117 1.565 19668 984 1 3 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.775 0.721 19668 985 1 3 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.738 0.909 19668 986 1 3 . 1 1 44 44 LEU H H 44 7.593 7.593 7.399 0.194 19668 987 1 3 . 1 1 45 45 GLY N N 45 108.681 108.681 111.321 -2.640 19668 988 1 3 . 1 1 45 45 GLY C C 45 174.957 174.957 174.248 0.709 19668 989 1 3 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.373 0.713 19668 990 1 3 . 1 1 45 45 GLY H H 45 8.234 8.234 8.029 0.205 19668 991 1 3 . 1 1 46 46 GLY N N 46 108.057 108.057 108.316 -0.259 19668 992 1 3 . 1 1 46 46 GLY C C 46 174.777 174.777 174.874 -0.097 19668 993 1 3 . 1 1 46 46 GLY CA C 46 45.364 45.364 43.801 1.563 19668 994 1 3 . 1 1 46 46 GLY H H 46 8.182 8.182 8.222 -0.040 19668 995 1 3 . 1 1 47 47 GLY N N 47 108.494 108.494 110.347 -1.853 19668 996 1 3 . 1 1 47 47 GLY C C 47 174.572 174.572 175.062 -0.490 19668 997 1 3 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.777 0.378 19668 998 1 3 . 1 1 47 47 GLY H H 47 8.087 8.087 7.787 0.300 19668 999 1 3 . 1 1 48 48 GLY N N 48 108.285 108.285 106.783 1.502 19668 1000 1 3 . 1 1 48 48 GLY C C 48 174.495 174.495 174.652 -0.157 19668 1001 1 3 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.398 0.056 19668 1002 1 3 . 1 1 48 48 GLY H H 48 8.323 8.323 8.281 0.042 19668 1003 1 3 . 1 1 49 49 GLU N N 49 121.070 121.070 121.162 -0.092 19668 1004 1 3 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.609 -0.192 19668 1005 1 3 . 1 1 49 49 GLU C C 49 177.226 177.226 178.127 -0.901 19668 1006 1 3 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.100 0.471 19668 1007 1 3 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.721 -0.056 19668 1008 1 3 . 1 1 49 49 GLU H H 49 8.483 8.483 8.607 -0.124 19668 1009 1 3 . 1 1 50 50 VAL N N 50 121.794 121.794 117.507 4.287 19668 1010 1 3 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.736 0.045 19668 1011 1 3 . 1 1 50 50 VAL C C 50 176.860 176.860 177.099 -0.239 19668 1012 1 3 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.774 -0.694 19668 1013 1 3 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.400 0.853 19668 1014 1 3 . 1 1 50 50 VAL H H 50 8.068 8.068 7.932 0.136 19668 1015 1 3 . 1 1 51 51 LYS N N 51 120.593 120.593 119.592 1.001 19668 1016 1 3 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.375 -0.168 19668 1017 1 3 . 1 1 51 51 LYS C C 51 178.667 178.667 178.970 -0.303 19668 1018 1 3 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.300 0.035 19668 1019 1 3 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.836 0.422 19668 1020 1 3 . 1 1 51 51 LYS H H 51 8.253 8.253 8.143 0.110 19668 1021 1 3 . 1 1 52 52 LYS N N 52 117.572 117.572 119.737 -2.165 19668 1022 1 3 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.043 0.125 19668 1023 1 3 . 1 1 52 52 LYS C C 52 179.248 179.248 178.643 0.605 19668 1024 1 3 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.448 -0.434 19668 1025 1 3 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.140 0.040 19668 1026 1 3 . 1 1 52 52 LYS H H 52 7.629 7.629 7.989 -0.360 19668 1027 1 3 . 1 1 53 53 VAL N N 53 119.059 119.059 118.917 0.142 19668 1028 1 3 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.663 0.129 19668 1029 1 3 . 1 1 53 53 VAL C C 53 177.987 177.987 177.811 0.176 19668 1030 1 3 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.825 -0.794 19668 1031 1 3 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.351 0.020 19668 1032 1 3 . 1 1 53 53 VAL H H 53 7.638 7.638 7.971 -0.333 19668 1033 1 3 . 1 1 54 54 GLU N N 54 120.388 120.388 119.215 1.173 19668 1034 1 3 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.922 -0.078 19668 1035 1 3 . 1 1 54 54 GLU C C 54 179.624 179.624 178.786 0.838 19668 1036 1 3 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.804 0.437 19668 1037 1 3 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.096 0.722 19668 1038 1 3 . 1 1 54 54 GLU H H 54 8.603 8.603 7.710 0.893 19668 1039 1 3 . 1 1 55 55 GLU N N 55 118.533 118.533 119.435 -0.902 19668 1040 1 3 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.041 0.048 19668 1041 1 3 . 1 1 55 55 GLU C C 55 179.158 179.158 178.817 0.341 19668 1042 1 3 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.181 0.153 19668 1043 1 3 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.570 -0.233 19668 1044 1 3 . 1 1 55 55 GLU H H 55 7.904 7.904 7.559 0.345 19668 1045 1 3 . 1 1 56 56 GLU N N 56 120.258 120.258 119.214 1.044 19668 1046 1 3 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.013 0.087 19668 1047 1 3 . 1 1 56 56 GLU C C 56 179.867 179.867 179.279 0.588 19668 1048 1 3 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.169 0.494 19668 1049 1 3 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.532 0.518 19668 1050 1 3 . 1 1 56 56 GLU H H 56 7.902 7.902 7.485 0.417 19668 1051 1 3 . 1 1 57 57 VAL N N 57 121.168 121.168 119.043 2.125 19668 1052 1 3 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.530 0.038 19668 1053 1 3 . 1 1 57 57 VAL C C 57 176.994 176.994 176.806 0.188 19668 1054 1 3 . 1 1 57 57 VAL CA C 57 66.896 66.896 66.102 0.795 19668 1055 1 3 . 1 1 57 57 VAL CB C 57 31.527 31.527 32.019 -0.492 19668 1056 1 3 . 1 1 57 57 VAL H H 57 8.613 8.613 7.495 1.118 19668 1057 1 3 . 1 1 58 58 LYS N N 58 120.234 120.234 118.757 1.477 19668 1058 1 3 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.986 0.216 19668 1059 1 3 . 1 1 58 58 LYS C C 58 179.131 179.131 178.160 0.971 19668 1060 1 3 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.439 0.148 19668 1061 1 3 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.613 0.678 19668 1062 1 3 . 1 1 58 58 LYS H H 58 7.810 7.810 7.530 0.280 19668 1063 1 3 . 1 1 59 59 LYS N N 59 118.301 118.301 119.010 -0.709 19668 1064 1 3 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.040 0.053 19668 1065 1 3 . 1 1 59 59 LYS C C 59 179.281 179.281 178.339 0.942 19668 1066 1 3 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.941 0.487 19668 1067 1 3 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.943 0.436 19668 1068 1 3 . 1 1 59 59 LYS H H 59 7.876 7.876 7.370 0.506 19668 1069 1 3 . 1 1 60 60 LEU N N 60 121.224 121.224 120.290 0.934 19668 1070 1 3 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.961 0.273 19668 1071 1 3 . 1 1 60 60 LEU C C 60 178.636 178.636 178.713 -0.077 19668 1072 1 3 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.819 0.338 19668 1073 1 3 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.262 0.372 19668 1074 1 3 . 1 1 60 60 LEU H H 60 7.893 7.893 7.562 0.331 19668 1075 1 3 . 1 1 61 61 GLU N N 61 118.660 118.660 118.073 0.587 19668 1076 1 3 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.058 -0.259 19668 1077 1 3 . 1 1 61 61 GLU C C 61 179.094 179.094 178.744 0.350 19668 1078 1 3 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.157 1.115 19668 1079 1 3 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.712 1.291 19668 1080 1 3 . 1 1 61 61 GLU H H 61 8.644 8.644 7.785 0.859 19668 1081 1 3 . 1 1 62 62 GLU N N 62 117.555 117.555 119.730 -2.175 19668 1082 1 3 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.996 -0.000 19668 1083 1 3 . 1 1 62 62 GLU C C 62 178.940 178.940 179.024 -0.084 19668 1084 1 3 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.429 -0.261 19668 1085 1 3 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.309 0.238 19668 1086 1 3 . 1 1 62 62 GLU H H 62 7.995 7.995 7.534 0.461 19668 1087 1 3 . 1 1 63 63 GLU N N 63 119.097 119.097 118.134 0.963 19668 1088 1 3 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.133 -0.104 19668 1089 1 3 . 1 1 63 63 GLU C C 63 179.890 179.890 179.036 0.854 19668 1090 1 3 . 1 1 63 63 GLU CA C 63 59.341 59.341 59.039 0.302 19668 1091 1 3 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.344 0.323 19668 1092 1 3 . 1 1 63 63 GLU H H 63 7.983 7.983 7.693 0.290 19668 1093 1 3 . 1 1 64 64 ILE N N 64 118.247 118.247 119.220 -0.973 19668 1094 1 3 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.841 -0.121 19668 1095 1 3 . 1 1 64 64 ILE C C 64 177.858 177.858 177.952 -0.094 19668 1096 1 3 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.252 0.244 19668 1097 1 3 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.487 0.493 19668 1098 1 3 . 1 1 64 64 ILE H H 64 8.261 8.261 7.219 1.042 19668 1099 1 3 . 1 1 65 65 LYS N N 65 118.693 118.693 118.543 0.150 19668 1100 1 3 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.106 -0.008 19668 1101 1 3 . 1 1 65 65 LYS C C 65 177.244 177.244 177.858 -0.614 19668 1102 1 3 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.776 -0.124 19668 1103 1 3 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.361 0.344 19668 1104 1 3 . 1 1 65 65 LYS H H 65 7.661 7.661 7.536 0.125 19668 1105 1 3 . 1 1 66 66 LYS N N 66 116.933 116.933 118.344 -1.411 19668 1106 1 3 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.164 0.174 19668 1107 1 3 . 1 1 66 66 LYS C C 66 176.011 176.011 176.710 -0.699 19668 1108 1 3 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.800 -1.341 19668 1109 1 3 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.653 0.478 19668 1110 1 3 . 1 1 66 66 LYS H H 66 7.261 7.261 7.828 -0.567 19668 1111 1 4 . 1 1 2 2 SER HA H 2 4.560 4.560 3.954 0.606 19668 1112 1 4 . 1 1 2 2 SER CA C 2 58.366 58.366 61.154 -2.788 19668 1113 1 4 . 1 1 3 3 ARG N N 3 125.213 125.213 121.150 4.063 19668 1114 1 4 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.179 0.087 19668 1115 1 4 . 1 1 3 3 ARG C C 3 178.381 178.381 178.073 0.308 19668 1116 1 4 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.748 -0.352 19668 1117 1 4 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.938 0.717 19668 1118 1 4 . 1 1 3 3 ARG H H 3 8.874 8.874 8.269 0.605 19668 1119 1 4 . 1 1 4 4 VAL N N 4 119.320 119.320 120.987 -1.667 19668 1120 1 4 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.754 0.044 19668 1121 1 4 . 1 1 4 4 VAL C C 4 177.004 177.004 177.682 -0.678 19668 1122 1 4 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.548 -0.033 19668 1123 1 4 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.338 0.465 19668 1124 1 4 . 1 1 4 4 VAL H H 4 8.112 8.112 7.386 0.726 19668 1125 1 4 . 1 1 5 5 LYS N N 5 122.279 122.279 120.714 1.565 19668 1126 1 4 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.048 0.114 19668 1127 1 4 . 1 1 5 5 LYS C C 5 178.547 178.547 178.283 0.264 19668 1128 1 4 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.870 -0.112 19668 1129 1 4 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.722 0.288 19668 1130 1 4 . 1 1 5 5 LYS H H 5 7.847 7.847 8.213 -0.366 19668 1131 1 4 . 1 1 6 6 ALA N N 6 120.295 120.295 121.558 -1.263 19668 1132 1 4 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.039 0.172 19668 1133 1 4 . 1 1 6 6 ALA C C 6 180.834 180.834 179.254 1.580 19668 1134 1 4 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.039 -0.136 19668 1135 1 4 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.252 -0.120 19668 1136 1 4 . 1 1 6 6 ALA H H 6 7.975 7.975 7.718 0.257 19668 1137 1 4 . 1 1 7 7 LEU N N 7 119.570 119.570 118.384 1.186 19668 1138 1 4 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.107 0.065 19668 1139 1 4 . 1 1 7 7 LEU C C 7 178.431 178.431 178.676 -0.245 19668 1140 1 4 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.796 -0.117 19668 1141 1 4 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.121 0.914 19668 1142 1 4 . 1 1 7 7 LEU H H 7 7.650 7.650 7.649 0.001 19668 1143 1 4 . 1 1 8 8 GLU N N 8 119.934 119.934 118.386 1.548 19668 1144 1 4 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.067 -0.208 19668 1145 1 4 . 1 1 8 8 GLU C C 8 179.534 179.534 178.482 1.052 19668 1146 1 4 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.332 0.705 19668 1147 1 4 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.725 0.742 19668 1148 1 4 . 1 1 8 8 GLU H H 8 8.411 8.411 7.829 0.582 19668 1149 1 4 . 1 1 9 9 GLU N N 9 118.234 118.234 118.821 -0.587 19668 1150 1 4 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.079 -0.019 19668 1151 1 4 . 1 1 9 9 GLU C C 9 179.596 179.596 178.964 0.632 19668 1152 1 4 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.247 0.083 19668 1153 1 4 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.170 0.248 19668 1154 1 4 . 1 1 9 9 GLU H H 9 8.206 8.206 7.744 0.462 19668 1155 1 4 . 1 1 10 10 LYS N N 10 121.042 121.042 119.217 1.825 19668 1156 1 4 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.135 0.048 19668 1157 1 4 . 1 1 10 10 LYS C C 10 179.380 179.380 179.043 0.337 19668 1158 1 4 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.087 0.238 19668 1159 1 4 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.042 0.367 19668 1160 1 4 . 1 1 10 10 LYS H H 10 7.931 7.931 7.541 0.390 19668 1161 1 4 . 1 1 11 11 VAL N N 11 118.662 118.662 120.352 -1.690 19668 1162 1 4 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.831 -0.017 19668 1163 1 4 . 1 1 11 11 VAL C C 11 178.845 178.845 178.204 0.641 19668 1164 1 4 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.769 0.219 19668 1165 1 4 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.674 -0.020 19668 1166 1 4 . 1 1 11 11 VAL H H 11 8.371 8.371 7.536 0.835 19668 1167 1 4 . 1 1 12 12 LYS N N 12 123.188 123.188 119.810 3.378 19668 1168 1 4 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.948 0.278 19668 1169 1 4 . 1 1 12 12 LYS C C 12 179.098 179.098 178.317 0.781 19668 1170 1 4 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.548 -0.065 19668 1171 1 4 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.312 -0.106 19668 1172 1 4 . 1 1 12 12 LYS H H 12 8.276 8.276 7.534 0.742 19668 1173 1 4 . 1 1 13 13 ALA N N 13 121.169 121.169 121.634 -0.465 19668 1174 1 4 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.078 0.180 19668 1175 1 4 . 1 1 13 13 ALA C C 13 180.169 180.169 179.701 0.468 19668 1176 1 4 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.821 -0.185 19668 1177 1 4 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.245 -0.138 19668 1178 1 4 . 1 1 13 13 ALA H H 13 7.829 7.829 7.478 0.351 19668 1179 1 4 . 1 1 14 14 LEU N N 14 118.104 118.104 118.314 -0.210 19668 1180 1 4 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.030 0.126 19668 1181 1 4 . 1 1 14 14 LEU C C 14 177.614 177.614 177.888 -0.274 19668 1182 1 4 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.146 -0.541 19668 1183 1 4 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.952 0.843 19668 1184 1 4 . 1 1 14 14 LEU H H 14 7.781 7.781 7.428 0.353 19668 1185 1 4 . 1 1 15 15 GLU N N 15 120.632 120.632 119.068 1.564 19668 1186 1 4 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.416 -0.049 19668 1187 1 4 . 1 1 15 15 GLU C C 15 178.243 178.243 178.689 -0.446 19668 1188 1 4 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.572 1.014 19668 1189 1 4 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.927 0.902 19668 1190 1 4 . 1 1 15 15 GLU H H 15 7.873 7.873 7.335 0.538 19668 1191 1 4 . 1 1 16 16 GLU N N 16 115.775 115.775 117.226 -1.451 19668 1192 1 4 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.021 -0.062 19668 1193 1 4 . 1 1 16 16 GLU C C 16 179.006 179.006 178.735 0.271 19668 1194 1 4 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.047 0.045 19668 1195 1 4 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.535 -0.182 19668 1196 1 4 . 1 1 16 16 GLU H H 16 7.926 7.926 7.674 0.252 19668 1197 1 4 . 1 1 17 17 LYS N N 17 118.801 118.801 119.326 -0.525 19668 1198 1 4 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.085 0.009 19668 1199 1 4 . 1 1 17 17 LYS C C 17 178.853 178.853 178.790 0.063 19668 1200 1 4 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.897 -0.426 19668 1201 1 4 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.880 0.482 19668 1202 1 4 . 1 1 17 17 LYS H H 17 7.518 7.518 7.514 0.004 19668 1203 1 4 . 1 1 18 18 VAL N N 18 118.034 118.034 120.348 -2.314 19668 1204 1 4 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.601 -0.089 19668 1205 1 4 . 1 1 18 18 VAL C C 18 178.362 178.362 177.674 0.688 19668 1206 1 4 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.246 -0.227 19668 1207 1 4 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.481 0.168 19668 1208 1 4 . 1 1 18 18 VAL H H 18 8.048 8.048 7.430 0.618 19668 1209 1 4 . 1 1 19 19 LYS N N 19 118.427 118.427 118.334 0.093 19668 1210 1 4 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.301 -0.291 19668 1211 1 4 . 1 1 19 19 LYS C C 19 177.706 177.706 178.376 -0.670 19668 1212 1 4 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.520 0.465 19668 1213 1 4 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.839 0.585 19668 1214 1 4 . 1 1 19 19 LYS H H 19 8.008 8.008 7.409 0.599 19668 1215 1 4 . 1 1 20 20 ALA N N 20 119.177 119.177 121.844 -2.667 19668 1216 1 4 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.258 0.058 19668 1217 1 4 . 1 1 20 20 ALA C C 20 178.269 178.269 179.116 -0.847 19668 1218 1 4 . 1 1 20 20 ALA CA C 20 52.631 52.631 54.249 -1.618 19668 1219 1 4 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.545 0.588 19668 1220 1 4 . 1 1 20 20 ALA H H 20 7.259 7.259 7.559 -0.300 19668 1221 1 4 . 1 1 21 21 LEU N N 21 118.596 118.596 114.003 4.593 19668 1222 1 4 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.241 0.020 19668 1223 1 4 . 1 1 21 21 LEU C C 21 177.732 177.732 177.018 0.714 19668 1224 1 4 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.677 -0.020 19668 1225 1 4 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.264 0.869 19668 1226 1 4 . 1 1 21 21 LEU H H 21 7.373 7.373 7.343 0.030 19668 1227 1 4 . 1 1 22 22 GLY N N 22 107.926 107.926 104.765 3.161 19668 1228 1 4 . 1 1 22 22 GLY C C 22 173.362 173.362 172.361 1.001 19668 1229 1 4 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.297 0.900 19668 1230 1 4 . 1 1 22 22 GLY H H 22 8.144 8.144 7.146 0.998 19668 1231 1 4 . 1 1 23 23 GLY N N 23 108.242 108.242 105.536 2.706 19668 1232 1 4 . 1 1 23 23 GLY C C 23 174.110 174.110 172.734 1.376 19668 1233 1 4 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.893 -0.209 19668 1234 1 4 . 1 1 23 23 GLY H H 23 8.157 8.157 8.151 0.006 19668 1235 1 4 . 1 1 24 24 GLY N N 24 106.969 106.969 109.062 -2.093 19668 1236 1 4 . 1 1 24 24 GLY C C 24 175.172 175.172 174.457 0.715 19668 1237 1 4 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.037 -0.598 19668 1238 1 4 . 1 1 24 24 GLY H H 24 8.466 8.466 8.227 0.239 19668 1239 1 4 . 1 1 25 25 GLY N N 25 108.946 108.946 112.574 -3.628 19668 1240 1 4 . 1 1 25 25 GLY C C 25 176.321 176.321 175.123 1.198 19668 1241 1 4 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.095 2.004 19668 1242 1 4 . 1 1 25 25 GLY H H 25 8.618 8.618 7.878 0.740 19668 1243 1 4 . 1 1 26 26 ARG N N 26 123.559 123.559 123.452 0.107 19668 1244 1 4 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.062 0.217 19668 1245 1 4 . 1 1 26 26 ARG C C 26 178.076 178.076 178.469 -0.393 19668 1246 1 4 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.994 -1.079 19668 1247 1 4 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.936 -0.026 19668 1248 1 4 . 1 1 26 26 ARG H H 26 8.789 8.789 8.590 0.199 19668 1249 1 4 . 1 1 27 27 ILE N N 27 118.726 118.726 118.759 -0.033 19668 1250 1 4 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.831 -0.045 19668 1251 1 4 . 1 1 27 27 ILE C C 27 177.639 177.639 178.000 -0.361 19668 1252 1 4 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.816 -1.192 19668 1253 1 4 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.179 -0.224 19668 1254 1 4 . 1 1 27 27 ILE H H 27 7.762 7.762 8.049 -0.286 19668 1255 1 4 . 1 1 28 28 GLU N N 28 119.843 119.843 119.399 0.444 19668 1256 1 4 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.958 0.055 19668 1257 1 4 . 1 1 28 28 GLU C C 28 179.447 179.447 179.070 0.377 19668 1258 1 4 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.155 -0.572 19668 1259 1 4 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.228 -0.168 19668 1260 1 4 . 1 1 28 28 GLU H H 28 7.867 7.867 8.496 -0.629 19668 1261 1 4 . 1 1 29 29 GLU N N 29 118.447 118.447 118.982 -0.535 19668 1262 1 4 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.039 0.048 19668 1263 1 4 . 1 1 29 29 GLU C C 29 179.310 179.310 179.021 0.289 19668 1264 1 4 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.880 0.400 19668 1265 1 4 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.142 0.194 19668 1266 1 4 . 1 1 29 29 GLU H H 29 7.755 7.755 8.334 -0.579 19668 1267 1 4 . 1 1 30 30 LEU N N 30 121.135 121.135 121.341 -0.206 19668 1268 1 4 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.007 0.089 19668 1269 1 4 . 1 1 30 30 LEU C C 30 178.928 178.928 178.766 0.162 19668 1270 1 4 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.133 -0.028 19668 1271 1 4 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.067 -0.387 19668 1272 1 4 . 1 1 30 30 LEU H H 30 7.785 7.785 7.585 0.200 19668 1273 1 4 . 1 1 31 31 LYS N N 31 119.130 119.130 118.004 1.126 19668 1274 1 4 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.042 -0.172 19668 1275 1 4 . 1 1 31 31 LYS C C 31 179.104 179.104 178.984 0.120 19668 1276 1 4 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.266 1.450 19668 1277 1 4 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.854 0.402 19668 1278 1 4 . 1 1 31 31 LYS H H 31 8.413 8.413 7.601 0.812 19668 1279 1 4 . 1 1 32 32 LYS N N 32 119.200 119.200 119.698 -0.498 19668 1280 1 4 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.036 0.066 19668 1281 1 4 . 1 1 32 32 LYS C C 32 179.420 179.420 179.072 0.348 19668 1282 1 4 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.045 0.412 19668 1283 1 4 . 1 1 32 32 LYS CB C 32 32.266 32.266 31.939 0.327 19668 1284 1 4 . 1 1 32 32 LYS H H 32 7.826 7.826 7.573 0.253 19668 1285 1 4 . 1 1 33 33 LYS N N 33 120.322 120.322 119.607 0.715 19668 1286 1 4 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.045 0.118 19668 1287 1 4 . 1 1 33 33 LYS C C 33 179.174 179.174 178.964 0.210 19668 1288 1 4 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.216 -0.468 19668 1289 1 4 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.335 -0.596 19668 1290 1 4 . 1 1 33 33 LYS H H 33 8.003 8.003 7.509 0.494 19668 1291 1 4 . 1 1 34 34 TYR N N 34 120.223 120.223 119.524 0.699 19668 1292 1 4 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.096 -0.040 19668 1293 1 4 . 1 1 34 34 TYR C C 34 176.356 176.356 178.039 -1.683 19668 1294 1 4 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.748 -0.693 19668 1295 1 4 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.405 -0.378 19668 1296 1 4 . 1 1 34 34 TYR H H 34 8.614 8.614 7.585 1.029 19668 1297 1 4 . 1 1 35 35 GLU N N 35 118.813 118.813 117.626 1.187 19668 1298 1 4 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.983 -0.258 19668 1299 1 4 . 1 1 35 35 GLU C C 35 179.787 179.787 179.097 0.690 19668 1300 1 4 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.002 -0.563 19668 1301 1 4 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.083 0.045 19668 1302 1 4 . 1 1 35 35 GLU H H 35 8.103 8.103 7.797 0.306 19668 1303 1 4 . 1 1 36 36 GLU N N 36 119.670 119.670 119.538 0.132 19668 1304 1 4 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.084 -0.070 19668 1305 1 4 . 1 1 36 36 GLU C C 36 179.295 179.295 179.128 0.167 19668 1306 1 4 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.174 0.089 19668 1307 1 4 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.464 0.105 19668 1308 1 4 . 1 1 36 36 GLU H H 36 8.028 8.028 7.621 0.407 19668 1309 1 4 . 1 1 37 37 LEU N N 37 121.416 121.416 118.900 2.516 19668 1310 1 4 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.963 0.056 19668 1311 1 4 . 1 1 37 37 LEU C C 37 178.277 178.277 178.719 -0.442 19668 1312 1 4 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.635 0.205 19668 1313 1 4 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.676 -0.047 19668 1314 1 4 . 1 1 37 37 LEU H H 37 8.176 8.176 7.319 0.857 19668 1315 1 4 . 1 1 38 38 LYS N N 38 118.998 118.998 118.184 0.814 19668 1316 1 4 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.981 -0.321 19668 1317 1 4 . 1 1 38 38 LYS C C 38 178.923 178.923 178.937 -0.014 19668 1318 1 4 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.722 0.678 19668 1319 1 4 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.000 0.062 19668 1320 1 4 . 1 1 38 38 LYS H H 38 8.260 8.260 7.469 0.791 19668 1321 1 4 . 1 1 39 39 LYS N N 39 118.070 118.070 118.189 -0.119 19668 1322 1 4 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.030 0.050 19668 1323 1 4 . 1 1 39 39 LYS C C 39 178.687 178.687 178.774 -0.087 19668 1324 1 4 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.920 -0.985 19668 1325 1 4 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.085 0.064 19668 1326 1 4 . 1 1 39 39 LYS H H 39 7.380 7.380 7.779 -0.399 19668 1327 1 4 . 1 1 40 40 LYS N N 40 118.894 118.894 118.537 0.357 19668 1328 1 4 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.279 -0.220 19668 1329 1 4 . 1 1 40 40 LYS C C 40 179.758 179.758 179.040 0.718 19668 1330 1 4 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.409 -0.347 19668 1331 1 4 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.164 0.224 19668 1332 1 4 . 1 1 40 40 LYS H H 40 7.919 7.919 7.439 0.480 19668 1333 1 4 . 1 1 41 41 ILE N N 41 118.270 118.270 118.174 0.096 19668 1334 1 4 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.771 -0.074 19668 1335 1 4 . 1 1 41 41 ILE C C 41 178.211 178.211 177.047 1.164 19668 1336 1 4 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.243 0.471 19668 1337 1 4 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.669 0.171 19668 1338 1 4 . 1 1 41 41 ILE H H 41 8.199 8.199 7.251 0.948 19668 1339 1 4 . 1 1 42 42 GLU N N 42 120.117 120.117 117.699 2.418 19668 1340 1 4 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.029 0.062 19668 1341 1 4 . 1 1 42 42 GLU C C 42 178.736 178.736 177.548 1.188 19668 1342 1 4 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.715 0.166 19668 1343 1 4 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.962 -0.571 19668 1344 1 4 . 1 1 42 42 GLU H H 42 7.738 7.738 7.493 0.245 19668 1345 1 4 . 1 1 43 43 GLU N N 43 117.194 117.194 116.393 0.801 19668 1346 1 4 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.143 0.156 19668 1347 1 4 . 1 1 43 43 GLU C C 43 177.658 177.658 177.345 0.313 19668 1348 1 4 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.594 -0.801 19668 1349 1 4 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.392 -0.459 19668 1350 1 4 . 1 1 43 43 GLU H H 43 7.698 7.698 7.499 0.199 19668 1351 1 4 . 1 1 44 44 LEU N N 44 120.812 120.812 118.748 2.064 19668 1352 1 4 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.240 -0.001 19668 1353 1 4 . 1 1 44 44 LEU C C 44 178.682 178.682 177.117 1.565 19668 1354 1 4 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.826 0.670 19668 1355 1 4 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.899 0.748 19668 1356 1 4 . 1 1 44 44 LEU H H 44 7.593 7.593 7.382 0.211 19668 1357 1 4 . 1 1 45 45 GLY N N 45 108.681 108.681 110.846 -2.165 19668 1358 1 4 . 1 1 45 45 GLY C C 45 174.957 174.957 174.751 0.206 19668 1359 1 4 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.911 1.175 19668 1360 1 4 . 1 1 45 45 GLY H H 45 8.234 8.234 8.647 -0.413 19668 1361 1 4 . 1 1 46 46 GLY N N 46 108.057 108.057 110.207 -2.150 19668 1362 1 4 . 1 1 46 46 GLY C C 46 174.777 174.777 174.319 0.458 19668 1363 1 4 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.744 0.620 19668 1364 1 4 . 1 1 46 46 GLY H H 46 8.182 8.182 8.082 0.100 19668 1365 1 4 . 1 1 47 47 GLY N N 47 108.494 108.494 104.776 3.718 19668 1366 1 4 . 1 1 47 47 GLY C C 47 174.572 174.572 173.894 0.678 19668 1367 1 4 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.718 0.437 19668 1368 1 4 . 1 1 47 47 GLY H H 47 8.087 8.087 7.900 0.187 19668 1369 1 4 . 1 1 48 48 GLY N N 48 108.285 108.285 110.742 -2.457 19668 1370 1 4 . 1 1 48 48 GLY C C 48 174.495 174.495 175.415 -0.920 19668 1371 1 4 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.119 0.335 19668 1372 1 4 . 1 1 48 48 GLY H H 48 8.323 8.323 8.390 -0.067 19668 1373 1 4 . 1 1 49 49 GLU N N 49 121.070 121.070 121.667 -0.597 19668 1374 1 4 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.299 0.118 19668 1375 1 4 . 1 1 49 49 GLU C C 49 177.226 177.226 177.630 -0.404 19668 1376 1 4 . 1 1 49 49 GLU CA C 49 56.571 56.571 58.456 -1.885 19668 1377 1 4 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.417 0.249 19668 1378 1 4 . 1 1 49 49 GLU H H 49 8.483 8.483 8.620 -0.137 19668 1379 1 4 . 1 1 50 50 VAL N N 50 121.794 121.794 114.420 7.374 19668 1380 1 4 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.710 0.071 19668 1381 1 4 . 1 1 50 50 VAL C C 50 176.860 176.860 177.444 -0.584 19668 1382 1 4 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.563 -0.483 19668 1383 1 4 . 1 1 50 50 VAL CB C 50 32.253 32.253 30.967 1.286 19668 1384 1 4 . 1 1 50 50 VAL H H 50 8.068 8.068 8.332 -0.264 19668 1385 1 4 . 1 1 51 51 LYS N N 51 120.593 120.593 119.462 1.131 19668 1386 1 4 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.107 0.100 19668 1387 1 4 . 1 1 51 51 LYS C C 51 178.667 178.667 178.862 -0.195 19668 1388 1 4 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.533 -0.198 19668 1389 1 4 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.772 0.486 19668 1390 1 4 . 1 1 51 51 LYS H H 51 8.253 8.253 7.899 0.354 19668 1391 1 4 . 1 1 52 52 LYS N N 52 117.572 117.572 120.056 -2.484 19668 1392 1 4 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.063 0.105 19668 1393 1 4 . 1 1 52 52 LYS C C 52 179.248 179.248 178.967 0.281 19668 1394 1 4 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.373 -0.359 19668 1395 1 4 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.292 -0.112 19668 1396 1 4 . 1 1 52 52 LYS H H 52 7.629 7.629 7.577 0.052 19668 1397 1 4 . 1 1 53 53 VAL N N 53 119.059 119.059 119.148 -0.089 19668 1398 1 4 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.646 0.146 19668 1399 1 4 . 1 1 53 53 VAL C C 53 177.987 177.987 177.677 0.310 19668 1400 1 4 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.670 0.361 19668 1401 1 4 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.049 0.322 19668 1402 1 4 . 1 1 53 53 VAL H H 53 7.638 7.638 7.755 -0.117 19668 1403 1 4 . 1 1 54 54 GLU N N 54 120.388 120.388 118.550 1.838 19668 1404 1 4 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.889 -0.045 19668 1405 1 4 . 1 1 54 54 GLU C C 54 179.624 179.624 178.774 0.850 19668 1406 1 4 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.846 0.395 19668 1407 1 4 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.109 0.709 19668 1408 1 4 . 1 1 54 54 GLU H H 54 8.603 8.603 7.645 0.958 19668 1409 1 4 . 1 1 55 55 GLU N N 55 118.533 118.533 119.432 -0.899 19668 1410 1 4 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.089 0.000 19668 1411 1 4 . 1 1 55 55 GLU C C 55 179.158 179.158 178.784 0.374 19668 1412 1 4 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.200 0.134 19668 1413 1 4 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.286 0.051 19668 1414 1 4 . 1 1 55 55 GLU H H 55 7.904 7.904 7.640 0.264 19668 1415 1 4 . 1 1 56 56 GLU N N 56 120.258 120.258 119.353 0.905 19668 1416 1 4 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.022 0.078 19668 1417 1 4 . 1 1 56 56 GLU C C 56 179.867 179.867 179.333 0.534 19668 1418 1 4 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.364 0.299 19668 1419 1 4 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.555 0.495 19668 1420 1 4 . 1 1 56 56 GLU H H 56 7.902 7.902 7.487 0.415 19668 1421 1 4 . 1 1 57 57 VAL N N 57 121.168 121.168 120.146 1.022 19668 1422 1 4 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.550 0.018 19668 1423 1 4 . 1 1 57 57 VAL C C 57 176.994 176.994 177.031 -0.037 19668 1424 1 4 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.604 1.292 19668 1425 1 4 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.859 -0.332 19668 1426 1 4 . 1 1 57 57 VAL H H 57 8.613 8.613 7.539 1.074 19668 1427 1 4 . 1 1 58 58 LYS N N 58 120.234 120.234 119.276 0.958 19668 1428 1 4 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.914 0.288 19668 1429 1 4 . 1 1 58 58 LYS C C 58 179.131 179.131 178.901 0.230 19668 1430 1 4 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.560 0.027 19668 1431 1 4 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.102 0.189 19668 1432 1 4 . 1 1 58 58 LYS H H 58 7.810 7.810 7.474 0.336 19668 1433 1 4 . 1 1 59 59 LYS N N 59 118.301 118.301 118.295 0.006 19668 1434 1 4 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.037 0.056 19668 1435 1 4 . 1 1 59 59 LYS C C 59 179.281 179.281 178.665 0.616 19668 1436 1 4 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.108 0.320 19668 1437 1 4 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.093 0.286 19668 1438 1 4 . 1 1 59 59 LYS H H 59 7.876 7.876 7.472 0.404 19668 1439 1 4 . 1 1 60 60 LEU N N 60 121.224 121.224 120.120 1.104 19668 1440 1 4 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.001 0.233 19668 1441 1 4 . 1 1 60 60 LEU C C 60 178.636 178.636 178.763 -0.127 19668 1442 1 4 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.797 0.360 19668 1443 1 4 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.331 0.303 19668 1444 1 4 . 1 1 60 60 LEU H H 60 7.893 7.893 7.719 0.174 19668 1445 1 4 . 1 1 61 61 GLU N N 61 118.660 118.660 118.038 0.622 19668 1446 1 4 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.080 -0.281 19668 1447 1 4 . 1 1 61 61 GLU C C 61 179.094 179.094 178.815 0.279 19668 1448 1 4 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.057 1.215 19668 1449 1 4 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.691 1.312 19668 1450 1 4 . 1 1 61 61 GLU H H 61 8.644 8.644 7.870 0.774 19668 1451 1 4 . 1 1 62 62 GLU N N 62 117.555 117.555 118.803 -1.248 19668 1452 1 4 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.011 -0.015 19668 1453 1 4 . 1 1 62 62 GLU C C 62 178.940 178.940 178.967 -0.027 19668 1454 1 4 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.432 -0.264 19668 1455 1 4 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.324 0.223 19668 1456 1 4 . 1 1 62 62 GLU H H 62 7.995 7.995 7.674 0.321 19668 1457 1 4 . 1 1 63 63 GLU N N 63 119.097 119.097 118.034 1.063 19668 1458 1 4 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.154 -0.125 19668 1459 1 4 . 1 1 63 63 GLU C C 63 179.890 179.890 178.818 1.072 19668 1460 1 4 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.353 0.988 19668 1461 1 4 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.998 0.669 19668 1462 1 4 . 1 1 63 63 GLU H H 63 7.983 7.983 7.648 0.335 19668 1463 1 4 . 1 1 64 64 ILE N N 64 118.247 118.247 119.148 -0.901 19668 1464 1 4 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.766 -0.046 19668 1465 1 4 . 1 1 64 64 ILE C C 64 177.858 177.858 178.479 -0.621 19668 1466 1 4 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.505 -0.009 19668 1467 1 4 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.751 0.230 19668 1468 1 4 . 1 1 64 64 ILE H H 64 8.261 8.261 7.414 0.847 19668 1469 1 4 . 1 1 65 65 LYS N N 65 118.693 118.693 120.221 -1.528 19668 1470 1 4 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.170 -0.072 19668 1471 1 4 . 1 1 65 65 LYS C C 65 177.244 177.244 177.324 -0.080 19668 1472 1 4 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.721 -0.068 19668 1473 1 4 . 1 1 65 65 LYS CB C 65 32.705 32.705 31.905 0.800 19668 1474 1 4 . 1 1 65 65 LYS H H 65 7.661 7.661 7.775 -0.114 19668 1475 1 4 . 1 1 66 66 LYS N N 66 116.933 116.933 116.671 0.262 19668 1476 1 4 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.179 0.159 19668 1477 1 4 . 1 1 66 66 LYS C C 66 176.011 176.011 176.587 -0.576 19668 1478 1 4 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.218 -0.759 19668 1479 1 4 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.569 0.562 19668 1480 1 4 . 1 1 66 66 LYS H H 66 7.261 7.261 7.549 -0.288 19668 1481 1 5 . 1 1 2 2 SER HA H 2 4.560 4.560 4.401 0.159 19668 1482 1 5 . 1 1 2 2 SER CA C 2 58.366 58.366 59.481 -1.115 19668 1483 1 5 . 1 1 3 3 ARG N N 3 125.213 125.213 124.808 0.405 19668 1484 1 5 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.166 0.100 19668 1485 1 5 . 1 1 3 3 ARG C C 3 178.381 178.381 178.155 0.226 19668 1486 1 5 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.480 -0.084 19668 1487 1 5 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.164 1.491 19668 1488 1 5 . 1 1 3 3 ARG H H 3 8.874 8.874 8.513 0.361 19668 1489 1 5 . 1 1 4 4 VAL N N 4 119.320 119.320 118.776 0.544 19668 1490 1 5 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.708 0.090 19668 1491 1 5 . 1 1 4 4 VAL C C 4 177.004 177.004 177.570 -0.566 19668 1492 1 5 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.214 -0.699 19668 1493 1 5 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.049 0.754 19668 1494 1 5 . 1 1 4 4 VAL H H 4 8.112 8.112 8.336 -0.224 19668 1495 1 5 . 1 1 5 5 LYS N N 5 122.279 122.279 120.807 1.472 19668 1496 1 5 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.994 0.168 19668 1497 1 5 . 1 1 5 5 LYS C C 5 178.547 178.547 178.232 0.315 19668 1498 1 5 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.787 -0.029 19668 1499 1 5 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.616 0.394 19668 1500 1 5 . 1 1 5 5 LYS H H 5 7.847 7.847 7.839 0.008 19668 1501 1 5 . 1 1 6 6 ALA N N 6 120.295 120.295 122.173 -1.878 19668 1502 1 5 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.093 0.118 19668 1503 1 5 . 1 1 6 6 ALA C C 6 180.834 180.834 179.682 1.152 19668 1504 1 5 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.114 -0.211 19668 1505 1 5 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.935 0.197 19668 1506 1 5 . 1 1 6 6 ALA H H 6 7.975 7.975 7.946 0.029 19668 1507 1 5 . 1 1 7 7 LEU N N 7 119.570 119.570 118.590 0.980 19668 1508 1 5 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.073 0.099 19668 1509 1 5 . 1 1 7 7 LEU C C 7 178.431 178.431 178.705 -0.274 19668 1510 1 5 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.929 -0.250 19668 1511 1 5 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.150 0.885 19668 1512 1 5 . 1 1 7 7 LEU H H 7 7.650 7.650 7.521 0.129 19668 1513 1 5 . 1 1 8 8 GLU N N 8 119.934 119.934 118.468 1.466 19668 1514 1 5 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.064 -0.205 19668 1515 1 5 . 1 1 8 8 GLU C C 8 179.534 179.534 178.558 0.976 19668 1516 1 5 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.319 0.718 19668 1517 1 5 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.738 0.729 19668 1518 1 5 . 1 1 8 8 GLU H H 8 8.411 8.411 7.859 0.552 19668 1519 1 5 . 1 1 9 9 GLU N N 9 118.234 118.234 119.190 -0.956 19668 1520 1 5 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.058 0.002 19668 1521 1 5 . 1 1 9 9 GLU C C 9 179.596 179.596 178.890 0.706 19668 1522 1 5 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.367 -0.037 19668 1523 1 5 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.454 -0.036 19668 1524 1 5 . 1 1 9 9 GLU H H 9 8.206 8.206 7.713 0.493 19668 1525 1 5 . 1 1 10 10 LYS N N 10 121.042 121.042 118.974 2.068 19668 1526 1 5 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.140 0.043 19668 1527 1 5 . 1 1 10 10 LYS C C 10 179.380 179.380 179.150 0.230 19668 1528 1 5 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.194 0.132 19668 1529 1 5 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.145 0.264 19668 1530 1 5 . 1 1 10 10 LYS H H 10 7.931 7.931 7.542 0.389 19668 1531 1 5 . 1 1 11 11 VAL N N 11 118.662 118.662 119.921 -1.259 19668 1532 1 5 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.875 -0.061 19668 1533 1 5 . 1 1 11 11 VAL C C 11 178.845 178.845 178.083 0.762 19668 1534 1 5 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.362 1.625 19668 1535 1 5 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.075 0.579 19668 1536 1 5 . 1 1 11 11 VAL H H 11 8.371 8.371 7.577 0.794 19668 1537 1 5 . 1 1 12 12 LYS N N 12 123.188 123.188 120.026 3.162 19668 1538 1 5 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.910 0.316 19668 1539 1 5 . 1 1 12 12 LYS C C 12 179.098 179.098 178.366 0.732 19668 1540 1 5 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.343 0.140 19668 1541 1 5 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.330 -0.124 19668 1542 1 5 . 1 1 12 12 LYS H H 12 8.276 8.276 7.535 0.741 19668 1543 1 5 . 1 1 13 13 ALA N N 13 121.169 121.169 121.536 -0.367 19668 1544 1 5 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.055 0.203 19668 1545 1 5 . 1 1 13 13 ALA C C 13 180.169 180.169 179.731 0.438 19668 1546 1 5 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.783 -0.147 19668 1547 1 5 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.206 -0.099 19668 1548 1 5 . 1 1 13 13 ALA H H 13 7.829 7.829 7.449 0.380 19668 1549 1 5 . 1 1 14 14 LEU N N 14 118.104 118.104 118.276 -0.172 19668 1550 1 5 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.010 0.146 19668 1551 1 5 . 1 1 14 14 LEU C C 14 177.614 177.614 177.874 -0.260 19668 1552 1 5 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.102 -0.497 19668 1553 1 5 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.904 0.891 19668 1554 1 5 . 1 1 14 14 LEU H H 14 7.781 7.781 7.355 0.426 19668 1555 1 5 . 1 1 15 15 GLU N N 15 120.632 120.632 118.906 1.726 19668 1556 1 5 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.384 -0.017 19668 1557 1 5 . 1 1 15 15 GLU C C 15 178.243 178.243 178.624 -0.381 19668 1558 1 5 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.477 1.109 19668 1559 1 5 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.883 0.946 19668 1560 1 5 . 1 1 15 15 GLU H H 15 7.873 7.873 7.211 0.662 19668 1561 1 5 . 1 1 16 16 GLU N N 16 115.775 115.775 116.835 -1.060 19668 1562 1 5 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.037 -0.078 19668 1563 1 5 . 1 1 16 16 GLU C C 16 179.006 179.006 178.711 0.295 19668 1564 1 5 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.013 0.079 19668 1565 1 5 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.338 0.015 19668 1566 1 5 . 1 1 16 16 GLU H H 16 7.926 7.926 7.691 0.235 19668 1567 1 5 . 1 1 17 17 LYS N N 17 118.801 118.801 119.539 -0.738 19668 1568 1 5 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.101 -0.007 19668 1569 1 5 . 1 1 17 17 LYS C C 17 178.853 178.853 178.786 0.067 19668 1570 1 5 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.819 -0.348 19668 1571 1 5 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.834 0.528 19668 1572 1 5 . 1 1 17 17 LYS H H 17 7.518 7.518 7.500 0.018 19668 1573 1 5 . 1 1 18 18 VAL N N 18 118.034 118.034 120.294 -2.260 19668 1574 1 5 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.649 -0.137 19668 1575 1 5 . 1 1 18 18 VAL C C 18 178.362 178.362 177.737 0.625 19668 1576 1 5 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.232 -0.213 19668 1577 1 5 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.579 0.070 19668 1578 1 5 . 1 1 18 18 VAL H H 18 8.048 8.048 7.453 0.595 19668 1579 1 5 . 1 1 19 19 LYS N N 19 118.427 118.427 117.917 0.510 19668 1580 1 5 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.276 -0.266 19668 1581 1 5 . 1 1 19 19 LYS C C 19 177.706 177.706 177.404 0.302 19668 1582 1 5 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.411 0.574 19668 1583 1 5 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.933 0.491 19668 1584 1 5 . 1 1 19 19 LYS H H 19 8.008 8.008 7.389 0.619 19668 1585 1 5 . 1 1 20 20 ALA N N 20 119.177 119.177 120.075 -0.898 19668 1586 1 5 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.233 0.083 19668 1587 1 5 . 1 1 20 20 ALA C C 20 178.269 178.269 179.019 -0.750 19668 1588 1 5 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.902 -1.271 19668 1589 1 5 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.799 0.334 19668 1590 1 5 . 1 1 20 20 ALA H H 20 7.259 7.259 7.530 -0.271 19668 1591 1 5 . 1 1 21 21 LEU N N 21 118.596 118.596 114.111 4.485 19668 1592 1 5 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.312 -0.051 19668 1593 1 5 . 1 1 21 21 LEU C C 21 177.732 177.732 176.903 0.829 19668 1594 1 5 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.498 0.159 19668 1595 1 5 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.401 0.732 19668 1596 1 5 . 1 1 21 21 LEU H H 21 7.373 7.373 7.231 0.142 19668 1597 1 5 . 1 1 22 22 GLY N N 22 107.926 107.926 104.617 3.309 19668 1598 1 5 . 1 1 22 22 GLY C C 22 173.362 173.362 172.423 0.939 19668 1599 1 5 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.437 0.760 19668 1600 1 5 . 1 1 22 22 GLY H H 22 8.144 8.144 7.129 1.015 19668 1601 1 5 . 1 1 23 23 GLY N N 23 108.242 108.242 105.196 3.046 19668 1602 1 5 . 1 1 23 23 GLY C C 23 174.110 174.110 173.255 0.855 19668 1603 1 5 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.219 -0.535 19668 1604 1 5 . 1 1 23 23 GLY H H 23 8.157 8.157 8.204 -0.047 19668 1605 1 5 . 1 1 24 24 GLY N N 24 106.969 106.969 107.950 -0.981 19668 1606 1 5 . 1 1 24 24 GLY C C 24 175.172 175.172 174.786 0.386 19668 1607 1 5 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.356 -0.917 19668 1608 1 5 . 1 1 24 24 GLY H H 24 8.466 8.466 8.692 -0.226 19668 1609 1 5 . 1 1 25 25 GLY N N 25 108.946 108.946 109.266 -0.320 19668 1610 1 5 . 1 1 25 25 GLY C C 25 176.321 176.321 175.202 1.119 19668 1611 1 5 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.344 1.755 19668 1612 1 5 . 1 1 25 25 GLY H H 25 8.618 8.618 7.963 0.655 19668 1613 1 5 . 1 1 26 26 ARG N N 26 123.559 123.559 121.322 2.237 19668 1614 1 5 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.337 -0.058 19668 1615 1 5 . 1 1 26 26 ARG C C 26 178.076 178.076 178.213 -0.137 19668 1616 1 5 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.026 -0.111 19668 1617 1 5 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.174 -0.264 19668 1618 1 5 . 1 1 26 26 ARG H H 26 8.789 8.789 8.416 0.373 19668 1619 1 5 . 1 1 27 27 ILE N N 27 118.726 118.726 120.733 -2.007 19668 1620 1 5 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.820 -0.034 19668 1621 1 5 . 1 1 27 27 ILE C C 27 177.639 177.639 177.822 -0.183 19668 1622 1 5 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.464 -0.840 19668 1623 1 5 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.035 -0.080 19668 1624 1 5 . 1 1 27 27 ILE H H 27 7.762 7.762 8.026 -0.264 19668 1625 1 5 . 1 1 28 28 GLU N N 28 119.843 119.843 119.546 0.297 19668 1626 1 5 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.917 0.096 19668 1627 1 5 . 1 1 28 28 GLU C C 28 179.447 179.447 178.454 0.993 19668 1628 1 5 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.548 0.035 19668 1629 1 5 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.730 0.330 19668 1630 1 5 . 1 1 28 28 GLU H H 28 7.867 7.867 8.768 -0.901 19668 1631 1 5 . 1 1 29 29 GLU N N 29 118.447 118.447 119.454 -1.007 19668 1632 1 5 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.108 -0.021 19668 1633 1 5 . 1 1 29 29 GLU C C 29 179.310 179.310 178.951 0.359 19668 1634 1 5 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.449 0.831 19668 1635 1 5 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.287 0.049 19668 1636 1 5 . 1 1 29 29 GLU H H 29 7.755 7.755 7.741 0.014 19668 1637 1 5 . 1 1 30 30 LEU N N 30 121.135 121.135 120.353 0.782 19668 1638 1 5 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.985 0.111 19668 1639 1 5 . 1 1 30 30 LEU C C 30 178.928 178.928 178.513 0.415 19668 1640 1 5 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.329 -0.224 19668 1641 1 5 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.086 -0.406 19668 1642 1 5 . 1 1 30 30 LEU H H 30 7.785 7.785 7.583 0.202 19668 1643 1 5 . 1 1 31 31 LYS N N 31 119.130 119.130 117.642 1.488 19668 1644 1 5 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.121 -0.251 19668 1645 1 5 . 1 1 31 31 LYS C C 31 179.104 179.104 178.948 0.156 19668 1646 1 5 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.455 1.261 19668 1647 1 5 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.822 0.434 19668 1648 1 5 . 1 1 31 31 LYS H H 31 8.413 8.413 7.703 0.710 19668 1649 1 5 . 1 1 32 32 LYS N N 32 119.200 119.200 119.800 -0.600 19668 1650 1 5 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.992 0.110 19668 1651 1 5 . 1 1 32 32 LYS C C 32 179.420 179.420 179.044 0.376 19668 1652 1 5 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.535 -0.078 19668 1653 1 5 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.234 0.032 19668 1654 1 5 . 1 1 32 32 LYS H H 32 7.826 7.826 7.520 0.306 19668 1655 1 5 . 1 1 33 33 LYS N N 33 120.322 120.322 119.022 1.300 19668 1656 1 5 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.033 0.130 19668 1657 1 5 . 1 1 33 33 LYS C C 33 179.174 179.174 178.919 0.255 19668 1658 1 5 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.107 -0.359 19668 1659 1 5 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.389 -0.649 19668 1660 1 5 . 1 1 33 33 LYS H H 33 8.003 8.003 7.472 0.531 19668 1661 1 5 . 1 1 34 34 TYR N N 34 120.223 120.223 119.110 1.113 19668 1662 1 5 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.108 -0.052 19668 1663 1 5 . 1 1 34 34 TYR C C 34 176.356 176.356 177.612 -1.256 19668 1664 1 5 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.590 -0.535 19668 1665 1 5 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.321 -0.294 19668 1666 1 5 . 1 1 34 34 TYR H H 34 8.614 8.614 7.596 1.018 19668 1667 1 5 . 1 1 35 35 GLU N N 35 118.813 118.813 117.709 1.104 19668 1668 1 5 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.957 -0.232 19668 1669 1 5 . 1 1 35 35 GLU C C 35 179.787 179.787 178.376 1.411 19668 1670 1 5 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.676 -0.237 19668 1671 1 5 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.649 0.479 19668 1672 1 5 . 1 1 35 35 GLU H H 35 8.103 8.103 8.075 0.028 19668 1673 1 5 . 1 1 36 36 GLU N N 36 119.670 119.670 120.259 -0.589 19668 1674 1 5 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.100 -0.086 19668 1675 1 5 . 1 1 36 36 GLU C C 36 179.295 179.295 178.647 0.648 19668 1676 1 5 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.227 0.036 19668 1677 1 5 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.704 -0.135 19668 1678 1 5 . 1 1 36 36 GLU H H 36 8.028 8.028 7.701 0.327 19668 1679 1 5 . 1 1 37 37 LEU N N 37 121.416 121.416 120.203 1.213 19668 1680 1 5 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.016 0.003 19668 1681 1 5 . 1 1 37 37 LEU C C 37 178.277 178.277 179.073 -0.796 19668 1682 1 5 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.911 -0.071 19668 1683 1 5 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.426 0.203 19668 1684 1 5 . 1 1 37 37 LEU H H 37 8.176 8.176 7.348 0.828 19668 1685 1 5 . 1 1 38 38 LYS N N 38 118.998 118.998 117.715 1.283 19668 1686 1 5 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.895 -0.235 19668 1687 1 5 . 1 1 38 38 LYS C C 38 178.923 178.923 178.975 -0.052 19668 1688 1 5 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.048 0.352 19668 1689 1 5 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.032 0.030 19668 1690 1 5 . 1 1 38 38 LYS H H 38 8.260 8.260 7.562 0.698 19668 1691 1 5 . 1 1 39 39 LYS N N 39 118.070 118.070 117.853 0.217 19668 1692 1 5 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.079 0.001 19668 1693 1 5 . 1 1 39 39 LYS C C 39 178.687 178.687 178.932 -0.245 19668 1694 1 5 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.353 -0.417 19668 1695 1 5 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.027 0.122 19668 1696 1 5 . 1 1 39 39 LYS H H 39 7.380 7.380 7.671 -0.291 19668 1697 1 5 . 1 1 40 40 LYS N N 40 118.894 118.894 119.475 -0.581 19668 1698 1 5 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.095 -0.036 19668 1699 1 5 . 1 1 40 40 LYS C C 40 179.758 179.758 179.155 0.603 19668 1700 1 5 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.446 -0.384 19668 1701 1 5 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.129 0.259 19668 1702 1 5 . 1 1 40 40 LYS H H 40 7.919 7.919 7.413 0.506 19668 1703 1 5 . 1 1 41 41 ILE N N 41 118.270 118.270 119.056 -0.786 19668 1704 1 5 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.763 -0.066 19668 1705 1 5 . 1 1 41 41 ILE C C 41 178.211 178.211 177.014 1.197 19668 1706 1 5 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.782 -0.068 19668 1707 1 5 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.744 0.095 19668 1708 1 5 . 1 1 41 41 ILE H H 41 8.199 8.199 7.347 0.852 19668 1709 1 5 . 1 1 42 42 GLU N N 42 120.117 120.117 117.392 2.725 19668 1710 1 5 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.067 0.024 19668 1711 1 5 . 1 1 42 42 GLU C C 42 178.736 178.736 177.515 1.221 19668 1712 1 5 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.556 0.324 19668 1713 1 5 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.104 -0.713 19668 1714 1 5 . 1 1 42 42 GLU H H 42 7.738 7.738 7.620 0.118 19668 1715 1 5 . 1 1 43 43 GLU N N 43 117.194 117.194 115.705 1.489 19668 1716 1 5 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.192 0.107 19668 1717 1 5 . 1 1 43 43 GLU C C 43 177.658 177.658 177.570 0.088 19668 1718 1 5 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.413 -0.620 19668 1719 1 5 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.996 -0.063 19668 1720 1 5 . 1 1 43 43 GLU H H 43 7.698 7.698 7.578 0.120 19668 1721 1 5 . 1 1 44 44 LEU N N 44 120.812 120.812 117.460 3.352 19668 1722 1 5 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.566 -0.327 19668 1723 1 5 . 1 1 44 44 LEU C C 44 178.682 178.682 176.196 2.486 19668 1724 1 5 . 1 1 44 44 LEU CA C 44 56.496 56.496 54.742 1.754 19668 1725 1 5 . 1 1 44 44 LEU CB C 44 42.647 42.647 43.165 -0.518 19668 1726 1 5 . 1 1 44 44 LEU H H 44 7.593 7.593 7.302 0.291 19668 1727 1 5 . 1 1 45 45 GLY N N 45 108.681 108.681 107.854 0.827 19668 1728 1 5 . 1 1 45 45 GLY C C 45 174.957 174.957 174.535 0.422 19668 1729 1 5 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.157 0.929 19668 1730 1 5 . 1 1 45 45 GLY H H 45 8.234 8.234 8.435 -0.201 19668 1731 1 5 . 1 1 46 46 GLY N N 46 108.057 108.057 109.623 -1.566 19668 1732 1 5 . 1 1 46 46 GLY C C 46 174.777 174.777 173.958 0.819 19668 1733 1 5 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.601 0.763 19668 1734 1 5 . 1 1 46 46 GLY H H 46 8.182 8.182 7.971 0.211 19668 1735 1 5 . 1 1 47 47 GLY N N 47 108.494 108.494 104.126 4.368 19668 1736 1 5 . 1 1 47 47 GLY C C 47 174.572 174.572 174.250 0.322 19668 1737 1 5 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.406 0.749 19668 1738 1 5 . 1 1 47 47 GLY H H 47 8.087 8.087 8.037 0.050 19668 1739 1 5 . 1 1 48 48 GLY N N 48 108.285 108.285 110.532 -2.247 19668 1740 1 5 . 1 1 48 48 GLY C C 48 174.495 174.495 175.400 -0.905 19668 1741 1 5 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.357 0.097 19668 1742 1 5 . 1 1 48 48 GLY H H 48 8.323 8.323 8.583 -0.260 19668 1743 1 5 . 1 1 49 49 GLU N N 49 121.070 121.070 120.948 0.122 19668 1744 1 5 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.424 -0.007 19668 1745 1 5 . 1 1 49 49 GLU C C 49 177.226 177.226 178.109 -0.883 19668 1746 1 5 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.199 -0.628 19668 1747 1 5 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.078 -0.412 19668 1748 1 5 . 1 1 49 49 GLU H H 49 8.483 8.483 8.403 0.080 19668 1749 1 5 . 1 1 50 50 VAL N N 50 121.794 121.794 118.013 3.781 19668 1750 1 5 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.655 0.126 19668 1751 1 5 . 1 1 50 50 VAL C C 50 176.860 176.860 177.716 -0.856 19668 1752 1 5 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.877 -0.797 19668 1753 1 5 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.364 0.888 19668 1754 1 5 . 1 1 50 50 VAL H H 50 8.068 8.068 8.208 -0.140 19668 1755 1 5 . 1 1 51 51 LYS N N 51 120.593 120.593 119.663 0.930 19668 1756 1 5 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.097 0.110 19668 1757 1 5 . 1 1 51 51 LYS C C 51 178.667 178.667 178.718 -0.051 19668 1758 1 5 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.297 0.038 19668 1759 1 5 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.617 0.641 19668 1760 1 5 . 1 1 51 51 LYS H H 51 8.253 8.253 8.396 -0.143 19668 1761 1 5 . 1 1 52 52 LYS N N 52 117.572 117.572 120.523 -2.951 19668 1762 1 5 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.047 0.121 19668 1763 1 5 . 1 1 52 52 LYS C C 52 179.248 179.248 178.696 0.552 19668 1764 1 5 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.396 -0.382 19668 1765 1 5 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.410 -0.230 19668 1766 1 5 . 1 1 52 52 LYS H H 52 7.629 7.629 7.617 0.012 19668 1767 1 5 . 1 1 53 53 VAL N N 53 119.059 119.059 118.945 0.114 19668 1768 1 5 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.643 0.149 19668 1769 1 5 . 1 1 53 53 VAL C C 53 177.987 177.987 177.672 0.315 19668 1770 1 5 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.635 -0.604 19668 1771 1 5 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.450 -0.079 19668 1772 1 5 . 1 1 53 53 VAL H H 53 7.638 7.638 7.518 0.120 19668 1773 1 5 . 1 1 54 54 GLU N N 54 120.388 120.388 119.214 1.174 19668 1774 1 5 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.929 -0.085 19668 1775 1 5 . 1 1 54 54 GLU C C 54 179.624 179.624 178.958 0.666 19668 1776 1 5 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.722 0.519 19668 1777 1 5 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.063 0.755 19668 1778 1 5 . 1 1 54 54 GLU H H 54 8.603 8.603 7.714 0.889 19668 1779 1 5 . 1 1 55 55 GLU N N 55 118.533 118.533 119.365 -0.832 19668 1780 1 5 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.063 0.026 19668 1781 1 5 . 1 1 55 55 GLU C C 55 179.158 179.158 178.916 0.242 19668 1782 1 5 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.295 0.038 19668 1783 1 5 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.550 -0.213 19668 1784 1 5 . 1 1 55 55 GLU H H 55 7.904 7.904 7.610 0.294 19668 1785 1 5 . 1 1 56 56 GLU N N 56 120.258 120.258 119.335 0.923 19668 1786 1 5 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.024 0.076 19668 1787 1 5 . 1 1 56 56 GLU C C 56 179.867 179.867 179.219 0.648 19668 1788 1 5 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.299 0.364 19668 1789 1 5 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.574 0.476 19668 1790 1 5 . 1 1 56 56 GLU H H 56 7.902 7.902 7.470 0.432 19668 1791 1 5 . 1 1 57 57 VAL N N 57 121.168 121.168 119.025 2.143 19668 1792 1 5 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.646 -0.078 19668 1793 1 5 . 1 1 57 57 VAL C C 57 176.994 176.994 177.205 -0.211 19668 1794 1 5 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.861 2.036 19668 1795 1 5 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.619 -0.092 19668 1796 1 5 . 1 1 57 57 VAL H H 57 8.613 8.613 7.520 1.093 19668 1797 1 5 . 1 1 58 58 LYS N N 58 120.234 120.234 119.516 0.718 19668 1798 1 5 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.970 0.232 19668 1799 1 5 . 1 1 58 58 LYS C C 58 179.131 179.131 178.721 0.410 19668 1800 1 5 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.589 -0.002 19668 1801 1 5 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.532 0.759 19668 1802 1 5 . 1 1 58 58 LYS H H 58 7.810 7.810 7.575 0.234 19668 1803 1 5 . 1 1 59 59 LYS N N 59 118.301 118.301 118.858 -0.557 19668 1804 1 5 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.047 0.046 19668 1805 1 5 . 1 1 59 59 LYS C C 59 179.281 179.281 178.388 0.893 19668 1806 1 5 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.991 0.437 19668 1807 1 5 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.053 0.327 19668 1808 1 5 . 1 1 59 59 LYS H H 59 7.876 7.876 7.396 0.480 19668 1809 1 5 . 1 1 60 60 LEU N N 60 121.224 121.224 120.367 0.857 19668 1810 1 5 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.967 0.267 19668 1811 1 5 . 1 1 60 60 LEU C C 60 178.636 178.636 178.617 0.019 19668 1812 1 5 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.805 0.352 19668 1813 1 5 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.276 0.358 19668 1814 1 5 . 1 1 60 60 LEU H H 60 7.893 7.893 7.621 0.272 19668 1815 1 5 . 1 1 61 61 GLU N N 61 118.660 118.660 117.909 0.751 19668 1816 1 5 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.053 -0.254 19668 1817 1 5 . 1 1 61 61 GLU C C 61 179.094 179.094 178.687 0.407 19668 1818 1 5 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.079 1.193 19668 1819 1 5 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.645 1.358 19668 1820 1 5 . 1 1 61 61 GLU H H 61 8.644 8.644 7.791 0.853 19668 1821 1 5 . 1 1 62 62 GLU N N 62 117.555 117.555 119.423 -1.868 19668 1822 1 5 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.022 -0.026 19668 1823 1 5 . 1 1 62 62 GLU C C 62 178.940 178.940 179.196 -0.256 19668 1824 1 5 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.194 -0.026 19668 1825 1 5 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.087 0.460 19668 1826 1 5 . 1 1 62 62 GLU H H 62 7.995 7.995 7.582 0.413 19668 1827 1 5 . 1 1 63 63 GLU N N 63 119.097 119.097 118.283 0.814 19668 1828 1 5 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.154 -0.125 19668 1829 1 5 . 1 1 63 63 GLU C C 63 179.890 179.890 178.941 0.949 19668 1830 1 5 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.409 0.932 19668 1831 1 5 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.941 0.726 19668 1832 1 5 . 1 1 63 63 GLU H H 63 7.983 7.983 7.718 0.265 19668 1833 1 5 . 1 1 64 64 ILE N N 64 118.247 118.247 119.345 -1.098 19668 1834 1 5 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.764 -0.044 19668 1835 1 5 . 1 1 64 64 ILE C C 64 177.858 177.858 178.605 -0.747 19668 1836 1 5 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.552 -0.056 19668 1837 1 5 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.590 0.391 19668 1838 1 5 . 1 1 64 64 ILE H H 64 8.261 8.261 7.280 0.981 19668 1839 1 5 . 1 1 65 65 LYS N N 65 118.693 118.693 119.129 -0.436 19668 1840 1 5 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.170 -0.072 19668 1841 1 5 . 1 1 65 65 LYS C C 65 177.244 177.244 177.736 -0.492 19668 1842 1 5 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.730 -0.077 19668 1843 1 5 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.140 0.565 19668 1844 1 5 . 1 1 65 65 LYS H H 65 7.661 7.661 7.669 -0.008 19668 1845 1 5 . 1 1 66 66 LYS N N 66 116.933 116.933 118.384 -1.451 19668 1846 1 5 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.201 0.137 19668 1847 1 5 . 1 1 66 66 LYS C C 66 176.011 176.011 176.586 -0.575 19668 1848 1 5 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.528 -1.069 19668 1849 1 5 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.878 0.253 19668 1850 1 5 . 1 1 66 66 LYS H H 66 7.261 7.261 7.714 -0.453 19668 1851 1 6 . 1 1 2 2 SER HA H 2 4.560 4.560 4.701 -0.141 19668 1852 1 6 . 1 1 2 2 SER CA C 2 58.366 58.366 58.566 -0.200 19668 1853 1 6 . 1 1 3 3 ARG N N 3 125.213 125.213 123.624 1.589 19668 1854 1 6 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.294 -0.028 19668 1855 1 6 . 1 1 3 3 ARG C C 3 178.381 178.381 175.926 2.455 19668 1856 1 6 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.418 0.978 19668 1857 1 6 . 1 1 3 3 ARG CB C 3 30.655 30.655 30.295 0.360 19668 1858 1 6 . 1 1 3 3 ARG H H 3 8.874 8.874 7.891 0.983 19668 1859 1 6 . 1 1 4 4 VAL N N 4 119.320 119.320 122.308 -2.988 19668 1860 1 6 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.737 0.061 19668 1861 1 6 . 1 1 4 4 VAL C C 4 177.004 177.004 177.320 -0.316 19668 1862 1 6 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.088 -0.573 19668 1863 1 6 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.718 0.085 19668 1864 1 6 . 1 1 4 4 VAL H H 4 8.112 8.112 8.423 -0.311 19668 1865 1 6 . 1 1 5 5 LYS N N 5 122.279 122.279 120.316 1.963 19668 1866 1 6 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.998 0.164 19668 1867 1 6 . 1 1 5 5 LYS C C 5 178.547 178.547 178.222 0.325 19668 1868 1 6 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.914 -0.156 19668 1869 1 6 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.759 0.250 19668 1870 1 6 . 1 1 5 5 LYS H H 5 7.847 7.847 7.599 0.248 19668 1871 1 6 . 1 1 6 6 ALA N N 6 120.295 120.295 121.153 -0.858 19668 1872 1 6 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.038 0.173 19668 1873 1 6 . 1 1 6 6 ALA C C 6 180.834 180.834 179.251 1.583 19668 1874 1 6 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.943 -0.040 19668 1875 1 6 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.170 -0.038 19668 1876 1 6 . 1 1 6 6 ALA H H 6 7.975 7.975 8.063 -0.088 19668 1877 1 6 . 1 1 7 7 LEU N N 7 119.570 119.570 118.292 1.278 19668 1878 1 6 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.060 0.112 19668 1879 1 6 . 1 1 7 7 LEU C C 7 178.431 178.431 178.608 -0.177 19668 1880 1 6 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.734 -0.055 19668 1881 1 6 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.146 0.889 19668 1882 1 6 . 1 1 7 7 LEU H H 7 7.650 7.650 7.672 -0.022 19668 1883 1 6 . 1 1 8 8 GLU N N 8 119.934 119.934 118.499 1.435 19668 1884 1 6 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.069 -0.210 19668 1885 1 6 . 1 1 8 8 GLU C C 8 179.534 179.534 178.568 0.966 19668 1886 1 6 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.297 0.740 19668 1887 1 6 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.754 0.713 19668 1888 1 6 . 1 1 8 8 GLU H H 8 8.411 8.411 7.912 0.499 19668 1889 1 6 . 1 1 9 9 GLU N N 9 118.234 118.234 119.453 -1.219 19668 1890 1 6 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.049 0.011 19668 1891 1 6 . 1 1 9 9 GLU C C 9 179.596 179.596 178.909 0.687 19668 1892 1 6 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.281 0.050 19668 1893 1 6 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.485 -0.067 19668 1894 1 6 . 1 1 9 9 GLU H H 9 8.206 8.206 7.669 0.537 19668 1895 1 6 . 1 1 10 10 LYS N N 10 121.042 121.042 118.868 2.174 19668 1896 1 6 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.145 0.038 19668 1897 1 6 . 1 1 10 10 LYS C C 10 179.380 179.380 179.135 0.245 19668 1898 1 6 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.157 0.168 19668 1899 1 6 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.188 0.221 19668 1900 1 6 . 1 1 10 10 LYS H H 10 7.931 7.931 7.561 0.370 19668 1901 1 6 . 1 1 11 11 VAL N N 11 118.662 118.662 120.176 -1.514 19668 1902 1 6 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.827 -0.013 19668 1903 1 6 . 1 1 11 11 VAL C C 11 178.845 178.845 177.997 0.848 19668 1904 1 6 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.402 0.586 19668 1905 1 6 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.655 -0.001 19668 1906 1 6 . 1 1 11 11 VAL H H 11 8.371 8.371 7.583 0.788 19668 1907 1 6 . 1 1 12 12 LYS N N 12 123.188 123.188 119.955 3.233 19668 1908 1 6 . 1 1 12 12 LYS HA H 12 4.226 4.226 4.131 0.095 19668 1909 1 6 . 1 1 12 12 LYS C C 12 179.098 179.098 178.452 0.646 19668 1910 1 6 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.116 0.367 19668 1911 1 6 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.445 -0.239 19668 1912 1 6 . 1 1 12 12 LYS H H 12 8.276 8.276 7.518 0.758 19668 1913 1 6 . 1 1 13 13 ALA N N 13 121.169 121.169 121.439 -0.270 19668 1914 1 6 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.061 0.197 19668 1915 1 6 . 1 1 13 13 ALA C C 13 180.169 180.169 179.769 0.400 19668 1916 1 6 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.791 -0.155 19668 1917 1 6 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.218 -0.111 19668 1918 1 6 . 1 1 13 13 ALA H H 13 7.829 7.829 7.449 0.380 19668 1919 1 6 . 1 1 14 14 LEU N N 14 118.104 118.104 118.114 -0.010 19668 1920 1 6 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.001 0.155 19668 1921 1 6 . 1 1 14 14 LEU C C 14 177.614 177.614 177.947 -0.333 19668 1922 1 6 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.176 -0.571 19668 1923 1 6 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.995 0.800 19668 1924 1 6 . 1 1 14 14 LEU H H 14 7.781 7.781 7.517 0.264 19668 1925 1 6 . 1 1 15 15 GLU N N 15 120.632 120.632 118.993 1.639 19668 1926 1 6 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.394 -0.027 19668 1927 1 6 . 1 1 15 15 GLU C C 15 178.243 178.243 178.643 -0.400 19668 1928 1 6 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.673 0.913 19668 1929 1 6 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.968 0.861 19668 1930 1 6 . 1 1 15 15 GLU H H 15 7.873 7.873 7.322 0.551 19668 1931 1 6 . 1 1 16 16 GLU N N 16 115.775 115.775 117.018 -1.243 19668 1932 1 6 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.990 -0.031 19668 1933 1 6 . 1 1 16 16 GLU C C 16 179.006 179.006 178.708 0.298 19668 1934 1 6 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.930 0.162 19668 1935 1 6 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.544 -0.191 19668 1936 1 6 . 1 1 16 16 GLU H H 16 7.926 7.926 7.724 0.202 19668 1937 1 6 . 1 1 17 17 LYS N N 17 118.801 118.801 119.560 -0.759 19668 1938 1 6 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.087 0.007 19668 1939 1 6 . 1 1 17 17 LYS C C 17 178.853 178.853 178.729 0.124 19668 1940 1 6 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.845 -0.374 19668 1941 1 6 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.854 0.508 19668 1942 1 6 . 1 1 17 17 LYS H H 17 7.518 7.518 7.504 0.014 19668 1943 1 6 . 1 1 18 18 VAL N N 18 118.034 118.034 120.298 -2.264 19668 1944 1 6 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.627 -0.115 19668 1945 1 6 . 1 1 18 18 VAL C C 18 178.362 178.362 177.615 0.747 19668 1946 1 6 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.610 -0.591 19668 1947 1 6 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.634 0.015 19668 1948 1 6 . 1 1 18 18 VAL H H 18 8.048 8.048 7.432 0.616 19668 1949 1 6 . 1 1 19 19 LYS N N 19 118.427 118.427 117.573 0.854 19668 1950 1 6 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.079 -0.069 19668 1951 1 6 . 1 1 19 19 LYS C C 19 177.706 177.706 177.342 0.364 19668 1952 1 6 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.621 0.364 19668 1953 1 6 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.972 0.452 19668 1954 1 6 . 1 1 19 19 LYS H H 19 8.008 8.008 7.423 0.585 19668 1955 1 6 . 1 1 20 20 ALA N N 20 119.177 119.177 120.721 -1.544 19668 1956 1 6 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.271 0.045 19668 1957 1 6 . 1 1 20 20 ALA C C 20 178.269 178.269 179.013 -0.744 19668 1958 1 6 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.369 -0.738 19668 1959 1 6 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.110 0.023 19668 1960 1 6 . 1 1 20 20 ALA H H 20 7.259 7.259 7.447 -0.188 19668 1961 1 6 . 1 1 21 21 LEU N N 21 118.596 118.596 115.611 2.985 19668 1962 1 6 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.213 0.048 19668 1963 1 6 . 1 1 21 21 LEU C C 21 177.732 177.732 177.411 0.321 19668 1964 1 6 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.143 -0.486 19668 1965 1 6 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.373 0.760 19668 1966 1 6 . 1 1 21 21 LEU H H 21 7.373 7.373 7.266 0.107 19668 1967 1 6 . 1 1 22 22 GLY N N 22 107.926 107.926 104.746 3.180 19668 1968 1 6 . 1 1 22 22 GLY C C 22 173.362 173.362 172.365 0.997 19668 1969 1 6 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.940 0.257 19668 1970 1 6 . 1 1 22 22 GLY H H 22 8.144 8.144 7.482 0.662 19668 1971 1 6 . 1 1 23 23 GLY N N 23 108.242 108.242 105.581 2.661 19668 1972 1 6 . 1 1 23 23 GLY C C 23 174.110 174.110 172.629 1.481 19668 1973 1 6 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.949 -0.265 19668 1974 1 6 . 1 1 23 23 GLY H H 23 8.157 8.157 8.061 0.096 19668 1975 1 6 . 1 1 24 24 GLY N N 24 106.969 106.969 109.785 -2.816 19668 1976 1 6 . 1 1 24 24 GLY C C 24 175.172 175.172 174.789 0.383 19668 1977 1 6 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.802 -0.363 19668 1978 1 6 . 1 1 24 24 GLY H H 24 8.466 8.466 8.409 0.057 19668 1979 1 6 . 1 1 25 25 GLY N N 25 108.946 108.946 111.364 -2.418 19668 1980 1 6 . 1 1 25 25 GLY C C 25 176.321 176.321 174.446 1.875 19668 1981 1 6 . 1 1 25 25 GLY CA C 25 47.099 47.099 44.865 2.234 19668 1982 1 6 . 1 1 25 25 GLY H H 25 8.618 8.618 7.827 0.790 19668 1983 1 6 . 1 1 26 26 ARG N N 26 123.559 123.559 122.985 0.574 19668 1984 1 6 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.001 0.278 19668 1985 1 6 . 1 1 26 26 ARG C C 26 178.076 178.076 178.071 0.005 19668 1986 1 6 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.013 -1.098 19668 1987 1 6 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.160 -0.250 19668 1988 1 6 . 1 1 26 26 ARG H H 26 8.789 8.789 8.538 0.251 19668 1989 1 6 . 1 1 27 27 ILE N N 27 118.726 118.726 117.364 1.362 19668 1990 1 6 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.859 -0.073 19668 1991 1 6 . 1 1 27 27 ILE C C 27 177.639 177.639 177.829 -0.190 19668 1992 1 6 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.122 0.502 19668 1993 1 6 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.746 0.209 19668 1994 1 6 . 1 1 27 27 ILE H H 27 7.762 7.762 8.151 -0.389 19668 1995 1 6 . 1 1 28 28 GLU N N 28 119.843 119.843 119.971 -0.128 19668 1996 1 6 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.987 0.026 19668 1997 1 6 . 1 1 28 28 GLU C C 28 179.447 179.447 179.086 0.361 19668 1998 1 6 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.845 -0.262 19668 1999 1 6 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.435 -0.375 19668 2000 1 6 . 1 1 28 28 GLU H H 28 7.867 7.867 7.731 0.136 19668 2001 1 6 . 1 1 29 29 GLU N N 29 118.447 118.447 119.268 -0.821 19668 2002 1 6 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.033 0.054 19668 2003 1 6 . 1 1 29 29 GLU C C 29 179.310 179.310 179.212 0.098 19668 2004 1 6 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.895 0.385 19668 2005 1 6 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.462 -0.126 19668 2006 1 6 . 1 1 29 29 GLU H H 29 7.755 7.755 7.935 -0.180 19668 2007 1 6 . 1 1 30 30 LEU N N 30 121.135 121.135 119.738 1.397 19668 2008 1 6 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.008 0.088 19668 2009 1 6 . 1 1 30 30 LEU C C 30 178.928 178.928 178.411 0.517 19668 2010 1 6 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.199 -0.094 19668 2011 1 6 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.059 -0.379 19668 2012 1 6 . 1 1 30 30 LEU H H 30 7.785 7.785 7.609 0.176 19668 2013 1 6 . 1 1 31 31 LYS N N 31 119.130 119.130 117.907 1.223 19668 2014 1 6 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.113 -0.243 19668 2015 1 6 . 1 1 31 31 LYS C C 31 179.104 179.104 179.011 0.093 19668 2016 1 6 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.226 1.490 19668 2017 1 6 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.883 0.373 19668 2018 1 6 . 1 1 31 31 LYS H H 31 8.413 8.413 7.510 0.903 19668 2019 1 6 . 1 1 32 32 LYS N N 32 119.200 119.200 118.770 0.430 19668 2020 1 6 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.024 0.078 19668 2021 1 6 . 1 1 32 32 LYS C C 32 179.420 179.420 178.967 0.453 19668 2022 1 6 . 1 1 32 32 LYS CA C 32 59.457 59.457 58.494 0.963 19668 2023 1 6 . 1 1 32 32 LYS CB C 32 32.266 32.266 31.640 0.626 19668 2024 1 6 . 1 1 32 32 LYS H H 32 7.826 7.826 7.545 0.281 19668 2025 1 6 . 1 1 33 33 LYS N N 33 120.322 120.322 119.411 0.911 19668 2026 1 6 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.040 0.123 19668 2027 1 6 . 1 1 33 33 LYS C C 33 179.174 179.174 178.950 0.224 19668 2028 1 6 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.140 -0.392 19668 2029 1 6 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.248 -0.509 19668 2030 1 6 . 1 1 33 33 LYS H H 33 8.003 8.003 7.581 0.422 19668 2031 1 6 . 1 1 34 34 TYR N N 34 120.223 120.223 117.851 2.372 19668 2032 1 6 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.171 -0.115 19668 2033 1 6 . 1 1 34 34 TYR C C 34 176.356 176.356 177.760 -1.404 19668 2034 1 6 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.246 -0.191 19668 2035 1 6 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.119 -0.092 19668 2036 1 6 . 1 1 34 34 TYR H H 34 8.614 8.614 7.497 1.117 19668 2037 1 6 . 1 1 35 35 GLU N N 35 118.813 118.813 117.337 1.476 19668 2038 1 6 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.933 -0.208 19668 2039 1 6 . 1 1 35 35 GLU C C 35 179.787 179.787 178.900 0.887 19668 2040 1 6 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.125 -0.686 19668 2041 1 6 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.123 0.005 19668 2042 1 6 . 1 1 35 35 GLU H H 35 8.103 8.103 7.847 0.256 19668 2043 1 6 . 1 1 36 36 GLU N N 36 119.670 119.670 119.794 -0.124 19668 2044 1 6 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.098 -0.084 19668 2045 1 6 . 1 1 36 36 GLU C C 36 179.295 179.295 179.053 0.242 19668 2046 1 6 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.356 -0.093 19668 2047 1 6 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.242 0.327 19668 2048 1 6 . 1 1 36 36 GLU H H 36 8.028 8.028 7.677 0.351 19668 2049 1 6 . 1 1 37 37 LEU N N 37 121.416 121.416 117.755 3.661 19668 2050 1 6 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.007 0.012 19668 2051 1 6 . 1 1 37 37 LEU C C 37 178.277 178.277 178.855 -0.578 19668 2052 1 6 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.540 0.300 19668 2053 1 6 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.651 -0.022 19668 2054 1 6 . 1 1 37 37 LEU H H 37 8.176 8.176 7.381 0.795 19668 2055 1 6 . 1 1 38 38 LYS N N 38 118.998 118.998 117.952 1.046 19668 2056 1 6 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.972 -0.312 19668 2057 1 6 . 1 1 38 38 LYS C C 38 178.923 178.923 179.078 -0.155 19668 2058 1 6 . 1 1 38 38 LYS CA C 38 60.400 60.400 58.993 1.407 19668 2059 1 6 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.032 0.030 19668 2060 1 6 . 1 1 38 38 LYS H H 38 8.260 8.260 7.591 0.669 19668 2061 1 6 . 1 1 39 39 LYS N N 39 118.070 118.070 119.089 -1.019 19668 2062 1 6 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.054 0.026 19668 2063 1 6 . 1 1 39 39 LYS C C 39 178.687 178.687 178.926 -0.239 19668 2064 1 6 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.341 -0.405 19668 2065 1 6 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.126 0.023 19668 2066 1 6 . 1 1 39 39 LYS H H 39 7.380 7.380 7.521 -0.141 19668 2067 1 6 . 1 1 40 40 LYS N N 40 118.894 118.894 118.483 0.411 19668 2068 1 6 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.048 0.011 19668 2069 1 6 . 1 1 40 40 LYS C C 40 179.758 179.758 179.061 0.697 19668 2070 1 6 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.356 -0.294 19668 2071 1 6 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.307 0.081 19668 2072 1 6 . 1 1 40 40 LYS H H 40 7.919 7.919 7.454 0.465 19668 2073 1 6 . 1 1 41 41 ILE N N 41 118.270 118.270 117.362 0.908 19668 2074 1 6 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.818 -0.121 19668 2075 1 6 . 1 1 41 41 ILE C C 41 178.211 178.211 177.019 1.192 19668 2076 1 6 . 1 1 41 41 ILE CA C 41 64.714 64.714 63.930 0.784 19668 2077 1 6 . 1 1 41 41 ILE CB C 41 37.839 37.839 38.013 -0.173 19668 2078 1 6 . 1 1 41 41 ILE H H 41 8.199 8.199 7.336 0.863 19668 2079 1 6 . 1 1 42 42 GLU N N 42 120.117 120.117 117.285 2.832 19668 2080 1 6 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.040 0.051 19668 2081 1 6 . 1 1 42 42 GLU C C 42 178.736 178.736 177.588 1.148 19668 2082 1 6 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.679 0.201 19668 2083 1 6 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.202 -0.811 19668 2084 1 6 . 1 1 42 42 GLU H H 42 7.738 7.738 7.600 0.138 19668 2085 1 6 . 1 1 43 43 GLU N N 43 117.194 117.194 115.596 1.598 19668 2086 1 6 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.237 0.062 19668 2087 1 6 . 1 1 43 43 GLU C C 43 177.658 177.658 177.375 0.283 19668 2088 1 6 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.734 0.058 19668 2089 1 6 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.891 0.042 19668 2090 1 6 . 1 1 43 43 GLU H H 43 7.698 7.698 7.543 0.155 19668 2091 1 6 . 1 1 44 44 LEU N N 44 120.812 120.812 122.972 -2.160 19668 2092 1 6 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.177 0.062 19668 2093 1 6 . 1 1 44 44 LEU C C 44 178.682 178.682 176.976 1.706 19668 2094 1 6 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.539 0.957 19668 2095 1 6 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.435 0.212 19668 2096 1 6 . 1 1 44 44 LEU H H 44 7.593 7.593 7.232 0.361 19668 2097 1 6 . 1 1 45 45 GLY N N 45 108.681 108.681 111.964 -3.283 19668 2098 1 6 . 1 1 45 45 GLY C C 45 174.957 174.957 174.605 0.352 19668 2099 1 6 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.531 1.555 19668 2100 1 6 . 1 1 45 45 GLY H H 45 8.234 8.234 8.599 -0.365 19668 2101 1 6 . 1 1 46 46 GLY N N 46 108.057 108.057 114.557 -6.500 19668 2102 1 6 . 1 1 46 46 GLY C C 46 174.777 174.777 173.479 1.298 19668 2103 1 6 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.995 0.369 19668 2104 1 6 . 1 1 46 46 GLY H H 46 8.182 8.182 8.169 0.013 19668 2105 1 6 . 1 1 47 47 GLY N N 47 108.494 108.494 109.124 -0.630 19668 2106 1 6 . 1 1 47 47 GLY C C 47 174.572 174.572 173.885 0.687 19668 2107 1 6 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.858 0.297 19668 2108 1 6 . 1 1 47 47 GLY H H 47 8.087 8.087 7.676 0.411 19668 2109 1 6 . 1 1 48 48 GLY N N 48 108.285 108.285 108.905 -0.620 19668 2110 1 6 . 1 1 48 48 GLY C C 48 174.495 174.495 175.745 -1.250 19668 2111 1 6 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.797 -0.343 19668 2112 1 6 . 1 1 48 48 GLY H H 48 8.323 8.323 8.314 0.009 19668 2113 1 6 . 1 1 49 49 GLU N N 49 121.070 121.070 122.075 -1.005 19668 2114 1 6 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.264 0.153 19668 2115 1 6 . 1 1 49 49 GLU C C 49 177.226 177.226 178.178 -0.952 19668 2116 1 6 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.138 -0.567 19668 2117 1 6 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.749 -0.083 19668 2118 1 6 . 1 1 49 49 GLU H H 49 8.483 8.483 8.170 0.313 19668 2119 1 6 . 1 1 50 50 VAL N N 50 121.794 121.794 119.888 1.906 19668 2120 1 6 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.674 0.107 19668 2121 1 6 . 1 1 50 50 VAL C C 50 176.860 176.860 177.215 -0.355 19668 2122 1 6 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.498 -0.418 19668 2123 1 6 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.724 0.529 19668 2124 1 6 . 1 1 50 50 VAL H H 50 8.068 8.068 7.968 0.100 19668 2125 1 6 . 1 1 51 51 LYS N N 51 120.593 120.593 118.702 1.891 19668 2126 1 6 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.110 0.097 19668 2127 1 6 . 1 1 51 51 LYS C C 51 178.667 178.667 178.911 -0.244 19668 2128 1 6 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.256 0.079 19668 2129 1 6 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.883 0.375 19668 2130 1 6 . 1 1 51 51 LYS H H 51 8.253 8.253 7.440 0.813 19668 2131 1 6 . 1 1 52 52 LYS N N 52 117.572 117.572 119.962 -2.390 19668 2132 1 6 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.052 0.116 19668 2133 1 6 . 1 1 52 52 LYS C C 52 179.248 179.248 178.835 0.413 19668 2134 1 6 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.528 -0.514 19668 2135 1 6 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.229 -0.049 19668 2136 1 6 . 1 1 52 52 LYS H H 52 7.629 7.629 7.415 0.214 19668 2137 1 6 . 1 1 53 53 VAL N N 53 119.059 119.059 118.570 0.489 19668 2138 1 6 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.735 0.057 19668 2139 1 6 . 1 1 53 53 VAL C C 53 177.987 177.987 177.963 0.024 19668 2140 1 6 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.670 0.361 19668 2141 1 6 . 1 1 53 53 VAL CB C 53 31.371 31.371 30.986 0.385 19668 2142 1 6 . 1 1 53 53 VAL H H 53 7.638 7.638 7.682 -0.044 19668 2143 1 6 . 1 1 54 54 GLU N N 54 120.388 120.388 120.186 0.202 19668 2144 1 6 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.907 -0.063 19668 2145 1 6 . 1 1 54 54 GLU C C 54 179.624 179.624 179.145 0.479 19668 2146 1 6 . 1 1 54 54 GLU CA C 54 60.241 60.241 60.120 0.121 19668 2147 1 6 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.278 0.540 19668 2148 1 6 . 1 1 54 54 GLU H H 54 8.603 8.603 7.640 0.963 19668 2149 1 6 . 1 1 55 55 GLU N N 55 118.533 118.533 118.842 -0.309 19668 2150 1 6 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.034 0.055 19668 2151 1 6 . 1 1 55 55 GLU C C 55 179.158 179.158 179.079 0.079 19668 2152 1 6 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.148 0.186 19668 2153 1 6 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.528 -0.191 19668 2154 1 6 . 1 1 55 55 GLU H H 55 7.904 7.904 7.613 0.291 19668 2155 1 6 . 1 1 56 56 GLU N N 56 120.258 120.258 119.255 1.003 19668 2156 1 6 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.026 0.074 19668 2157 1 6 . 1 1 56 56 GLU C C 56 179.867 179.867 179.208 0.659 19668 2158 1 6 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.303 0.360 19668 2159 1 6 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.498 0.552 19668 2160 1 6 . 1 1 56 56 GLU H H 56 7.902 7.902 7.429 0.473 19668 2161 1 6 . 1 1 57 57 VAL N N 57 121.168 121.168 119.131 2.037 19668 2162 1 6 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.610 -0.042 19668 2163 1 6 . 1 1 57 57 VAL C C 57 176.994 176.994 177.169 -0.175 19668 2164 1 6 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.652 2.244 19668 2165 1 6 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.553 -0.026 19668 2166 1 6 . 1 1 57 57 VAL H H 57 8.613 8.613 7.509 1.104 19668 2167 1 6 . 1 1 58 58 LYS N N 58 120.234 120.234 119.627 0.607 19668 2168 1 6 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.973 0.229 19668 2169 1 6 . 1 1 58 58 LYS C C 58 179.131 179.131 178.691 0.440 19668 2170 1 6 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.540 0.047 19668 2171 1 6 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.567 0.724 19668 2172 1 6 . 1 1 58 58 LYS H H 58 7.810 7.810 7.478 0.332 19668 2173 1 6 . 1 1 59 59 LYS N N 59 118.301 118.301 119.187 -0.886 19668 2174 1 6 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.038 0.055 19668 2175 1 6 . 1 1 59 59 LYS C C 59 179.281 179.281 178.375 0.906 19668 2176 1 6 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.993 0.435 19668 2177 1 6 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.919 0.460 19668 2178 1 6 . 1 1 59 59 LYS H H 59 7.876 7.876 7.400 0.476 19668 2179 1 6 . 1 1 60 60 LEU N N 60 121.224 121.224 120.284 0.940 19668 2180 1 6 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.979 0.255 19668 2181 1 6 . 1 1 60 60 LEU C C 60 178.636 178.636 178.811 -0.175 19668 2182 1 6 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.816 0.341 19668 2183 1 6 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.180 0.454 19668 2184 1 6 . 1 1 60 60 LEU H H 60 7.893 7.893 7.397 0.496 19668 2185 1 6 . 1 1 61 61 GLU N N 61 118.660 118.660 118.021 0.639 19668 2186 1 6 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.072 -0.273 19668 2187 1 6 . 1 1 61 61 GLU C C 61 179.094 179.094 178.747 0.347 19668 2188 1 6 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.965 1.307 19668 2189 1 6 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.637 1.366 19668 2190 1 6 . 1 1 61 61 GLU H H 61 8.644 8.644 7.785 0.859 19668 2191 1 6 . 1 1 62 62 GLU N N 62 117.555 117.555 119.927 -2.372 19668 2192 1 6 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.980 0.016 19668 2193 1 6 . 1 1 62 62 GLU C C 62 178.940 178.940 179.077 -0.137 19668 2194 1 6 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.471 -0.303 19668 2195 1 6 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.316 0.231 19668 2196 1 6 . 1 1 62 62 GLU H H 62 7.995 7.995 7.510 0.485 19668 2197 1 6 . 1 1 63 63 GLU N N 63 119.097 119.097 118.197 0.900 19668 2198 1 6 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.105 -0.076 19668 2199 1 6 . 1 1 63 63 GLU C C 63 179.890 179.890 179.094 0.796 19668 2200 1 6 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.763 0.578 19668 2201 1 6 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.930 0.737 19668 2202 1 6 . 1 1 63 63 GLU H H 63 7.983 7.983 7.733 0.250 19668 2203 1 6 . 1 1 64 64 ILE N N 64 118.247 118.247 117.735 0.512 19668 2204 1 6 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.896 -0.176 19668 2205 1 6 . 1 1 64 64 ILE C C 64 177.858 177.858 177.569 0.289 19668 2206 1 6 . 1 1 64 64 ILE CA C 64 64.496 64.496 63.940 0.557 19668 2207 1 6 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.498 0.483 19668 2208 1 6 . 1 1 64 64 ILE H H 64 8.261 8.261 7.217 1.044 19668 2209 1 6 . 1 1 65 65 LYS N N 65 118.693 118.693 118.269 0.424 19668 2210 1 6 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.184 -0.086 19668 2211 1 6 . 1 1 65 65 LYS C C 65 177.244 177.244 177.668 -0.424 19668 2212 1 6 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.798 0.855 19668 2213 1 6 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.159 0.546 19668 2214 1 6 . 1 1 65 65 LYS H H 65 7.661 7.661 7.631 0.030 19668 2215 1 6 . 1 1 66 66 LYS N N 66 116.933 116.933 117.557 -0.624 19668 2216 1 6 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.168 0.170 19668 2217 1 6 . 1 1 66 66 LYS C C 66 176.011 176.011 177.469 -1.458 19668 2218 1 6 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.711 -1.252 19668 2219 1 6 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.748 0.383 19668 2220 1 6 . 1 1 66 66 LYS H H 66 7.261 7.261 7.565 -0.304 19668 2221 1 7 . 1 1 2 2 SER HA H 2 4.560 4.560 4.201 0.359 19668 2222 1 7 . 1 1 2 2 SER CA C 2 58.366 58.366 58.219 0.147 19668 2223 1 7 . 1 1 3 3 ARG N N 3 125.213 125.213 122.014 3.199 19668 2224 1 7 . 1 1 3 3 ARG HA H 3 4.266 4.266 3.877 0.389 19668 2225 1 7 . 1 1 3 3 ARG C C 3 178.381 178.381 176.370 2.011 19668 2226 1 7 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.634 -0.238 19668 2227 1 7 . 1 1 3 3 ARG CB C 3 30.655 30.655 28.626 2.029 19668 2228 1 7 . 1 1 3 3 ARG H H 3 8.874 8.874 8.584 0.290 19668 2229 1 7 . 1 1 4 4 VAL N N 4 119.320 119.320 119.553 -0.233 19668 2230 1 7 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.784 0.014 19668 2231 1 7 . 1 1 4 4 VAL C C 4 177.004 177.004 177.372 -0.368 19668 2232 1 7 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.376 -0.861 19668 2233 1 7 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.668 0.135 19668 2234 1 7 . 1 1 4 4 VAL H H 4 8.112 8.112 8.554 -0.442 19668 2235 1 7 . 1 1 5 5 LYS N N 5 122.279 122.279 120.772 1.507 19668 2236 1 7 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.889 0.273 19668 2237 1 7 . 1 1 5 5 LYS C C 5 178.547 178.547 178.325 0.222 19668 2238 1 7 . 1 1 5 5 LYS CA C 5 58.758 58.758 59.220 -0.462 19668 2239 1 7 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.413 0.597 19668 2240 1 7 . 1 1 5 5 LYS H H 5 7.847 7.847 8.069 -0.222 19668 2241 1 7 . 1 1 6 6 ALA N N 6 120.295 120.295 120.344 -0.049 19668 2242 1 7 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.089 0.122 19668 2243 1 7 . 1 1 6 6 ALA C C 6 180.834 180.834 179.318 1.516 19668 2244 1 7 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.941 -0.038 19668 2245 1 7 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.857 0.275 19668 2246 1 7 . 1 1 6 6 ALA H H 6 7.975 7.975 8.199 -0.224 19668 2247 1 7 . 1 1 7 7 LEU N N 7 119.570 119.570 118.502 1.068 19668 2248 1 7 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.065 0.107 19668 2249 1 7 . 1 1 7 7 LEU C C 7 178.431 178.431 178.521 -0.090 19668 2250 1 7 . 1 1 7 7 LEU CA C 7 57.679 57.679 58.051 -0.372 19668 2251 1 7 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.064 0.971 19668 2252 1 7 . 1 1 7 7 LEU H H 7 7.650 7.650 7.622 0.028 19668 2253 1 7 . 1 1 8 8 GLU N N 8 119.934 119.934 118.175 1.759 19668 2254 1 7 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.037 -0.178 19668 2255 1 7 . 1 1 8 8 GLU C C 8 179.534 179.534 178.668 0.866 19668 2256 1 7 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.409 0.628 19668 2257 1 7 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.758 0.709 19668 2258 1 7 . 1 1 8 8 GLU H H 8 8.411 8.411 7.801 0.610 19668 2259 1 7 . 1 1 9 9 GLU N N 9 118.234 118.234 119.486 -1.252 19668 2260 1 7 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.080 -0.020 19668 2261 1 7 . 1 1 9 9 GLU C C 9 179.596 179.596 178.777 0.819 19668 2262 1 7 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.186 0.144 19668 2263 1 7 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.460 -0.042 19668 2264 1 7 . 1 1 9 9 GLU H H 9 8.206 8.206 7.684 0.522 19668 2265 1 7 . 1 1 10 10 LYS N N 10 121.042 121.042 118.846 2.196 19668 2266 1 7 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.111 0.072 19668 2267 1 7 . 1 1 10 10 LYS C C 10 179.380 179.380 179.162 0.218 19668 2268 1 7 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.148 0.177 19668 2269 1 7 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.079 0.330 19668 2270 1 7 . 1 1 10 10 LYS H H 10 7.931 7.931 7.549 0.382 19668 2271 1 7 . 1 1 11 11 VAL N N 11 118.662 118.662 120.115 -1.453 19668 2272 1 7 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.813 0.001 19668 2273 1 7 . 1 1 11 11 VAL C C 11 178.845 178.845 178.067 0.778 19668 2274 1 7 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.753 0.235 19668 2275 1 7 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.656 -0.002 19668 2276 1 7 . 1 1 11 11 VAL H H 11 8.371 8.371 7.564 0.807 19668 2277 1 7 . 1 1 12 12 LYS N N 12 123.188 123.188 120.007 3.181 19668 2278 1 7 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.941 0.285 19668 2279 1 7 . 1 1 12 12 LYS C C 12 179.098 179.098 178.207 0.891 19668 2280 1 7 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.327 0.156 19668 2281 1 7 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.337 -0.131 19668 2282 1 7 . 1 1 12 12 LYS H H 12 8.276 8.276 7.525 0.751 19668 2283 1 7 . 1 1 13 13 ALA N N 13 121.169 121.169 121.582 -0.413 19668 2284 1 7 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.065 0.193 19668 2285 1 7 . 1 1 13 13 ALA C C 13 180.169 180.169 179.768 0.401 19668 2286 1 7 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.815 -0.179 19668 2287 1 7 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.191 -0.084 19668 2288 1 7 . 1 1 13 13 ALA H H 13 7.829 7.829 7.476 0.353 19668 2289 1 7 . 1 1 14 14 LEU N N 14 118.104 118.104 118.233 -0.129 19668 2290 1 7 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.015 0.141 19668 2291 1 7 . 1 1 14 14 LEU C C 14 177.614 177.614 177.951 -0.337 19668 2292 1 7 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.088 -0.483 19668 2293 1 7 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.934 0.861 19668 2294 1 7 . 1 1 14 14 LEU H H 14 7.781 7.781 7.413 0.368 19668 2295 1 7 . 1 1 15 15 GLU N N 15 120.632 120.632 119.055 1.577 19668 2296 1 7 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.370 -0.003 19668 2297 1 7 . 1 1 15 15 GLU C C 15 178.243 178.243 178.715 -0.472 19668 2298 1 7 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.535 1.052 19668 2299 1 7 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.871 0.958 19668 2300 1 7 . 1 1 15 15 GLU H H 15 7.873 7.873 7.274 0.599 19668 2301 1 7 . 1 1 16 16 GLU N N 16 115.775 115.775 117.320 -1.545 19668 2302 1 7 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.019 -0.060 19668 2303 1 7 . 1 1 16 16 GLU C C 16 179.006 179.006 178.672 0.334 19668 2304 1 7 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.931 0.161 19668 2305 1 7 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.562 -0.209 19668 2306 1 7 . 1 1 16 16 GLU H H 16 7.926 7.926 7.652 0.274 19668 2307 1 7 . 1 1 17 17 LYS N N 17 118.801 118.801 119.189 -0.388 19668 2308 1 7 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.092 0.002 19668 2309 1 7 . 1 1 17 17 LYS C C 17 178.853 178.853 178.764 0.089 19668 2310 1 7 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.846 -0.375 19668 2311 1 7 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.851 0.511 19668 2312 1 7 . 1 1 17 17 LYS H H 17 7.518 7.518 7.532 -0.014 19668 2313 1 7 . 1 1 18 18 VAL N N 18 118.034 118.034 119.898 -1.864 19668 2314 1 7 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.675 -0.163 19668 2315 1 7 . 1 1 18 18 VAL C C 18 178.362 178.362 178.424 -0.062 19668 2316 1 7 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.886 0.133 19668 2317 1 7 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.608 0.042 19668 2318 1 7 . 1 1 18 18 VAL H H 18 8.048 8.048 7.438 0.610 19668 2319 1 7 . 1 1 19 19 LYS N N 19 118.427 118.427 119.200 -0.773 19668 2320 1 7 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.175 -0.165 19668 2321 1 7 . 1 1 19 19 LYS C C 19 177.706 177.706 177.890 -0.184 19668 2322 1 7 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.681 0.304 19668 2323 1 7 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.777 0.646 19668 2324 1 7 . 1 1 19 19 LYS H H 19 8.008 8.008 7.543 0.465 19668 2325 1 7 . 1 1 20 20 ALA N N 20 119.177 119.177 121.027 -1.850 19668 2326 1 7 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.384 -0.068 19668 2327 1 7 . 1 1 20 20 ALA C C 20 178.269 178.269 178.607 -0.338 19668 2328 1 7 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.529 -0.898 19668 2329 1 7 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.524 0.609 19668 2330 1 7 . 1 1 20 20 ALA H H 20 7.259 7.259 7.591 -0.332 19668 2331 1 7 . 1 1 21 21 LEU N N 21 118.596 118.596 115.036 3.560 19668 2332 1 7 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.206 0.055 19668 2333 1 7 . 1 1 21 21 LEU C C 21 177.732 177.732 177.179 0.553 19668 2334 1 7 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.488 0.169 19668 2335 1 7 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.135 0.998 19668 2336 1 7 . 1 1 21 21 LEU H H 21 7.373 7.373 7.303 0.070 19668 2337 1 7 . 1 1 22 22 GLY N N 22 107.926 107.926 104.933 2.993 19668 2338 1 7 . 1 1 22 22 GLY C C 22 173.362 173.362 172.291 1.071 19668 2339 1 7 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.100 1.097 19668 2340 1 7 . 1 1 22 22 GLY H H 22 8.144 8.144 7.262 0.882 19668 2341 1 7 . 1 1 23 23 GLY N N 23 108.242 108.242 105.902 2.340 19668 2342 1 7 . 1 1 23 23 GLY C C 23 174.110 174.110 173.284 0.826 19668 2343 1 7 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.770 -0.086 19668 2344 1 7 . 1 1 23 23 GLY H H 23 8.157 8.157 8.154 0.003 19668 2345 1 7 . 1 1 24 24 GLY N N 24 106.969 106.969 109.379 -2.410 19668 2346 1 7 . 1 1 24 24 GLY C C 24 175.172 175.172 174.055 1.117 19668 2347 1 7 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.419 -0.980 19668 2348 1 7 . 1 1 24 24 GLY H H 24 8.466 8.466 7.727 0.739 19668 2349 1 7 . 1 1 25 25 GLY N N 25 108.946 108.946 108.306 0.640 19668 2350 1 7 . 1 1 25 25 GLY C C 25 176.321 176.321 175.952 0.369 19668 2351 1 7 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.948 0.151 19668 2352 1 7 . 1 1 25 25 GLY H H 25 8.618 8.618 8.599 0.019 19668 2353 1 7 . 1 1 26 26 ARG N N 26 123.559 123.559 121.017 2.542 19668 2354 1 7 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.282 -0.003 19668 2355 1 7 . 1 1 26 26 ARG C C 26 178.076 178.076 178.775 -0.699 19668 2356 1 7 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.660 -0.745 19668 2357 1 7 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.578 0.332 19668 2358 1 7 . 1 1 26 26 ARG H H 26 8.789 8.789 8.610 0.179 19668 2359 1 7 . 1 1 27 27 ILE N N 27 118.726 118.726 119.830 -1.104 19668 2360 1 7 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.762 0.024 19668 2361 1 7 . 1 1 27 27 ILE C C 27 177.639 177.639 178.003 -0.364 19668 2362 1 7 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.415 -0.790 19668 2363 1 7 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.417 -0.462 19668 2364 1 7 . 1 1 27 27 ILE H H 27 7.762 7.762 7.875 -0.113 19668 2365 1 7 . 1 1 28 28 GLU N N 28 119.843 119.843 119.670 0.173 19668 2366 1 7 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.955 0.058 19668 2367 1 7 . 1 1 28 28 GLU C C 28 179.447 179.447 178.781 0.666 19668 2368 1 7 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.556 0.027 19668 2369 1 7 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.054 0.006 19668 2370 1 7 . 1 1 28 28 GLU H H 28 7.867 7.867 8.808 -0.941 19668 2371 1 7 . 1 1 29 29 GLU N N 29 118.447 118.447 119.610 -1.163 19668 2372 1 7 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.073 0.014 19668 2373 1 7 . 1 1 29 29 GLU C C 29 179.310 179.310 178.793 0.517 19668 2374 1 7 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.502 0.778 19668 2375 1 7 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.310 0.026 19668 2376 1 7 . 1 1 29 29 GLU H H 29 7.755 7.755 7.925 -0.170 19668 2377 1 7 . 1 1 30 30 LEU N N 30 121.135 121.135 121.598 -0.463 19668 2378 1 7 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.000 0.096 19668 2379 1 7 . 1 1 30 30 LEU C C 30 178.928 178.928 178.788 0.140 19668 2380 1 7 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.180 -0.075 19668 2381 1 7 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.086 -0.406 19668 2382 1 7 . 1 1 30 30 LEU H H 30 7.785 7.785 7.612 0.173 19668 2383 1 7 . 1 1 31 31 LYS N N 31 119.130 119.130 117.715 1.415 19668 2384 1 7 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.108 -0.238 19668 2385 1 7 . 1 1 31 31 LYS C C 31 179.104 179.104 178.939 0.165 19668 2386 1 7 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.398 1.318 19668 2387 1 7 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.805 0.451 19668 2388 1 7 . 1 1 31 31 LYS H H 31 8.413 8.413 7.665 0.748 19668 2389 1 7 . 1 1 32 32 LYS N N 32 119.200 119.200 119.766 -0.566 19668 2390 1 7 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.991 0.111 19668 2391 1 7 . 1 1 32 32 LYS C C 32 179.420 179.420 179.050 0.370 19668 2392 1 7 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.485 -0.028 19668 2393 1 7 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.244 0.022 19668 2394 1 7 . 1 1 32 32 LYS H H 32 7.826 7.826 7.542 0.284 19668 2395 1 7 . 1 1 33 33 LYS N N 33 120.322 120.322 119.042 1.280 19668 2396 1 7 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.036 0.127 19668 2397 1 7 . 1 1 33 33 LYS C C 33 179.174 179.174 178.917 0.257 19668 2398 1 7 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.085 -0.337 19668 2399 1 7 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.342 -0.603 19668 2400 1 7 . 1 1 33 33 LYS H H 33 8.003 8.003 7.489 0.514 19668 2401 1 7 . 1 1 34 34 TYR N N 34 120.223 120.223 119.056 1.167 19668 2402 1 7 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.047 0.009 19668 2403 1 7 . 1 1 34 34 TYR C C 34 176.356 176.356 177.711 -1.355 19668 2404 1 7 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.513 -0.458 19668 2405 1 7 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.463 -0.436 19668 2406 1 7 . 1 1 34 34 TYR H H 34 8.614 8.614 7.603 1.011 19668 2407 1 7 . 1 1 35 35 GLU N N 35 118.813 118.813 117.530 1.283 19668 2408 1 7 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.953 -0.228 19668 2409 1 7 . 1 1 35 35 GLU C C 35 179.787 179.787 178.305 1.482 19668 2410 1 7 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.750 -0.311 19668 2411 1 7 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.611 0.516 19668 2412 1 7 . 1 1 35 35 GLU H H 35 8.103 8.103 8.138 -0.035 19668 2413 1 7 . 1 1 36 36 GLU N N 36 119.670 119.670 120.155 -0.485 19668 2414 1 7 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.087 -0.073 19668 2415 1 7 . 1 1 36 36 GLU C C 36 179.295 179.295 178.753 0.542 19668 2416 1 7 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.172 0.091 19668 2417 1 7 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.468 0.101 19668 2418 1 7 . 1 1 36 36 GLU H H 36 8.028 8.028 7.728 0.300 19668 2419 1 7 . 1 1 37 37 LEU N N 37 121.416 121.416 119.132 2.284 19668 2420 1 7 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.895 0.124 19668 2421 1 7 . 1 1 37 37 LEU C C 37 178.277 178.277 178.948 -0.671 19668 2422 1 7 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.633 0.207 19668 2423 1 7 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.706 -0.077 19668 2424 1 7 . 1 1 37 37 LEU H H 37 8.176 8.176 7.427 0.749 19668 2425 1 7 . 1 1 38 38 LYS N N 38 118.998 118.998 118.288 0.710 19668 2426 1 7 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.888 -0.228 19668 2427 1 7 . 1 1 38 38 LYS C C 38 178.923 178.923 178.954 -0.031 19668 2428 1 7 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.780 0.620 19668 2429 1 7 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.175 -0.113 19668 2430 1 7 . 1 1 38 38 LYS H H 38 8.260 8.260 7.641 0.619 19668 2431 1 7 . 1 1 39 39 LYS N N 39 118.070 118.070 119.220 -1.150 19668 2432 1 7 . 1 1 39 39 LYS HA H 39 4.080 4.080 3.997 0.083 19668 2433 1 7 . 1 1 39 39 LYS C C 39 178.687 178.687 178.938 -0.251 19668 2434 1 7 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.452 -0.516 19668 2435 1 7 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.295 -0.146 19668 2436 1 7 . 1 1 39 39 LYS H H 39 7.380 7.380 7.601 -0.221 19668 2437 1 7 . 1 1 40 40 LYS N N 40 118.894 118.894 118.805 0.089 19668 2438 1 7 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.062 -0.003 19668 2439 1 7 . 1 1 40 40 LYS C C 40 179.758 179.758 179.126 0.632 19668 2440 1 7 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.292 -0.230 19668 2441 1 7 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.315 0.073 19668 2442 1 7 . 1 1 40 40 LYS H H 40 7.919 7.919 7.537 0.382 19668 2443 1 7 . 1 1 41 41 ILE N N 41 118.270 118.270 118.884 -0.614 19668 2444 1 7 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.807 -0.110 19668 2445 1 7 . 1 1 41 41 ILE C C 41 178.211 178.211 178.007 0.204 19668 2446 1 7 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.319 0.395 19668 2447 1 7 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.770 0.069 19668 2448 1 7 . 1 1 41 41 ILE H H 41 8.199 8.199 7.522 0.677 19668 2449 1 7 . 1 1 42 42 GLU N N 42 120.117 120.117 119.050 1.067 19668 2450 1 7 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.034 0.057 19668 2451 1 7 . 1 1 42 42 GLU C C 42 178.736 178.736 177.781 0.955 19668 2452 1 7 . 1 1 42 42 GLU CA C 42 58.880 58.880 59.214 -0.334 19668 2453 1 7 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.672 -0.281 19668 2454 1 7 . 1 1 42 42 GLU H H 42 7.738 7.738 7.525 0.213 19668 2455 1 7 . 1 1 43 43 GLU N N 43 117.194 117.194 116.576 0.618 19668 2456 1 7 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.235 0.064 19668 2457 1 7 . 1 1 43 43 GLU C C 43 177.658 177.658 176.784 0.874 19668 2458 1 7 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.888 -0.095 19668 2459 1 7 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.329 -0.396 19668 2460 1 7 . 1 1 43 43 GLU H H 43 7.698 7.698 7.519 0.179 19668 2461 1 7 . 1 1 44 44 LEU N N 44 120.812 120.812 121.947 -1.135 19668 2462 1 7 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.137 0.102 19668 2463 1 7 . 1 1 44 44 LEU C C 44 178.682 178.682 177.808 0.874 19668 2464 1 7 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.605 0.891 19668 2465 1 7 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.284 0.363 19668 2466 1 7 . 1 1 44 44 LEU H H 44 7.593 7.593 7.166 0.427 19668 2467 1 7 . 1 1 45 45 GLY N N 45 108.681 108.681 113.873 -5.192 19668 2468 1 7 . 1 1 45 45 GLY C C 45 174.957 174.957 174.461 0.496 19668 2469 1 7 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.535 0.551 19668 2470 1 7 . 1 1 45 45 GLY H H 45 8.234 8.234 8.653 -0.419 19668 2471 1 7 . 1 1 46 46 GLY N N 46 108.057 108.057 107.592 0.465 19668 2472 1 7 . 1 1 46 46 GLY C C 46 174.777 174.777 174.700 0.077 19668 2473 1 7 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.232 1.132 19668 2474 1 7 . 1 1 46 46 GLY H H 46 8.182 8.182 7.811 0.371 19668 2475 1 7 . 1 1 47 47 GLY N N 47 108.494 108.494 107.496 0.998 19668 2476 1 7 . 1 1 47 47 GLY C C 47 174.572 174.572 173.917 0.655 19668 2477 1 7 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.724 0.430 19668 2478 1 7 . 1 1 47 47 GLY H H 47 8.087 8.087 8.253 -0.166 19668 2479 1 7 . 1 1 48 48 GLY N N 48 108.285 108.285 108.746 -0.461 19668 2480 1 7 . 1 1 48 48 GLY C C 48 174.495 174.495 175.072 -0.577 19668 2481 1 7 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.559 -0.105 19668 2482 1 7 . 1 1 48 48 GLY H H 48 8.323 8.323 7.756 0.567 19668 2483 1 7 . 1 1 49 49 GLU N N 49 121.070 121.070 120.952 0.118 19668 2484 1 7 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.435 -0.018 19668 2485 1 7 . 1 1 49 49 GLU C C 49 177.226 177.226 178.065 -0.839 19668 2486 1 7 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.791 -0.221 19668 2487 1 7 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.918 -0.252 19668 2488 1 7 . 1 1 49 49 GLU H H 49 8.483 8.483 8.345 0.138 19668 2489 1 7 . 1 1 50 50 VAL N N 50 121.794 121.794 116.488 5.306 19668 2490 1 7 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.677 0.104 19668 2491 1 7 . 1 1 50 50 VAL C C 50 176.860 176.860 177.390 -0.530 19668 2492 1 7 . 1 1 50 50 VAL CA C 50 65.080 65.080 66.073 -0.993 19668 2493 1 7 . 1 1 50 50 VAL CB C 50 32.253 32.253 30.925 1.328 19668 2494 1 7 . 1 1 50 50 VAL H H 50 8.068 8.068 8.354 -0.286 19668 2495 1 7 . 1 1 51 51 LYS N N 51 120.593 120.593 118.577 2.016 19668 2496 1 7 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.451 -0.244 19668 2497 1 7 . 1 1 51 51 LYS C C 51 178.667 178.667 179.150 -0.483 19668 2498 1 7 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.628 0.707 19668 2499 1 7 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.663 0.595 19668 2500 1 7 . 1 1 51 51 LYS H H 51 8.253 8.253 8.410 -0.157 19668 2501 1 7 . 1 1 52 52 LYS N N 52 117.572 117.572 119.246 -1.674 19668 2502 1 7 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.099 0.069 19668 2503 1 7 . 1 1 52 52 LYS C C 52 179.248 179.248 178.874 0.374 19668 2504 1 7 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.456 -0.442 19668 2505 1 7 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.090 0.090 19668 2506 1 7 . 1 1 52 52 LYS H H 52 7.629 7.629 7.284 0.345 19668 2507 1 7 . 1 1 53 53 VAL N N 53 119.059 119.059 118.979 0.080 19668 2508 1 7 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.625 0.167 19668 2509 1 7 . 1 1 53 53 VAL C C 53 177.987 177.987 177.676 0.311 19668 2510 1 7 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.533 -0.502 19668 2511 1 7 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.334 0.037 19668 2512 1 7 . 1 1 53 53 VAL H H 53 7.638 7.638 8.007 -0.369 19668 2513 1 7 . 1 1 54 54 GLU N N 54 120.388 120.388 119.391 0.997 19668 2514 1 7 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.893 -0.048 19668 2515 1 7 . 1 1 54 54 GLU C C 54 179.624 179.624 178.861 0.763 19668 2516 1 7 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.918 0.323 19668 2517 1 7 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.191 0.627 19668 2518 1 7 . 1 1 54 54 GLU H H 54 8.603 8.603 7.704 0.899 19668 2519 1 7 . 1 1 55 55 GLU N N 55 118.533 118.533 119.075 -0.542 19668 2520 1 7 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.047 0.042 19668 2521 1 7 . 1 1 55 55 GLU C C 55 179.158 179.158 178.901 0.257 19668 2522 1 7 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.246 0.088 19668 2523 1 7 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.569 -0.232 19668 2524 1 7 . 1 1 55 55 GLU H H 55 7.904 7.904 7.598 0.306 19668 2525 1 7 . 1 1 56 56 GLU N N 56 120.258 120.258 118.827 1.431 19668 2526 1 7 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.003 0.097 19668 2527 1 7 . 1 1 56 56 GLU C C 56 179.867 179.867 179.263 0.604 19668 2528 1 7 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.207 0.456 19668 2529 1 7 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.527 0.523 19668 2530 1 7 . 1 1 56 56 GLU H H 56 7.902 7.902 7.526 0.376 19668 2531 1 7 . 1 1 57 57 VAL N N 57 121.168 121.168 120.192 0.976 19668 2532 1 7 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.559 0.009 19668 2533 1 7 . 1 1 57 57 VAL C C 57 176.994 176.994 177.071 -0.077 19668 2534 1 7 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.670 1.226 19668 2535 1 7 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.871 -0.344 19668 2536 1 7 . 1 1 57 57 VAL H H 57 8.613 8.613 7.550 1.063 19668 2537 1 7 . 1 1 58 58 LYS N N 58 120.234 120.234 118.913 1.321 19668 2538 1 7 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.925 0.277 19668 2539 1 7 . 1 1 58 58 LYS C C 58 179.131 179.131 178.761 0.370 19668 2540 1 7 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.096 0.491 19668 2541 1 7 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.927 0.364 19668 2542 1 7 . 1 1 58 58 LYS H H 58 7.810 7.810 7.447 0.363 19668 2543 1 7 . 1 1 59 59 LYS N N 59 118.301 118.301 117.507 0.794 19668 2544 1 7 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.062 0.031 19668 2545 1 7 . 1 1 59 59 LYS C C 59 179.281 179.281 178.267 1.014 19668 2546 1 7 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.110 0.318 19668 2547 1 7 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.729 0.650 19668 2548 1 7 . 1 1 59 59 LYS H H 59 7.876 7.876 7.438 0.438 19668 2549 1 7 . 1 1 60 60 LEU N N 60 121.224 121.224 121.332 -0.108 19668 2550 1 7 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.990 0.244 19668 2551 1 7 . 1 1 60 60 LEU C C 60 178.636 178.636 178.863 -0.227 19668 2552 1 7 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.778 0.379 19668 2553 1 7 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.196 0.438 19668 2554 1 7 . 1 1 60 60 LEU H H 60 7.893 7.893 7.718 0.175 19668 2555 1 7 . 1 1 61 61 GLU N N 61 118.660 118.660 117.892 0.768 19668 2556 1 7 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.074 -0.275 19668 2557 1 7 . 1 1 61 61 GLU C C 61 179.094 179.094 178.755 0.339 19668 2558 1 7 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.972 1.300 19668 2559 1 7 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.510 1.493 19668 2560 1 7 . 1 1 61 61 GLU H H 61 8.644 8.644 7.810 0.834 19668 2561 1 7 . 1 1 62 62 GLU N N 62 117.555 117.555 119.574 -2.019 19668 2562 1 7 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.036 -0.040 19668 2563 1 7 . 1 1 62 62 GLU C C 62 178.940 178.940 179.163 -0.223 19668 2564 1 7 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.124 0.044 19668 2565 1 7 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.118 0.429 19668 2566 1 7 . 1 1 62 62 GLU H H 62 7.995 7.995 7.568 0.427 19668 2567 1 7 . 1 1 63 63 GLU N N 63 119.097 119.097 118.297 0.800 19668 2568 1 7 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.140 -0.111 19668 2569 1 7 . 1 1 63 63 GLU C C 63 179.890 179.890 178.993 0.897 19668 2570 1 7 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.687 0.654 19668 2571 1 7 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.120 0.547 19668 2572 1 7 . 1 1 63 63 GLU H H 63 7.983 7.983 7.628 0.355 19668 2573 1 7 . 1 1 64 64 ILE N N 64 118.247 118.247 120.057 -1.810 19668 2574 1 7 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.746 -0.026 19668 2575 1 7 . 1 1 64 64 ILE C C 64 177.858 177.858 178.797 -0.939 19668 2576 1 7 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.654 -0.158 19668 2577 1 7 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.621 0.360 19668 2578 1 7 . 1 1 64 64 ILE H H 64 8.261 8.261 7.318 0.943 19668 2579 1 7 . 1 1 65 65 LYS N N 65 118.693 118.693 119.964 -1.271 19668 2580 1 7 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.095 0.003 19668 2581 1 7 . 1 1 65 65 LYS C C 65 177.244 177.244 178.130 -0.886 19668 2582 1 7 . 1 1 65 65 LYS CA C 65 58.653 58.653 59.028 -0.375 19668 2583 1 7 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.289 0.416 19668 2584 1 7 . 1 1 65 65 LYS H H 65 7.661 7.661 7.682 -0.021 19668 2585 1 7 . 1 1 66 66 LYS N N 66 116.933 116.933 116.525 0.408 19668 2586 1 7 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.121 0.217 19668 2587 1 7 . 1 1 66 66 LYS C C 66 176.011 176.011 177.033 -1.022 19668 2588 1 7 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.620 -1.161 19668 2589 1 7 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.920 0.211 19668 2590 1 7 . 1 1 66 66 LYS H H 66 7.261 7.261 7.590 -0.329 19668 2591 1 8 . 1 1 2 2 SER HA H 2 4.560 4.560 4.040 0.520 19668 2592 1 8 . 1 1 2 2 SER CA C 2 58.366 58.366 60.867 -2.501 19668 2593 1 8 . 1 1 3 3 ARG N N 3 125.213 125.213 120.985 4.228 19668 2594 1 8 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.253 0.013 19668 2595 1 8 . 1 1 3 3 ARG C C 3 178.381 178.381 178.222 0.159 19668 2596 1 8 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.641 -0.245 19668 2597 1 8 . 1 1 3 3 ARG CB C 3 30.655 30.655 30.008 0.647 19668 2598 1 8 . 1 1 3 3 ARG H H 3 8.874 8.874 8.306 0.568 19668 2599 1 8 . 1 1 4 4 VAL N N 4 119.320 119.320 121.010 -1.690 19668 2600 1 8 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.743 0.055 19668 2601 1 8 . 1 1 4 4 VAL C C 4 177.004 177.004 177.777 -0.773 19668 2602 1 8 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.750 -0.235 19668 2603 1 8 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.425 0.378 19668 2604 1 8 . 1 1 4 4 VAL H H 4 8.112 8.112 7.534 0.578 19668 2605 1 8 . 1 1 5 5 LYS N N 5 122.279 122.279 120.950 1.329 19668 2606 1 8 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.062 0.100 19668 2607 1 8 . 1 1 5 5 LYS C C 5 178.547 178.547 178.276 0.271 19668 2608 1 8 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.830 -0.072 19668 2609 1 8 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.752 0.258 19668 2610 1 8 . 1 1 5 5 LYS H H 5 7.847 7.847 8.281 -0.434 19668 2611 1 8 . 1 1 6 6 ALA N N 6 120.295 120.295 121.878 -1.583 19668 2612 1 8 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.316 -0.105 19668 2613 1 8 . 1 1 6 6 ALA C C 6 180.834 180.834 179.539 1.295 19668 2614 1 8 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.723 0.180 19668 2615 1 8 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.163 -0.031 19668 2616 1 8 . 1 1 6 6 ALA H H 6 7.975 7.975 7.540 0.435 19668 2617 1 8 . 1 1 7 7 LEU N N 7 119.570 119.570 118.296 1.274 19668 2618 1 8 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.066 0.106 19668 2619 1 8 . 1 1 7 7 LEU C C 7 178.431 178.431 178.552 -0.121 19668 2620 1 8 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.770 -0.091 19668 2621 1 8 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.016 1.019 19668 2622 1 8 . 1 1 7 7 LEU H H 7 7.650 7.650 7.651 -0.001 19668 2623 1 8 . 1 1 8 8 GLU N N 8 119.934 119.934 118.467 1.467 19668 2624 1 8 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.072 -0.213 19668 2625 1 8 . 1 1 8 8 GLU C C 8 179.534 179.534 178.378 1.156 19668 2626 1 8 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.342 0.695 19668 2627 1 8 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.737 0.730 19668 2628 1 8 . 1 1 8 8 GLU H H 8 8.411 8.411 7.925 0.486 19668 2629 1 8 . 1 1 9 9 GLU N N 9 118.234 118.234 119.435 -1.201 19668 2630 1 8 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.041 0.019 19668 2631 1 8 . 1 1 9 9 GLU C C 9 179.596 179.596 179.004 0.592 19668 2632 1 8 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.188 0.142 19668 2633 1 8 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.353 0.065 19668 2634 1 8 . 1 1 9 9 GLU H H 9 8.206 8.206 7.674 0.532 19668 2635 1 8 . 1 1 10 10 LYS N N 10 121.042 121.042 119.304 1.738 19668 2636 1 8 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.123 0.060 19668 2637 1 8 . 1 1 10 10 LYS C C 10 179.380 179.380 179.029 0.351 19668 2638 1 8 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.081 0.244 19668 2639 1 8 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.187 0.222 19668 2640 1 8 . 1 1 10 10 LYS H H 10 7.931 7.931 7.557 0.374 19668 2641 1 8 . 1 1 11 11 VAL N N 11 118.662 118.662 120.648 -1.986 19668 2642 1 8 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.840 -0.026 19668 2643 1 8 . 1 1 11 11 VAL C C 11 178.845 178.845 178.212 0.633 19668 2644 1 8 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.885 0.103 19668 2645 1 8 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.715 -0.061 19668 2646 1 8 . 1 1 11 11 VAL H H 11 8.371 8.371 7.588 0.783 19668 2647 1 8 . 1 1 12 12 LYS N N 12 123.188 123.188 119.635 3.553 19668 2648 1 8 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.949 0.277 19668 2649 1 8 . 1 1 12 12 LYS C C 12 179.098 179.098 178.289 0.809 19668 2650 1 8 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.333 0.150 19668 2651 1 8 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.406 -0.200 19668 2652 1 8 . 1 1 12 12 LYS H H 12 8.276 8.276 7.527 0.749 19668 2653 1 8 . 1 1 13 13 ALA N N 13 121.169 121.169 121.679 -0.510 19668 2654 1 8 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.044 0.214 19668 2655 1 8 . 1 1 13 13 ALA C C 13 180.169 180.169 179.450 0.719 19668 2656 1 8 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.859 -0.223 19668 2657 1 8 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.374 -0.267 19668 2658 1 8 . 1 1 13 13 ALA H H 13 7.829 7.829 7.447 0.382 19668 2659 1 8 . 1 1 14 14 LEU N N 14 118.104 118.104 118.362 -0.258 19668 2660 1 8 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.009 0.147 19668 2661 1 8 . 1 1 14 14 LEU C C 14 177.614 177.614 177.800 -0.186 19668 2662 1 8 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.155 -0.550 19668 2663 1 8 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.885 0.910 19668 2664 1 8 . 1 1 14 14 LEU H H 14 7.781 7.781 7.391 0.390 19668 2665 1 8 . 1 1 15 15 GLU N N 15 120.632 120.632 118.899 1.733 19668 2666 1 8 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.347 0.020 19668 2667 1 8 . 1 1 15 15 GLU C C 15 178.243 178.243 178.702 -0.459 19668 2668 1 8 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.525 1.061 19668 2669 1 8 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.925 0.904 19668 2670 1 8 . 1 1 15 15 GLU H H 15 7.873 7.873 7.255 0.618 19668 2671 1 8 . 1 1 16 16 GLU N N 16 115.775 115.775 117.396 -1.621 19668 2672 1 8 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.997 -0.038 19668 2673 1 8 . 1 1 16 16 GLU C C 16 179.006 179.006 178.692 0.314 19668 2674 1 8 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.014 0.078 19668 2675 1 8 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.448 -0.095 19668 2676 1 8 . 1 1 16 16 GLU H H 16 7.926 7.926 7.651 0.276 19668 2677 1 8 . 1 1 17 17 LYS N N 17 118.801 118.801 119.306 -0.505 19668 2678 1 8 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.072 0.022 19668 2679 1 8 . 1 1 17 17 LYS C C 17 178.853 178.853 178.646 0.207 19668 2680 1 8 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.844 -0.373 19668 2681 1 8 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.796 0.566 19668 2682 1 8 . 1 1 17 17 LYS H H 17 7.518 7.518 7.299 0.219 19668 2683 1 8 . 1 1 18 18 VAL N N 18 118.034 118.034 120.238 -2.204 19668 2684 1 8 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.615 -0.103 19668 2685 1 8 . 1 1 18 18 VAL C C 18 178.362 178.362 177.585 0.777 19668 2686 1 8 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.469 -0.450 19668 2687 1 8 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.579 0.070 19668 2688 1 8 . 1 1 18 18 VAL H H 18 8.048 8.048 7.426 0.622 19668 2689 1 8 . 1 1 19 19 LYS N N 19 118.427 118.427 118.215 0.212 19668 2690 1 8 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.063 -0.053 19668 2691 1 8 . 1 1 19 19 LYS C C 19 177.706 177.706 177.509 0.197 19668 2692 1 8 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.600 0.385 19668 2693 1 8 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.855 0.569 19668 2694 1 8 . 1 1 19 19 LYS H H 19 8.008 8.008 7.412 0.596 19668 2695 1 8 . 1 1 20 20 ALA N N 20 119.177 119.177 120.630 -1.453 19668 2696 1 8 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.288 0.028 19668 2697 1 8 . 1 1 20 20 ALA C C 20 178.269 178.269 178.913 -0.644 19668 2698 1 8 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.284 -0.653 19668 2699 1 8 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.097 0.036 19668 2700 1 8 . 1 1 20 20 ALA H H 20 7.259 7.259 7.412 -0.153 19668 2701 1 8 . 1 1 21 21 LEU N N 21 118.596 118.596 115.878 2.718 19668 2702 1 8 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.206 0.055 19668 2703 1 8 . 1 1 21 21 LEU C C 21 177.732 177.732 177.440 0.292 19668 2704 1 8 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.254 -0.597 19668 2705 1 8 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.326 0.807 19668 2706 1 8 . 1 1 21 21 LEU H H 21 7.373 7.373 7.202 0.171 19668 2707 1 8 . 1 1 22 22 GLY N N 22 107.926 107.926 105.487 2.439 19668 2708 1 8 . 1 1 22 22 GLY C C 22 173.362 173.362 172.583 0.779 19668 2709 1 8 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.217 -0.020 19668 2710 1 8 . 1 1 22 22 GLY H H 22 8.144 8.144 7.485 0.659 19668 2711 1 8 . 1 1 23 23 GLY N N 23 108.242 108.242 105.863 2.379 19668 2712 1 8 . 1 1 23 23 GLY C C 23 174.110 174.110 172.760 1.350 19668 2713 1 8 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.263 -0.579 19668 2714 1 8 . 1 1 23 23 GLY H H 23 8.157 8.157 7.896 0.261 19668 2715 1 8 . 1 1 24 24 GLY N N 24 106.969 106.969 109.443 -2.474 19668 2716 1 8 . 1 1 24 24 GLY C C 24 175.172 175.172 174.630 0.542 19668 2717 1 8 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.243 -0.804 19668 2718 1 8 . 1 1 24 24 GLY H H 24 8.466 8.466 7.843 0.623 19668 2719 1 8 . 1 1 25 25 GLY N N 25 108.946 108.946 114.193 -5.247 19668 2720 1 8 . 1 1 25 25 GLY C C 25 176.321 176.321 175.089 1.232 19668 2721 1 8 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.134 0.965 19668 2722 1 8 . 1 1 25 25 GLY H H 25 8.618 8.618 8.089 0.529 19668 2723 1 8 . 1 1 26 26 ARG N N 26 123.559 123.559 123.482 0.077 19668 2724 1 8 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.328 -0.049 19668 2725 1 8 . 1 1 26 26 ARG C C 26 178.076 178.076 178.478 -0.402 19668 2726 1 8 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.087 -1.173 19668 2727 1 8 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.367 -0.457 19668 2728 1 8 . 1 1 26 26 ARG H H 26 8.789 8.789 7.994 0.795 19668 2729 1 8 . 1 1 27 27 ILE N N 27 118.726 118.726 117.469 1.257 19668 2730 1 8 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.907 -0.121 19668 2731 1 8 . 1 1 27 27 ILE C C 27 177.639 177.639 177.969 -0.330 19668 2732 1 8 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.575 0.049 19668 2733 1 8 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.457 0.498 19668 2734 1 8 . 1 1 27 27 ILE H H 27 7.762 7.762 8.093 -0.331 19668 2735 1 8 . 1 1 28 28 GLU N N 28 119.843 119.843 119.232 0.611 19668 2736 1 8 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.983 0.030 19668 2737 1 8 . 1 1 28 28 GLU C C 28 179.447 179.447 178.961 0.486 19668 2738 1 8 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.847 -0.264 19668 2739 1 8 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.279 -0.218 19668 2740 1 8 . 1 1 28 28 GLU H H 28 7.867 7.867 8.586 -0.719 19668 2741 1 8 . 1 1 29 29 GLU N N 29 118.447 118.447 119.277 -0.830 19668 2742 1 8 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.079 0.008 19668 2743 1 8 . 1 1 29 29 GLU C C 29 179.310 179.310 178.922 0.388 19668 2744 1 8 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.838 0.442 19668 2745 1 8 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.293 0.043 19668 2746 1 8 . 1 1 29 29 GLU H H 29 7.755 7.755 8.345 -0.590 19668 2747 1 8 . 1 1 30 30 LEU N N 30 121.135 121.135 121.527 -0.392 19668 2748 1 8 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.003 0.093 19668 2749 1 8 . 1 1 30 30 LEU C C 30 178.928 178.928 178.750 0.178 19668 2750 1 8 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.210 -0.105 19668 2751 1 8 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.144 -0.464 19668 2752 1 8 . 1 1 30 30 LEU H H 30 7.785 7.785 7.624 0.161 19668 2753 1 8 . 1 1 31 31 LYS N N 31 119.130 119.130 117.823 1.307 19668 2754 1 8 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.079 -0.209 19668 2755 1 8 . 1 1 31 31 LYS C C 31 179.104 179.104 178.985 0.119 19668 2756 1 8 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.486 1.230 19668 2757 1 8 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.837 0.419 19668 2758 1 8 . 1 1 31 31 LYS H H 31 8.413 8.413 7.638 0.775 19668 2759 1 8 . 1 1 32 32 LYS N N 32 119.200 119.200 119.816 -0.616 19668 2760 1 8 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.985 0.117 19668 2761 1 8 . 1 1 32 32 LYS C C 32 179.420 179.420 179.042 0.378 19668 2762 1 8 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.601 -0.144 19668 2763 1 8 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.216 0.050 19668 2764 1 8 . 1 1 32 32 LYS H H 32 7.826 7.826 7.569 0.257 19668 2765 1 8 . 1 1 33 33 LYS N N 33 120.322 120.322 119.326 0.996 19668 2766 1 8 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.049 0.114 19668 2767 1 8 . 1 1 33 33 LYS C C 33 179.174 179.174 178.739 0.435 19668 2768 1 8 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.075 -0.327 19668 2769 1 8 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.312 -0.573 19668 2770 1 8 . 1 1 33 33 LYS H H 33 8.003 8.003 7.481 0.522 19668 2771 1 8 . 1 1 34 34 TYR N N 34 120.223 120.223 119.566 0.657 19668 2772 1 8 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.095 -0.039 19668 2773 1 8 . 1 1 34 34 TYR C C 34 176.356 176.356 177.967 -1.611 19668 2774 1 8 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.617 -0.562 19668 2775 1 8 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.376 -0.349 19668 2776 1 8 . 1 1 34 34 TYR H H 34 8.614 8.614 7.564 1.050 19668 2777 1 8 . 1 1 35 35 GLU N N 35 118.813 118.813 117.269 1.544 19668 2778 1 8 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.925 -0.200 19668 2779 1 8 . 1 1 35 35 GLU C C 35 179.787 179.787 178.722 1.065 19668 2780 1 8 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.091 -0.652 19668 2781 1 8 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.001 0.127 19668 2782 1 8 . 1 1 35 35 GLU H H 35 8.103 8.103 7.853 0.250 19668 2783 1 8 . 1 1 36 36 GLU N N 36 119.670 119.670 119.438 0.232 19668 2784 1 8 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.081 -0.067 19668 2785 1 8 . 1 1 36 36 GLU C C 36 179.295 179.295 179.064 0.231 19668 2786 1 8 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.114 0.150 19668 2787 1 8 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.557 0.012 19668 2788 1 8 . 1 1 36 36 GLU H H 36 8.028 8.028 7.644 0.384 19668 2789 1 8 . 1 1 37 37 LEU N N 37 121.416 121.416 119.648 1.768 19668 2790 1 8 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.014 0.005 19668 2791 1 8 . 1 1 37 37 LEU C C 37 178.277 178.277 179.062 -0.785 19668 2792 1 8 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.021 -0.181 19668 2793 1 8 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.414 0.214 19668 2794 1 8 . 1 1 37 37 LEU H H 37 8.176 8.176 7.414 0.762 19668 2795 1 8 . 1 1 38 38 LYS N N 38 118.998 118.998 117.977 1.021 19668 2796 1 8 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.911 -0.251 19668 2797 1 8 . 1 1 38 38 LYS C C 38 178.923 178.923 179.031 -0.108 19668 2798 1 8 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.094 0.306 19668 2799 1 8 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.005 0.057 19668 2800 1 8 . 1 1 38 38 LYS H H 38 8.260 8.260 7.643 0.617 19668 2801 1 8 . 1 1 39 39 LYS N N 39 118.070 118.070 117.718 0.352 19668 2802 1 8 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.051 0.029 19668 2803 1 8 . 1 1 39 39 LYS C C 39 178.687 178.687 178.939 -0.252 19668 2804 1 8 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.587 -0.651 19668 2805 1 8 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.252 -0.103 19668 2806 1 8 . 1 1 39 39 LYS H H 39 7.380 7.380 7.751 -0.371 19668 2807 1 8 . 1 1 40 40 LYS N N 40 118.894 118.894 120.148 -1.254 19668 2808 1 8 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.064 -0.005 19668 2809 1 8 . 1 1 40 40 LYS C C 40 179.758 179.758 179.071 0.687 19668 2810 1 8 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.197 -0.135 19668 2811 1 8 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.209 0.179 19668 2812 1 8 . 1 1 40 40 LYS H H 40 7.919 7.919 7.409 0.510 19668 2813 1 8 . 1 1 41 41 ILE N N 41 118.270 118.270 117.449 0.821 19668 2814 1 8 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.810 -0.113 19668 2815 1 8 . 1 1 41 41 ILE C C 41 178.211 178.211 177.078 1.133 19668 2816 1 8 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.261 0.453 19668 2817 1 8 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.949 -0.110 19668 2818 1 8 . 1 1 41 41 ILE H H 41 8.199 8.199 7.424 0.775 19668 2819 1 8 . 1 1 42 42 GLU N N 42 120.117 120.117 117.420 2.697 19668 2820 1 8 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.057 0.034 19668 2821 1 8 . 1 1 42 42 GLU C C 42 178.736 178.736 177.485 1.251 19668 2822 1 8 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.658 0.222 19668 2823 1 8 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.206 -0.815 19668 2824 1 8 . 1 1 42 42 GLU H H 42 7.738 7.738 7.579 0.159 19668 2825 1 8 . 1 1 43 43 GLU N N 43 117.194 117.194 116.278 0.916 19668 2826 1 8 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.181 0.118 19668 2827 1 8 . 1 1 43 43 GLU C C 43 177.658 177.658 176.923 0.735 19668 2828 1 8 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.200 -0.407 19668 2829 1 8 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.820 0.113 19668 2830 1 8 . 1 1 43 43 GLU H H 43 7.698 7.698 7.571 0.127 19668 2831 1 8 . 1 1 44 44 LEU N N 44 120.812 120.812 121.663 -0.851 19668 2832 1 8 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.233 0.006 19668 2833 1 8 . 1 1 44 44 LEU C C 44 178.682 178.682 176.893 1.789 19668 2834 1 8 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.377 1.119 19668 2835 1 8 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.460 0.187 19668 2836 1 8 . 1 1 44 44 LEU H H 44 7.593 7.593 7.046 0.547 19668 2837 1 8 . 1 1 45 45 GLY N N 45 108.681 108.681 110.544 -1.863 19668 2838 1 8 . 1 1 45 45 GLY C C 45 174.957 174.957 173.690 1.267 19668 2839 1 8 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.383 1.703 19668 2840 1 8 . 1 1 45 45 GLY H H 45 8.234 8.234 8.552 -0.318 19668 2841 1 8 . 1 1 46 46 GLY N N 46 108.057 108.057 108.324 -0.267 19668 2842 1 8 . 1 1 46 46 GLY C C 46 174.777 174.777 173.012 1.765 19668 2843 1 8 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.513 -0.149 19668 2844 1 8 . 1 1 46 46 GLY H H 46 8.182 8.182 7.901 0.281 19668 2845 1 8 . 1 1 47 47 GLY N N 47 108.494 108.494 106.882 1.612 19668 2846 1 8 . 1 1 47 47 GLY C C 47 174.572 174.572 174.989 -0.417 19668 2847 1 8 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.429 0.726 19668 2848 1 8 . 1 1 47 47 GLY H H 47 8.087 8.087 8.243 -0.156 19668 2849 1 8 . 1 1 48 48 GLY N N 48 108.285 108.285 108.595 -0.310 19668 2850 1 8 . 1 1 48 48 GLY C C 48 174.495 174.495 175.166 -0.671 19668 2851 1 8 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.025 -0.571 19668 2852 1 8 . 1 1 48 48 GLY H H 48 8.323 8.323 8.324 -0.001 19668 2853 1 8 . 1 1 49 49 GLU N N 49 121.070 121.070 122.010 -0.940 19668 2854 1 8 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.432 -0.015 19668 2855 1 8 . 1 1 49 49 GLU C C 49 177.226 177.226 178.208 -0.982 19668 2856 1 8 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.644 -0.073 19668 2857 1 8 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.143 -0.477 19668 2858 1 8 . 1 1 49 49 GLU H H 49 8.483 8.483 7.871 0.612 19668 2859 1 8 . 1 1 50 50 VAL N N 50 121.794 121.794 119.579 2.215 19668 2860 1 8 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.633 0.148 19668 2861 1 8 . 1 1 50 50 VAL C C 50 176.860 176.860 177.228 -0.368 19668 2862 1 8 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.888 -0.808 19668 2863 1 8 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.922 0.331 19668 2864 1 8 . 1 1 50 50 VAL H H 50 8.068 8.068 8.443 -0.375 19668 2865 1 8 . 1 1 51 51 LYS N N 51 120.593 120.593 116.693 3.900 19668 2866 1 8 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.426 -0.219 19668 2867 1 8 . 1 1 51 51 LYS C C 51 178.667 178.667 178.763 -0.096 19668 2868 1 8 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.363 -0.028 19668 2869 1 8 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.933 0.325 19668 2870 1 8 . 1 1 51 51 LYS H H 51 8.253 8.253 8.331 -0.078 19668 2871 1 8 . 1 1 52 52 LYS N N 52 117.572 117.572 119.576 -2.004 19668 2872 1 8 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.100 0.068 19668 2873 1 8 . 1 1 52 52 LYS C C 52 179.248 179.248 178.570 0.678 19668 2874 1 8 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.165 -0.151 19668 2875 1 8 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.246 -0.066 19668 2876 1 8 . 1 1 52 52 LYS H H 52 7.629 7.629 7.747 -0.118 19668 2877 1 8 . 1 1 53 53 VAL N N 53 119.059 119.059 119.115 -0.056 19668 2878 1 8 . 1 1 53 53 VAL HA H 53 3.792 3.792 4.043 -0.251 19668 2879 1 8 . 1 1 53 53 VAL C C 53 177.987 177.987 178.384 -0.397 19668 2880 1 8 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.972 1.059 19668 2881 1 8 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.270 0.101 19668 2882 1 8 . 1 1 53 53 VAL H H 53 7.638 7.638 7.480 0.158 19668 2883 1 8 . 1 1 54 54 GLU N N 54 120.388 120.388 119.477 0.911 19668 2884 1 8 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.954 -0.110 19668 2885 1 8 . 1 1 54 54 GLU C C 54 179.624 179.624 178.927 0.697 19668 2886 1 8 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.784 0.457 19668 2887 1 8 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.253 0.565 19668 2888 1 8 . 1 1 54 54 GLU H H 54 8.603 8.603 7.655 0.948 19668 2889 1 8 . 1 1 55 55 GLU N N 55 118.533 118.533 119.147 -0.614 19668 2890 1 8 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.053 0.036 19668 2891 1 8 . 1 1 55 55 GLU C C 55 179.158 179.158 178.670 0.488 19668 2892 1 8 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.390 -0.056 19668 2893 1 8 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.570 -0.233 19668 2894 1 8 . 1 1 55 55 GLU H H 55 7.904 7.904 7.685 0.219 19668 2895 1 8 . 1 1 56 56 GLU N N 56 120.258 120.258 119.169 1.089 19668 2896 1 8 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.004 0.096 19668 2897 1 8 . 1 1 56 56 GLU C C 56 179.867 179.867 178.867 1.000 19668 2898 1 8 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.843 0.820 19668 2899 1 8 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.216 0.834 19668 2900 1 8 . 1 1 56 56 GLU H H 56 7.902 7.902 7.653 0.249 19668 2901 1 8 . 1 1 57 57 VAL N N 57 121.168 121.168 120.567 0.601 19668 2902 1 8 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.478 0.090 19668 2903 1 8 . 1 1 57 57 VAL C C 57 176.994 176.994 177.344 -0.350 19668 2904 1 8 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.431 1.464 19668 2905 1 8 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.631 -0.104 19668 2906 1 8 . 1 1 57 57 VAL H H 57 8.613 8.613 7.445 1.168 19668 2907 1 8 . 1 1 58 58 LYS N N 58 120.234 120.234 118.134 2.100 19668 2908 1 8 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.989 0.213 19668 2909 1 8 . 1 1 58 58 LYS C C 58 179.131 179.131 178.807 0.324 19668 2910 1 8 . 1 1 58 58 LYS CA C 58 59.587 59.587 58.918 0.669 19668 2911 1 8 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.902 0.389 19668 2912 1 8 . 1 1 58 58 LYS H H 58 7.810 7.810 7.606 0.204 19668 2913 1 8 . 1 1 59 59 LYS N N 59 118.301 118.301 118.938 -0.637 19668 2914 1 8 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.028 0.065 19668 2915 1 8 . 1 1 59 59 LYS C C 59 179.281 179.281 178.433 0.848 19668 2916 1 8 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.170 0.258 19668 2917 1 8 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.073 0.306 19668 2918 1 8 . 1 1 59 59 LYS H H 59 7.876 7.876 7.362 0.514 19668 2919 1 8 . 1 1 60 60 LEU N N 60 121.224 121.224 120.204 1.020 19668 2920 1 8 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.014 0.220 19668 2921 1 8 . 1 1 60 60 LEU C C 60 178.636 178.636 178.756 -0.120 19668 2922 1 8 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.839 0.318 19668 2923 1 8 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.332 0.302 19668 2924 1 8 . 1 1 60 60 LEU H H 60 7.893 7.893 7.530 0.362 19668 2925 1 8 . 1 1 61 61 GLU N N 61 118.660 118.660 118.230 0.430 19668 2926 1 8 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.090 -0.291 19668 2927 1 8 . 1 1 61 61 GLU C C 61 179.094 179.094 178.783 0.311 19668 2928 1 8 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.011 1.260 19668 2929 1 8 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.527 1.476 19668 2930 1 8 . 1 1 61 61 GLU H H 61 8.644 8.644 7.827 0.817 19668 2931 1 8 . 1 1 62 62 GLU N N 62 117.555 117.555 119.873 -2.318 19668 2932 1 8 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.998 -0.002 19668 2933 1 8 . 1 1 62 62 GLU C C 62 178.940 178.940 179.049 -0.109 19668 2934 1 8 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.405 -0.237 19668 2935 1 8 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.313 0.234 19668 2936 1 8 . 1 1 62 62 GLU H H 62 7.995 7.995 7.532 0.463 19668 2937 1 8 . 1 1 63 63 GLU N N 63 119.097 119.097 118.250 0.847 19668 2938 1 8 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.140 -0.111 19668 2939 1 8 . 1 1 63 63 GLU C C 63 179.890 179.890 179.057 0.833 19668 2940 1 8 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.864 0.477 19668 2941 1 8 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.123 0.544 19668 2942 1 8 . 1 1 63 63 GLU H H 63 7.983 7.983 7.750 0.233 19668 2943 1 8 . 1 1 64 64 ILE N N 64 118.247 118.247 118.334 -0.087 19668 2944 1 8 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.880 -0.160 19668 2945 1 8 . 1 1 64 64 ILE C C 64 177.858 177.858 177.132 0.726 19668 2946 1 8 . 1 1 64 64 ILE CA C 64 64.496 64.496 63.861 0.635 19668 2947 1 8 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.583 0.398 19668 2948 1 8 . 1 1 64 64 ILE H H 64 8.261 8.261 7.227 1.034 19668 2949 1 8 . 1 1 65 65 LYS N N 65 118.693 118.693 118.043 0.650 19668 2950 1 8 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.175 -0.077 19668 2951 1 8 . 1 1 65 65 LYS C C 65 177.244 177.244 177.796 -0.552 19668 2952 1 8 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.709 0.944 19668 2953 1 8 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.265 0.440 19668 2954 1 8 . 1 1 65 65 LYS H H 65 7.661 7.661 7.459 0.202 19668 2955 1 8 . 1 1 66 66 LYS N N 66 116.933 116.933 117.522 -0.589 19668 2956 1 8 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.123 0.215 19668 2957 1 8 . 1 1 66 66 LYS C C 66 176.011 176.011 177.758 -1.747 19668 2958 1 8 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.764 -1.305 19668 2959 1 8 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.858 0.273 19668 2960 1 8 . 1 1 66 66 LYS H H 66 7.261 7.261 7.568 -0.307 19668 2961 1 9 . 1 1 2 2 SER HA H 2 4.560 4.560 4.366 0.194 19668 2962 1 9 . 1 1 2 2 SER CA C 2 58.366 58.366 58.759 -0.393 19668 2963 1 9 . 1 1 3 3 ARG N N 3 125.213 125.213 122.471 2.742 19668 2964 1 9 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.241 0.025 19668 2965 1 9 . 1 1 3 3 ARG C C 3 178.381 178.381 177.862 0.519 19668 2966 1 9 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.530 -0.134 19668 2967 1 9 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.815 0.840 19668 2968 1 9 . 1 1 3 3 ARG H H 3 8.874 8.874 8.607 0.267 19668 2969 1 9 . 1 1 4 4 VAL N N 4 119.320 119.320 119.936 -0.616 19668 2970 1 9 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.785 0.013 19668 2971 1 9 . 1 1 4 4 VAL C C 4 177.004 177.004 177.756 -0.752 19668 2972 1 9 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.078 -0.563 19668 2973 1 9 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.634 0.169 19668 2974 1 9 . 1 1 4 4 VAL H H 4 8.112 8.112 7.815 0.297 19668 2975 1 9 . 1 1 5 5 LYS N N 5 122.279 122.279 120.327 1.952 19668 2976 1 9 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.030 0.132 19668 2977 1 9 . 1 1 5 5 LYS C C 5 178.547 178.547 178.074 0.473 19668 2978 1 9 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.868 -0.110 19668 2979 1 9 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.685 0.325 19668 2980 1 9 . 1 1 5 5 LYS H H 5 7.847 7.847 8.271 -0.424 19668 2981 1 9 . 1 1 6 6 ALA N N 6 120.295 120.295 121.428 -1.133 19668 2982 1 9 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.041 0.170 19668 2983 1 9 . 1 1 6 6 ALA C C 6 180.834 180.834 179.237 1.597 19668 2984 1 9 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.157 -0.254 19668 2985 1 9 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.110 0.022 19668 2986 1 9 . 1 1 6 6 ALA H H 6 7.975 7.975 7.513 0.462 19668 2987 1 9 . 1 1 7 7 LEU N N 7 119.570 119.570 118.455 1.115 19668 2988 1 9 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.075 0.097 19668 2989 1 9 . 1 1 7 7 LEU C C 7 178.431 178.431 178.561 -0.130 19668 2990 1 9 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.937 -0.258 19668 2991 1 9 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.020 1.016 19668 2992 1 9 . 1 1 7 7 LEU H H 7 7.650 7.650 7.557 0.093 19668 2993 1 9 . 1 1 8 8 GLU N N 8 119.934 119.934 118.405 1.529 19668 2994 1 9 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.061 -0.202 19668 2995 1 9 . 1 1 8 8 GLU C C 8 179.534 179.534 178.509 1.025 19668 2996 1 9 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.369 0.668 19668 2997 1 9 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.743 0.724 19668 2998 1 9 . 1 1 8 8 GLU H H 8 8.411 8.411 7.855 0.556 19668 2999 1 9 . 1 1 9 9 GLU N N 9 118.234 118.234 118.929 -0.695 19668 3000 1 9 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.071 -0.011 19668 3001 1 9 . 1 1 9 9 GLU C C 9 179.596 179.596 178.948 0.648 19668 3002 1 9 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.367 -0.037 19668 3003 1 9 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.300 0.118 19668 3004 1 9 . 1 1 9 9 GLU H H 9 8.206 8.206 7.727 0.479 19668 3005 1 9 . 1 1 10 10 LYS N N 10 121.042 121.042 119.241 1.801 19668 3006 1 9 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.129 0.054 19668 3007 1 9 . 1 1 10 10 LYS C C 10 179.380 179.380 179.027 0.353 19668 3008 1 9 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.097 0.228 19668 3009 1 9 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.082 0.327 19668 3010 1 9 . 1 1 10 10 LYS H H 10 7.931 7.931 7.533 0.398 19668 3011 1 9 . 1 1 11 11 VAL N N 11 118.662 118.662 120.639 -1.977 19668 3012 1 9 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.804 0.010 19668 3013 1 9 . 1 1 11 11 VAL C C 11 178.845 178.845 178.199 0.646 19668 3014 1 9 . 1 1 11 11 VAL CA C 11 66.988 66.988 67.051 -0.063 19668 3015 1 9 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.689 -0.035 19668 3016 1 9 . 1 1 11 11 VAL H H 11 8.371 8.371 7.582 0.789 19668 3017 1 9 . 1 1 12 12 LYS N N 12 123.188 123.188 119.446 3.742 19668 3018 1 9 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.821 0.405 19668 3019 1 9 . 1 1 12 12 LYS C C 12 179.098 179.098 178.245 0.853 19668 3020 1 9 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.645 -0.161 19668 3021 1 9 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.264 -0.058 19668 3022 1 9 . 1 1 12 12 LYS H H 12 8.276 8.276 7.555 0.721 19668 3023 1 9 . 1 1 13 13 ALA N N 13 121.169 121.169 121.868 -0.699 19668 3024 1 9 . 1 1 13 13 ALA HA H 13 4.258 4.258 3.979 0.279 19668 3025 1 9 . 1 1 13 13 ALA C C 13 180.169 180.169 179.325 0.844 19668 3026 1 9 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.958 -0.322 19668 3027 1 9 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.435 -0.328 19668 3028 1 9 . 1 1 13 13 ALA H H 13 7.829 7.829 7.425 0.404 19668 3029 1 9 . 1 1 14 14 LEU N N 14 118.104 118.104 118.298 -0.194 19668 3030 1 9 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.992 0.164 19668 3031 1 9 . 1 1 14 14 LEU C C 14 177.614 177.614 177.876 -0.262 19668 3032 1 9 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.135 -0.530 19668 3033 1 9 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.881 0.914 19668 3034 1 9 . 1 1 14 14 LEU H H 14 7.781 7.781 7.397 0.384 19668 3035 1 9 . 1 1 15 15 GLU N N 15 120.632 120.632 118.910 1.722 19668 3036 1 9 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.386 -0.019 19668 3037 1 9 . 1 1 15 15 GLU C C 15 178.243 178.243 178.666 -0.423 19668 3038 1 9 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.521 1.065 19668 3039 1 9 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.921 0.908 19668 3040 1 9 . 1 1 15 15 GLU H H 15 7.873 7.873 7.224 0.649 19668 3041 1 9 . 1 1 16 16 GLU N N 16 115.775 115.775 116.983 -1.208 19668 3042 1 9 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.027 -0.068 19668 3043 1 9 . 1 1 16 16 GLU C C 16 179.006 179.006 178.702 0.304 19668 3044 1 9 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.113 -0.021 19668 3045 1 9 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.455 -0.102 19668 3046 1 9 . 1 1 16 16 GLU H H 16 7.926 7.926 7.681 0.245 19668 3047 1 9 . 1 1 17 17 LYS N N 17 118.801 118.801 119.440 -0.639 19668 3048 1 9 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.097 -0.003 19668 3049 1 9 . 1 1 17 17 LYS C C 17 178.853 178.853 178.747 0.106 19668 3050 1 9 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.866 -0.395 19668 3051 1 9 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.853 0.509 19668 3052 1 9 . 1 1 17 17 LYS H H 17 7.518 7.518 7.437 0.081 19668 3053 1 9 . 1 1 18 18 VAL N N 18 118.034 118.034 120.660 -2.626 19668 3054 1 9 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.649 -0.137 19668 3055 1 9 . 1 1 18 18 VAL C C 18 178.362 178.362 177.721 0.641 19668 3056 1 9 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.645 -0.626 19668 3057 1 9 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.516 0.133 19668 3058 1 9 . 1 1 18 18 VAL H H 18 8.048 8.048 7.462 0.586 19668 3059 1 9 . 1 1 19 19 LYS N N 19 118.427 118.427 118.535 -0.108 19668 3060 1 9 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.282 -0.272 19668 3061 1 9 . 1 1 19 19 LYS C C 19 177.706 177.706 177.117 0.589 19668 3062 1 9 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.588 0.397 19668 3063 1 9 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.991 0.433 19668 3064 1 9 . 1 1 19 19 LYS H H 19 8.008 8.008 7.413 0.595 19668 3065 1 9 . 1 1 20 20 ALA N N 20 119.177 119.177 121.139 -1.962 19668 3066 1 9 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.181 0.135 19668 3067 1 9 . 1 1 20 20 ALA C C 20 178.269 178.269 179.780 -1.511 19668 3068 1 9 . 1 1 20 20 ALA CA C 20 52.631 52.631 54.197 -1.565 19668 3069 1 9 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.719 0.414 19668 3070 1 9 . 1 1 20 20 ALA H H 20 7.259 7.259 7.412 -0.153 19668 3071 1 9 . 1 1 21 21 LEU N N 21 118.596 118.596 114.511 4.085 19668 3072 1 9 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.230 0.031 19668 3073 1 9 . 1 1 21 21 LEU C C 21 177.732 177.732 177.276 0.456 19668 3074 1 9 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.015 -0.358 19668 3075 1 9 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.450 0.683 19668 3076 1 9 . 1 1 21 21 LEU H H 21 7.373 7.373 7.433 -0.060 19668 3077 1 9 . 1 1 22 22 GLY N N 22 107.926 107.926 104.178 3.748 19668 3078 1 9 . 1 1 22 22 GLY C C 22 173.362 173.362 172.146 1.216 19668 3079 1 9 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.856 0.341 19668 3080 1 9 . 1 1 22 22 GLY H H 22 8.144 8.144 7.311 0.833 19668 3081 1 9 . 1 1 23 23 GLY N N 23 108.242 108.242 105.100 3.142 19668 3082 1 9 . 1 1 23 23 GLY C C 23 174.110 174.110 172.930 1.180 19668 3083 1 9 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.140 -0.456 19668 3084 1 9 . 1 1 23 23 GLY H H 23 8.157 8.157 8.182 -0.025 19668 3085 1 9 . 1 1 24 24 GLY N N 24 106.969 106.969 107.719 -0.750 19668 3086 1 9 . 1 1 24 24 GLY C C 24 175.172 175.172 174.485 0.687 19668 3087 1 9 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.633 -0.194 19668 3088 1 9 . 1 1 24 24 GLY H H 24 8.466 8.466 8.065 0.401 19668 3089 1 9 . 1 1 25 25 GLY N N 25 108.946 108.946 111.558 -2.612 19668 3090 1 9 . 1 1 25 25 GLY C C 25 176.321 176.321 174.885 1.436 19668 3091 1 9 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.553 1.546 19668 3092 1 9 . 1 1 25 25 GLY H H 25 8.618 8.618 7.899 0.719 19668 3093 1 9 . 1 1 26 26 ARG N N 26 123.559 123.559 122.459 1.100 19668 3094 1 9 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.500 -0.221 19668 3095 1 9 . 1 1 26 26 ARG C C 26 178.076 178.076 178.035 0.041 19668 3096 1 9 . 1 1 26 26 ARG CA C 26 57.915 57.915 57.918 -0.003 19668 3097 1 9 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.308 -0.398 19668 3098 1 9 . 1 1 26 26 ARG H H 26 8.789 8.789 8.394 0.395 19668 3099 1 9 . 1 1 27 27 ILE N N 27 118.726 118.726 119.485 -0.759 19668 3100 1 9 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.827 -0.041 19668 3101 1 9 . 1 1 27 27 ILE C C 27 177.639 177.639 177.960 -0.321 19668 3102 1 9 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.717 -1.093 19668 3103 1 9 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.356 -0.401 19668 3104 1 9 . 1 1 27 27 ILE H H 27 7.762 7.762 8.100 -0.338 19668 3105 1 9 . 1 1 28 28 GLU N N 28 119.843 119.843 118.546 1.297 19668 3106 1 9 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.969 0.044 19668 3107 1 9 . 1 1 28 28 GLU C C 28 179.447 179.447 178.849 0.598 19668 3108 1 9 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.300 -0.717 19668 3109 1 9 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.242 -0.182 19668 3110 1 9 . 1 1 28 28 GLU H H 28 7.867 7.867 8.741 -0.874 19668 3111 1 9 . 1 1 29 29 GLU N N 29 118.447 118.447 118.969 -0.522 19668 3112 1 9 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.096 -0.009 19668 3113 1 9 . 1 1 29 29 GLU C C 29 179.310 179.310 178.881 0.429 19668 3114 1 9 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.556 0.724 19668 3115 1 9 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.142 0.194 19668 3116 1 9 . 1 1 29 29 GLU H H 29 7.755 7.755 7.627 0.128 19668 3117 1 9 . 1 1 30 30 LEU N N 30 121.135 121.135 121.552 -0.417 19668 3118 1 9 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.989 0.107 19668 3119 1 9 . 1 1 30 30 LEU C C 30 178.928 178.928 178.737 0.191 19668 3120 1 9 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.286 -0.181 19668 3121 1 9 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.133 -0.453 19668 3122 1 9 . 1 1 30 30 LEU H H 30 7.785 7.785 7.610 0.175 19668 3123 1 9 . 1 1 31 31 LYS N N 31 119.130 119.130 117.678 1.452 19668 3124 1 9 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.088 -0.218 19668 3125 1 9 . 1 1 31 31 LYS C C 31 179.104 179.104 179.020 0.084 19668 3126 1 9 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.458 1.258 19668 3127 1 9 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.834 0.423 19668 3128 1 9 . 1 1 31 31 LYS H H 31 8.413 8.413 7.662 0.751 19668 3129 1 9 . 1 1 32 32 LYS N N 32 119.200 119.200 119.402 -0.202 19668 3130 1 9 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.941 0.161 19668 3131 1 9 . 1 1 32 32 LYS C C 32 179.420 179.420 178.790 0.630 19668 3132 1 9 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.934 -0.477 19668 3133 1 9 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.219 0.047 19668 3134 1 9 . 1 1 32 32 LYS H H 32 7.826 7.826 7.519 0.307 19668 3135 1 9 . 1 1 33 33 LYS N N 33 120.322 120.322 119.052 1.270 19668 3136 1 9 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.046 0.117 19668 3137 1 9 . 1 1 33 33 LYS C C 33 179.174 179.174 178.977 0.197 19668 3138 1 9 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.973 -0.225 19668 3139 1 9 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.298 -0.559 19668 3140 1 9 . 1 1 33 33 LYS H H 33 8.003 8.003 7.499 0.504 19668 3141 1 9 . 1 1 34 34 TYR N N 34 120.223 120.223 119.628 0.595 19668 3142 1 9 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.103 -0.047 19668 3143 1 9 . 1 1 34 34 TYR C C 34 176.356 176.356 177.988 -1.632 19668 3144 1 9 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.529 -0.474 19668 3145 1 9 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.355 -0.328 19668 3146 1 9 . 1 1 34 34 TYR H H 34 8.614 8.614 7.574 1.040 19668 3147 1 9 . 1 1 35 35 GLU N N 35 118.813 118.813 117.098 1.715 19668 3148 1 9 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.934 -0.209 19668 3149 1 9 . 1 1 35 35 GLU C C 35 179.787 179.787 178.890 0.897 19668 3150 1 9 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.945 -0.506 19668 3151 1 9 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.042 0.086 19668 3152 1 9 . 1 1 35 35 GLU H H 35 8.103 8.103 7.956 0.147 19668 3153 1 9 . 1 1 36 36 GLU N N 36 119.670 119.670 119.553 0.117 19668 3154 1 9 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.098 -0.084 19668 3155 1 9 . 1 1 36 36 GLU C C 36 179.295 179.295 179.049 0.246 19668 3156 1 9 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.299 -0.036 19668 3157 1 9 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.313 0.256 19668 3158 1 9 . 1 1 36 36 GLU H H 36 8.028 8.028 7.754 0.274 19668 3159 1 9 . 1 1 37 37 LEU N N 37 121.416 121.416 119.286 2.130 19668 3160 1 9 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.990 0.029 19668 3161 1 9 . 1 1 37 37 LEU C C 37 178.277 178.277 178.804 -0.527 19668 3162 1 9 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.091 -0.251 19668 3163 1 9 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.418 0.211 19668 3164 1 9 . 1 1 37 37 LEU H H 37 8.176 8.176 7.430 0.746 19668 3165 1 9 . 1 1 38 38 LYS N N 38 118.998 118.998 118.130 0.868 19668 3166 1 9 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.946 -0.286 19668 3167 1 9 . 1 1 38 38 LYS C C 38 178.923 178.923 179.224 -0.301 19668 3168 1 9 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.855 0.545 19668 3169 1 9 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.009 0.053 19668 3170 1 9 . 1 1 38 38 LYS H H 38 8.260 8.260 7.654 0.606 19668 3171 1 9 . 1 1 39 39 LYS N N 39 118.070 118.070 119.104 -1.034 19668 3172 1 9 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.046 0.034 19668 3173 1 9 . 1 1 39 39 LYS C C 39 178.687 178.687 178.922 -0.235 19668 3174 1 9 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.365 -0.429 19668 3175 1 9 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.289 -0.140 19668 3176 1 9 . 1 1 39 39 LYS H H 39 7.380 7.380 7.593 -0.213 19668 3177 1 9 . 1 1 40 40 LYS N N 40 118.894 118.894 119.969 -1.075 19668 3178 1 9 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.069 -0.010 19668 3179 1 9 . 1 1 40 40 LYS C C 40 179.758 179.758 179.086 0.672 19668 3180 1 9 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.383 -0.321 19668 3181 1 9 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.364 0.024 19668 3182 1 9 . 1 1 40 40 LYS H H 40 7.919 7.919 7.344 0.575 19668 3183 1 9 . 1 1 41 41 ILE N N 41 118.270 118.270 118.752 -0.482 19668 3184 1 9 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.745 -0.048 19668 3185 1 9 . 1 1 41 41 ILE C C 41 178.211 178.211 177.048 1.163 19668 3186 1 9 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.789 -0.075 19668 3187 1 9 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.720 0.119 19668 3188 1 9 . 1 1 41 41 ILE H H 41 8.199 8.199 7.484 0.715 19668 3189 1 9 . 1 1 42 42 GLU N N 42 120.117 120.117 117.218 2.899 19668 3190 1 9 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.035 0.056 19668 3191 1 9 . 1 1 42 42 GLU C C 42 178.736 178.736 177.533 1.203 19668 3192 1 9 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.774 0.106 19668 3193 1 9 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.013 -0.622 19668 3194 1 9 . 1 1 42 42 GLU H H 42 7.738 7.738 7.563 0.175 19668 3195 1 9 . 1 1 43 43 GLU N N 43 117.194 117.194 117.311 -0.117 19668 3196 1 9 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.161 0.138 19668 3197 1 9 . 1 1 43 43 GLU C C 43 177.658 177.658 177.718 -0.060 19668 3198 1 9 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.048 -0.255 19668 3199 1 9 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.982 -0.049 19668 3200 1 9 . 1 1 43 43 GLU H H 43 7.698 7.698 7.475 0.223 19668 3201 1 9 . 1 1 44 44 LEU N N 44 120.812 120.812 121.719 -0.907 19668 3202 1 9 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.079 0.160 19668 3203 1 9 . 1 1 44 44 LEU C C 44 178.682 178.682 177.443 1.239 19668 3204 1 9 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.474 1.022 19668 3205 1 9 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.125 1.522 19668 3206 1 9 . 1 1 44 44 LEU H H 44 7.593 7.593 7.463 0.130 19668 3207 1 9 . 1 1 45 45 GLY N N 45 108.681 108.681 111.535 -2.854 19668 3208 1 9 . 1 1 45 45 GLY C C 45 174.957 174.957 174.117 0.840 19668 3209 1 9 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.939 0.147 19668 3210 1 9 . 1 1 45 45 GLY H H 45 8.234 8.234 7.907 0.327 19668 3211 1 9 . 1 1 46 46 GLY N N 46 108.057 108.057 109.168 -1.111 19668 3212 1 9 . 1 1 46 46 GLY C C 46 174.777 174.777 174.327 0.450 19668 3213 1 9 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.325 1.038 19668 3214 1 9 . 1 1 46 46 GLY H H 46 8.182 8.182 8.067 0.115 19668 3215 1 9 . 1 1 47 47 GLY N N 47 108.494 108.494 107.287 1.207 19668 3216 1 9 . 1 1 47 47 GLY C C 47 174.572 174.572 173.918 0.654 19668 3217 1 9 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.178 -0.023 19668 3218 1 9 . 1 1 47 47 GLY H H 47 8.087 8.087 8.089 -0.002 19668 3219 1 9 . 1 1 48 48 GLY N N 48 108.285 108.285 110.310 -2.025 19668 3220 1 9 . 1 1 48 48 GLY C C 48 174.495 174.495 174.930 -0.435 19668 3221 1 9 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.403 -0.949 19668 3222 1 9 . 1 1 48 48 GLY H H 48 8.323 8.323 8.155 0.168 19668 3223 1 9 . 1 1 49 49 GLU N N 49 121.070 121.070 122.226 -1.156 19668 3224 1 9 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.427 -0.010 19668 3225 1 9 . 1 1 49 49 GLU C C 49 177.226 177.226 177.613 -0.387 19668 3226 1 9 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.629 -0.058 19668 3227 1 9 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.562 0.104 19668 3228 1 9 . 1 1 49 49 GLU H H 49 8.483 8.483 8.677 -0.194 19668 3229 1 9 . 1 1 50 50 VAL N N 50 121.794 121.794 115.753 6.041 19668 3230 1 9 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.761 0.020 19668 3231 1 9 . 1 1 50 50 VAL C C 50 176.860 176.860 177.441 -0.581 19668 3232 1 9 . 1 1 50 50 VAL CA C 50 65.080 65.080 64.684 0.396 19668 3233 1 9 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.116 1.137 19668 3234 1 9 . 1 1 50 50 VAL H H 50 8.068 8.068 7.930 0.138 19668 3235 1 9 . 1 1 51 51 LYS N N 51 120.593 120.593 118.783 1.810 19668 3236 1 9 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.379 -0.172 19668 3237 1 9 . 1 1 51 51 LYS C C 51 178.667 178.667 179.008 -0.341 19668 3238 1 9 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.880 0.455 19668 3239 1 9 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.927 0.331 19668 3240 1 9 . 1 1 51 51 LYS H H 51 8.253 8.253 7.673 0.580 19668 3241 1 9 . 1 1 52 52 LYS N N 52 117.572 117.572 119.715 -2.143 19668 3242 1 9 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.073 0.095 19668 3243 1 9 . 1 1 52 52 LYS C C 52 179.248 179.248 178.564 0.684 19668 3244 1 9 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.579 -0.565 19668 3245 1 9 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.240 -0.060 19668 3246 1 9 . 1 1 52 52 LYS H H 52 7.629 7.629 7.426 0.203 19668 3247 1 9 . 1 1 53 53 VAL N N 53 119.059 119.059 119.128 -0.069 19668 3248 1 9 . 1 1 53 53 VAL HA H 53 3.792 3.792 4.029 -0.237 19668 3249 1 9 . 1 1 53 53 VAL C C 53 177.987 177.987 178.419 -0.432 19668 3250 1 9 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.888 1.143 19668 3251 1 9 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.214 0.157 19668 3252 1 9 . 1 1 53 53 VAL H H 53 7.638 7.638 7.636 0.002 19668 3253 1 9 . 1 1 54 54 GLU N N 54 120.388 120.388 119.414 0.974 19668 3254 1 9 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.955 -0.111 19668 3255 1 9 . 1 1 54 54 GLU C C 54 179.624 179.624 178.890 0.734 19668 3256 1 9 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.750 0.491 19668 3257 1 9 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.215 0.603 19668 3258 1 9 . 1 1 54 54 GLU H H 54 8.603 8.603 7.676 0.927 19668 3259 1 9 . 1 1 55 55 GLU N N 55 118.533 118.533 119.283 -0.750 19668 3260 1 9 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.036 0.053 19668 3261 1 9 . 1 1 55 55 GLU C C 55 179.158 179.158 178.745 0.413 19668 3262 1 9 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.555 -0.221 19668 3263 1 9 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.753 -0.416 19668 3264 1 9 . 1 1 55 55 GLU H H 55 7.904 7.904 7.676 0.228 19668 3265 1 9 . 1 1 56 56 GLU N N 56 120.258 120.258 118.845 1.413 19668 3266 1 9 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.049 0.051 19668 3267 1 9 . 1 1 56 56 GLU C C 56 179.867 179.867 178.876 0.991 19668 3268 1 9 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.886 0.777 19668 3269 1 9 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.366 0.684 19668 3270 1 9 . 1 1 56 56 GLU H H 56 7.902 7.902 7.628 0.274 19668 3271 1 9 . 1 1 57 57 VAL N N 57 121.168 121.168 121.015 0.153 19668 3272 1 9 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.569 -0.001 19668 3273 1 9 . 1 1 57 57 VAL C C 57 176.994 176.994 176.950 0.044 19668 3274 1 9 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.375 2.521 19668 3275 1 9 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.616 -0.090 19668 3276 1 9 . 1 1 57 57 VAL H H 57 8.613 8.613 7.487 1.126 19668 3277 1 9 . 1 1 58 58 LYS N N 58 120.234 120.234 118.908 1.326 19668 3278 1 9 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.976 0.226 19668 3279 1 9 . 1 1 58 58 LYS C C 58 179.131 179.131 178.222 0.909 19668 3280 1 9 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.627 -0.040 19668 3281 1 9 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.491 0.800 19668 3282 1 9 . 1 1 58 58 LYS H H 58 7.810 7.810 7.568 0.242 19668 3283 1 9 . 1 1 59 59 LYS N N 59 118.301 118.301 118.780 -0.479 19668 3284 1 9 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.042 0.051 19668 3285 1 9 . 1 1 59 59 LYS C C 59 179.281 179.281 178.347 0.934 19668 3286 1 9 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.142 0.286 19668 3287 1 9 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.894 0.485 19668 3288 1 9 . 1 1 59 59 LYS H H 59 7.876 7.876 7.398 0.478 19668 3289 1 9 . 1 1 60 60 LEU N N 60 121.224 121.224 120.287 0.937 19668 3290 1 9 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.000 0.234 19668 3291 1 9 . 1 1 60 60 LEU C C 60 178.636 178.636 178.673 -0.037 19668 3292 1 9 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.818 0.339 19668 3293 1 9 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.282 0.352 19668 3294 1 9 . 1 1 60 60 LEU H H 60 7.893 7.893 7.530 0.363 19668 3295 1 9 . 1 1 61 61 GLU N N 61 118.660 118.660 118.014 0.646 19668 3296 1 9 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.084 -0.285 19668 3297 1 9 . 1 1 61 61 GLU C C 61 179.094 179.094 178.775 0.319 19668 3298 1 9 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.007 1.265 19668 3299 1 9 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.515 1.488 19668 3300 1 9 . 1 1 61 61 GLU H H 61 8.644 8.644 7.802 0.842 19668 3301 1 9 . 1 1 62 62 GLU N N 62 117.555 117.555 119.649 -2.094 19668 3302 1 9 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.024 -0.028 19668 3303 1 9 . 1 1 62 62 GLU C C 62 178.940 178.940 179.068 -0.128 19668 3304 1 9 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.421 -0.253 19668 3305 1 9 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.347 0.200 19668 3306 1 9 . 1 1 62 62 GLU H H 62 7.995 7.995 7.548 0.447 19668 3307 1 9 . 1 1 63 63 GLU N N 63 119.097 119.097 118.296 0.801 19668 3308 1 9 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.138 -0.109 19668 3309 1 9 . 1 1 63 63 GLU C C 63 179.890 179.890 179.035 0.855 19668 3310 1 9 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.768 0.573 19668 3311 1 9 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.081 0.586 19668 3312 1 9 . 1 1 63 63 GLU H H 63 7.983 7.983 7.725 0.258 19668 3313 1 9 . 1 1 64 64 ILE N N 64 118.247 118.247 119.799 -1.552 19668 3314 1 9 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.776 -0.056 19668 3315 1 9 . 1 1 64 64 ILE C C 64 177.858 177.858 178.757 -0.899 19668 3316 1 9 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.591 -0.094 19668 3317 1 9 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.657 0.324 19668 3318 1 9 . 1 1 64 64 ILE H H 64 8.261 8.261 7.228 1.033 19668 3319 1 9 . 1 1 65 65 LYS N N 65 118.693 118.693 120.089 -1.396 19668 3320 1 9 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.151 -0.053 19668 3321 1 9 . 1 1 65 65 LYS C C 65 177.244 177.244 177.623 -0.379 19668 3322 1 9 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.590 0.063 19668 3323 1 9 . 1 1 65 65 LYS CB C 65 32.705 32.705 31.911 0.794 19668 3324 1 9 . 1 1 65 65 LYS H H 65 7.661 7.661 7.732 -0.071 19668 3325 1 9 . 1 1 66 66 LYS N N 66 116.933 116.933 116.142 0.791 19668 3326 1 9 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.110 0.228 19668 3327 1 9 . 1 1 66 66 LYS C C 66 176.011 176.011 176.946 -0.935 19668 3328 1 9 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.596 -1.137 19668 3329 1 9 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.820 0.311 19668 3330 1 9 . 1 1 66 66 LYS H H 66 7.261 7.261 7.563 -0.302 19668 3331 1 10 . 1 1 2 2 SER HA H 2 4.560 4.560 4.457 0.103 19668 3332 1 10 . 1 1 2 2 SER CA C 2 58.366 58.366 59.637 -1.271 19668 3333 1 10 . 1 1 3 3 ARG N N 3 125.213 125.213 121.896 3.317 19668 3334 1 10 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.290 -0.024 19668 3335 1 10 . 1 1 3 3 ARG C C 3 178.381 178.381 178.091 0.290 19668 3336 1 10 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.580 -0.184 19668 3337 1 10 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.342 1.313 19668 3338 1 10 . 1 1 3 3 ARG H H 3 8.874 8.874 8.396 0.478 19668 3339 1 10 . 1 1 4 4 VAL N N 4 119.320 119.320 119.245 0.075 19668 3340 1 10 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.846 -0.048 19668 3341 1 10 . 1 1 4 4 VAL C C 4 177.004 177.004 177.549 -0.545 19668 3342 1 10 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.702 -0.187 19668 3343 1 10 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.244 0.559 19668 3344 1 10 . 1 1 4 4 VAL H H 4 8.112 8.112 8.182 -0.070 19668 3345 1 10 . 1 1 5 5 LYS N N 5 122.279 122.279 120.376 1.903 19668 3346 1 10 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.045 0.117 19668 3347 1 10 . 1 1 5 5 LYS C C 5 178.547 178.547 178.364 0.183 19668 3348 1 10 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.727 0.031 19668 3349 1 10 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.844 0.166 19668 3350 1 10 . 1 1 5 5 LYS H H 5 7.847 7.847 7.527 0.320 19668 3351 1 10 . 1 1 6 6 ALA N N 6 120.295 120.295 121.711 -1.416 19668 3352 1 10 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.039 0.172 19668 3353 1 10 . 1 1 6 6 ALA C C 6 180.834 180.834 179.215 1.619 19668 3354 1 10 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.982 -0.079 19668 3355 1 10 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.177 -0.045 19668 3356 1 10 . 1 1 6 6 ALA H H 6 7.975 7.975 7.610 0.365 19668 3357 1 10 . 1 1 7 7 LEU N N 7 119.570 119.570 118.311 1.259 19668 3358 1 10 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.042 0.130 19668 3359 1 10 . 1 1 7 7 LEU C C 7 178.431 178.431 178.644 -0.213 19668 3360 1 10 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.957 -0.278 19668 3361 1 10 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.222 0.813 19668 3362 1 10 . 1 1 7 7 LEU H H 7 7.650 7.650 7.671 -0.021 19668 3363 1 10 . 1 1 8 8 GLU N N 8 119.934 119.934 118.414 1.520 19668 3364 1 10 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.066 -0.207 19668 3365 1 10 . 1 1 8 8 GLU C C 8 179.534 179.534 178.442 1.092 19668 3366 1 10 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.383 0.654 19668 3367 1 10 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.744 0.723 19668 3368 1 10 . 1 1 8 8 GLU H H 8 8.411 8.411 7.843 0.568 19668 3369 1 10 . 1 1 9 9 GLU N N 9 118.234 118.234 118.896 -0.662 19668 3370 1 10 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.065 -0.005 19668 3371 1 10 . 1 1 9 9 GLU C C 9 179.596 179.596 178.970 0.626 19668 3372 1 10 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.411 -0.081 19668 3373 1 10 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.269 0.149 19668 3374 1 10 . 1 1 9 9 GLU H H 9 8.206 8.206 7.753 0.453 19668 3375 1 10 . 1 1 10 10 LYS N N 10 121.042 121.042 119.374 1.668 19668 3376 1 10 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.132 0.051 19668 3377 1 10 . 1 1 10 10 LYS C C 10 179.380 179.380 179.034 0.346 19668 3378 1 10 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.095 0.230 19668 3379 1 10 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.104 0.305 19668 3380 1 10 . 1 1 10 10 LYS H H 10 7.931 7.931 7.550 0.381 19668 3381 1 10 . 1 1 11 11 VAL N N 11 118.662 118.662 120.596 -1.934 19668 3382 1 10 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.821 -0.007 19668 3383 1 10 . 1 1 11 11 VAL C C 11 178.845 178.845 178.265 0.580 19668 3384 1 10 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.944 0.044 19668 3385 1 10 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.684 -0.030 19668 3386 1 10 . 1 1 11 11 VAL H H 11 8.371 8.371 7.588 0.783 19668 3387 1 10 . 1 1 12 12 LYS N N 12 123.188 123.188 119.552 3.636 19668 3388 1 10 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.933 0.293 19668 3389 1 10 . 1 1 12 12 LYS C C 12 179.098 179.098 178.286 0.812 19668 3390 1 10 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.367 0.116 19668 3391 1 10 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.355 -0.149 19668 3392 1 10 . 1 1 12 12 LYS H H 12 8.276 8.276 7.519 0.757 19668 3393 1 10 . 1 1 13 13 ALA N N 13 121.169 121.169 121.696 -0.527 19668 3394 1 10 . 1 1 13 13 ALA HA H 13 4.258 4.258 3.983 0.275 19668 3395 1 10 . 1 1 13 13 ALA C C 13 180.169 180.169 179.297 0.872 19668 3396 1 10 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.946 -0.310 19668 3397 1 10 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.458 -0.351 19668 3398 1 10 . 1 1 13 13 ALA H H 13 7.829 7.829 7.434 0.395 19668 3399 1 10 . 1 1 14 14 LEU N N 14 118.104 118.104 118.279 -0.175 19668 3400 1 10 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.004 0.152 19668 3401 1 10 . 1 1 14 14 LEU C C 14 177.614 177.614 177.902 -0.288 19668 3402 1 10 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.184 -0.579 19668 3403 1 10 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.900 0.895 19668 3404 1 10 . 1 1 14 14 LEU H H 14 7.781 7.781 7.390 0.391 19668 3405 1 10 . 1 1 15 15 GLU N N 15 120.632 120.632 118.666 1.966 19668 3406 1 10 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.434 -0.067 19668 3407 1 10 . 1 1 15 15 GLU C C 15 178.243 178.243 178.519 -0.276 19668 3408 1 10 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.592 0.994 19668 3409 1 10 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.238 0.591 19668 3410 1 10 . 1 1 15 15 GLU H H 15 7.873 7.873 7.325 0.548 19668 3411 1 10 . 1 1 16 16 GLU N N 16 115.775 115.775 117.047 -1.272 19668 3412 1 10 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.992 -0.033 19668 3413 1 10 . 1 1 16 16 GLU C C 16 179.006 179.006 178.532 0.474 19668 3414 1 10 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.226 -0.134 19668 3415 1 10 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.032 0.321 19668 3416 1 10 . 1 1 16 16 GLU H H 16 7.926 7.926 7.845 0.081 19668 3417 1 10 . 1 1 17 17 LYS N N 17 118.801 118.801 119.040 -0.239 19668 3418 1 10 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.093 0.001 19668 3419 1 10 . 1 1 17 17 LYS C C 17 178.853 178.853 178.192 0.661 19668 3420 1 10 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.911 -0.440 19668 3421 1 10 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.892 0.470 19668 3422 1 10 . 1 1 17 17 LYS H H 17 7.518 7.518 7.561 -0.043 19668 3423 1 10 . 1 1 18 18 VAL N N 18 118.034 118.034 118.614 -0.580 19668 3424 1 10 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.806 -0.294 19668 3425 1 10 . 1 1 18 18 VAL C C 18 178.362 178.362 178.386 -0.024 19668 3426 1 10 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.797 0.222 19668 3427 1 10 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.382 0.267 19668 3428 1 10 . 1 1 18 18 VAL H H 18 8.048 8.048 7.250 0.798 19668 3429 1 10 . 1 1 19 19 LYS N N 19 118.427 118.427 118.633 -0.206 19668 3430 1 10 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.077 -0.067 19668 3431 1 10 . 1 1 19 19 LYS C C 19 177.706 177.706 177.886 -0.180 19668 3432 1 10 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.398 0.587 19668 3433 1 10 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.204 1.220 19668 3434 1 10 . 1 1 19 19 LYS H H 19 8.008 8.008 7.559 0.449 19668 3435 1 10 . 1 1 20 20 ALA N N 20 119.177 119.177 120.052 -0.875 19668 3436 1 10 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.353 -0.037 19668 3437 1 10 . 1 1 20 20 ALA C C 20 178.269 178.269 178.553 -0.284 19668 3438 1 10 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.952 -0.321 19668 3439 1 10 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.591 0.542 19668 3440 1 10 . 1 1 20 20 ALA H H 20 7.259 7.259 7.436 -0.177 19668 3441 1 10 . 1 1 21 21 LEU N N 21 118.596 118.596 117.737 0.859 19668 3442 1 10 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.080 0.181 19668 3443 1 10 . 1 1 21 21 LEU C C 21 177.732 177.732 177.460 0.272 19668 3444 1 10 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.301 -0.644 19668 3445 1 10 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.391 0.742 19668 3446 1 10 . 1 1 21 21 LEU H H 21 7.373 7.373 7.484 -0.111 19668 3447 1 10 . 1 1 22 22 GLY N N 22 107.926 107.926 103.742 4.184 19668 3448 1 10 . 1 1 22 22 GLY C C 22 173.362 173.362 174.286 -0.924 19668 3449 1 10 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.740 0.457 19668 3450 1 10 . 1 1 22 22 GLY H H 22 8.144 8.144 7.399 0.745 19668 3451 1 10 . 1 1 23 23 GLY N N 23 108.242 108.242 109.963 -1.721 19668 3452 1 10 . 1 1 23 23 GLY C C 23 174.110 174.110 174.268 -0.158 19668 3453 1 10 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.385 -0.701 19668 3454 1 10 . 1 1 23 23 GLY H H 23 8.157 8.157 8.094 0.063 19668 3455 1 10 . 1 1 24 24 GLY N N 24 106.969 106.969 109.767 -2.798 19668 3456 1 10 . 1 1 24 24 GLY C C 24 175.172 175.172 174.608 0.564 19668 3457 1 10 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.857 -0.418 19668 3458 1 10 . 1 1 24 24 GLY H H 24 8.466 8.466 8.154 0.312 19668 3459 1 10 . 1 1 25 25 GLY N N 25 108.946 108.946 114.108 -5.162 19668 3460 1 10 . 1 1 25 25 GLY C C 25 176.321 176.321 174.936 1.385 19668 3461 1 10 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.356 1.742 19668 3462 1 10 . 1 1 25 25 GLY H H 25 8.618 8.618 8.007 0.611 19668 3463 1 10 . 1 1 26 26 ARG N N 26 123.559 123.559 123.519 0.040 19668 3464 1 10 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.416 -0.137 19668 3465 1 10 . 1 1 26 26 ARG C C 26 178.076 178.076 178.439 -0.363 19668 3466 1 10 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.323 -0.408 19668 3467 1 10 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.429 -0.519 19668 3468 1 10 . 1 1 26 26 ARG H H 26 8.789 8.789 8.314 0.475 19668 3469 1 10 . 1 1 27 27 ILE N N 27 118.726 118.726 118.272 0.454 19668 3470 1 10 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.818 -0.032 19668 3471 1 10 . 1 1 27 27 ILE C C 27 177.639 177.639 177.952 -0.313 19668 3472 1 10 . 1 1 27 27 ILE CA C 27 63.624 63.624 65.102 -1.478 19668 3473 1 10 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.353 -0.398 19668 3474 1 10 . 1 1 27 27 ILE H H 27 7.762 7.762 8.262 -0.500 19668 3475 1 10 . 1 1 28 28 GLU N N 28 119.843 119.843 118.698 1.145 19668 3476 1 10 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.040 -0.027 19668 3477 1 10 . 1 1 28 28 GLU C C 28 179.447 179.447 179.060 0.387 19668 3478 1 10 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.105 -0.521 19668 3479 1 10 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.094 -0.034 19668 3480 1 10 . 1 1 28 28 GLU H H 28 7.867 7.867 8.734 -0.867 19668 3481 1 10 . 1 1 29 29 GLU N N 29 118.447 118.447 118.986 -0.539 19668 3482 1 10 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.114 -0.027 19668 3483 1 10 . 1 1 29 29 GLU C C 29 179.310 179.310 178.900 0.410 19668 3484 1 10 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.617 0.663 19668 3485 1 10 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.217 0.119 19668 3486 1 10 . 1 1 29 29 GLU H H 29 7.755 7.755 7.662 0.093 19668 3487 1 10 . 1 1 30 30 LEU N N 30 121.135 121.135 121.634 -0.499 19668 3488 1 10 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.983 0.113 19668 3489 1 10 . 1 1 30 30 LEU C C 30 178.928 178.928 178.747 0.181 19668 3490 1 10 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.311 -0.206 19668 3491 1 10 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.165 -0.485 19668 3492 1 10 . 1 1 30 30 LEU H H 30 7.785 7.785 7.637 0.148 19668 3493 1 10 . 1 1 31 31 LYS N N 31 119.130 119.130 117.895 1.235 19668 3494 1 10 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.122 -0.252 19668 3495 1 10 . 1 1 31 31 LYS C C 31 179.104 179.104 178.894 0.210 19668 3496 1 10 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.439 1.277 19668 3497 1 10 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.761 0.495 19668 3498 1 10 . 1 1 31 31 LYS H H 31 8.413 8.413 7.671 0.742 19668 3499 1 10 . 1 1 32 32 LYS N N 32 119.200 119.200 119.723 -0.523 19668 3500 1 10 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.983 0.119 19668 3501 1 10 . 1 1 32 32 LYS C C 32 179.420 179.420 179.174 0.246 19668 3502 1 10 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.392 0.065 19668 3503 1 10 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.248 0.018 19668 3504 1 10 . 1 1 32 32 LYS H H 32 7.826 7.826 7.492 0.334 19668 3505 1 10 . 1 1 33 33 LYS N N 33 120.322 120.322 119.074 1.248 19668 3506 1 10 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.071 0.092 19668 3507 1 10 . 1 1 33 33 LYS C C 33 179.174 179.174 178.966 0.208 19668 3508 1 10 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.404 0.344 19668 3509 1 10 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.139 -0.400 19668 3510 1 10 . 1 1 33 33 LYS H H 33 8.003 8.003 7.501 0.502 19668 3511 1 10 . 1 1 34 34 TYR N N 34 120.223 120.223 119.569 0.654 19668 3512 1 10 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.115 -0.059 19668 3513 1 10 . 1 1 34 34 TYR C C 34 176.356 176.356 178.060 -1.704 19668 3514 1 10 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.682 -0.627 19668 3515 1 10 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.340 -0.313 19668 3516 1 10 . 1 1 34 34 TYR H H 34 8.614 8.614 7.597 1.017 19668 3517 1 10 . 1 1 35 35 GLU N N 35 118.813 118.813 117.620 1.193 19668 3518 1 10 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.944 -0.219 19668 3519 1 10 . 1 1 35 35 GLU C C 35 179.787 179.787 178.766 1.021 19668 3520 1 10 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.930 -0.491 19668 3521 1 10 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.048 0.080 19668 3522 1 10 . 1 1 35 35 GLU H H 35 8.103 8.103 7.945 0.158 19668 3523 1 10 . 1 1 36 36 GLU N N 36 119.670 119.670 119.550 0.120 19668 3524 1 10 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.085 -0.071 19668 3525 1 10 . 1 1 36 36 GLU C C 36 179.295 179.295 179.062 0.233 19668 3526 1 10 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.240 0.023 19668 3527 1 10 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.447 0.122 19668 3528 1 10 . 1 1 36 36 GLU H H 36 8.028 8.028 7.733 0.295 19668 3529 1 10 . 1 1 37 37 LEU N N 37 121.416 121.416 119.729 1.687 19668 3530 1 10 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.994 0.025 19668 3531 1 10 . 1 1 37 37 LEU C C 37 178.277 178.277 179.016 -0.739 19668 3532 1 10 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.902 -0.062 19668 3533 1 10 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.384 0.245 19668 3534 1 10 . 1 1 37 37 LEU H H 37 8.176 8.176 7.331 0.845 19668 3535 1 10 . 1 1 38 38 LYS N N 38 118.998 118.998 117.948 1.050 19668 3536 1 10 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.904 -0.244 19668 3537 1 10 . 1 1 38 38 LYS C C 38 178.923 178.923 178.949 -0.026 19668 3538 1 10 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.110 0.290 19668 3539 1 10 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.073 -0.011 19668 3540 1 10 . 1 1 38 38 LYS H H 38 8.260 8.260 7.616 0.644 19668 3541 1 10 . 1 1 39 39 LYS N N 39 118.070 118.070 117.512 0.558 19668 3542 1 10 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.230 -0.150 19668 3543 1 10 . 1 1 39 39 LYS C C 39 178.687 178.687 178.969 -0.282 19668 3544 1 10 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.336 -0.400 19668 3545 1 10 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.200 -0.051 19668 3546 1 10 . 1 1 39 39 LYS H H 39 7.380 7.380 7.716 -0.336 19668 3547 1 10 . 1 1 40 40 LYS N N 40 118.894 118.894 119.895 -1.001 19668 3548 1 10 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.069 -0.010 19668 3549 1 10 . 1 1 40 40 LYS C C 40 179.758 179.758 179.041 0.717 19668 3550 1 10 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.503 -0.441 19668 3551 1 10 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.234 0.153 19668 3552 1 10 . 1 1 40 40 LYS H H 40 7.919 7.919 7.356 0.564 19668 3553 1 10 . 1 1 41 41 ILE N N 41 118.270 118.270 118.435 -0.165 19668 3554 1 10 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.818 -0.121 19668 3555 1 10 . 1 1 41 41 ILE C C 41 178.211 178.211 178.108 0.103 19668 3556 1 10 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.668 0.046 19668 3557 1 10 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.767 0.072 19668 3558 1 10 . 1 1 41 41 ILE H H 41 8.199 8.199 7.591 0.608 19668 3559 1 10 . 1 1 42 42 GLU N N 42 120.117 120.117 117.971 2.146 19668 3560 1 10 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.069 0.022 19668 3561 1 10 . 1 1 42 42 GLU C C 42 178.736 178.736 177.430 1.306 19668 3562 1 10 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.874 0.006 19668 3563 1 10 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.746 -0.355 19668 3564 1 10 . 1 1 42 42 GLU H H 42 7.738 7.738 7.560 0.178 19668 3565 1 10 . 1 1 43 43 GLU N N 43 117.194 117.194 116.538 0.656 19668 3566 1 10 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.229 0.070 19668 3567 1 10 . 1 1 43 43 GLU C C 43 177.658 177.658 176.495 1.163 19668 3568 1 10 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.608 0.184 19668 3569 1 10 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.366 -0.432 19668 3570 1 10 . 1 1 43 43 GLU H H 43 7.698 7.698 7.548 0.150 19668 3571 1 10 . 1 1 44 44 LEU N N 44 120.812 120.812 120.291 0.521 19668 3572 1 10 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.082 0.157 19668 3573 1 10 . 1 1 44 44 LEU C C 44 178.682 178.682 177.403 1.279 19668 3574 1 10 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.288 1.208 19668 3575 1 10 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.467 0.180 19668 3576 1 10 . 1 1 44 44 LEU H H 44 7.593 7.593 7.130 0.463 19668 3577 1 10 . 1 1 45 45 GLY N N 45 108.681 108.681 109.989 -1.308 19668 3578 1 10 . 1 1 45 45 GLY C C 45 174.957 174.957 173.909 1.048 19668 3579 1 10 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.426 1.660 19668 3580 1 10 . 1 1 45 45 GLY H H 45 8.234 8.234 8.407 -0.173 19668 3581 1 10 . 1 1 46 46 GLY N N 46 108.057 108.057 108.929 -0.872 19668 3582 1 10 . 1 1 46 46 GLY C C 46 174.777 174.777 174.666 0.111 19668 3583 1 10 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.203 1.161 19668 3584 1 10 . 1 1 46 46 GLY H H 46 8.182 8.182 7.931 0.251 19668 3585 1 10 . 1 1 47 47 GLY N N 47 108.494 108.494 107.574 0.920 19668 3586 1 10 . 1 1 47 47 GLY C C 47 174.572 174.572 173.563 1.009 19668 3587 1 10 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.901 0.254 19668 3588 1 10 . 1 1 47 47 GLY H H 47 8.087 8.087 8.275 -0.188 19668 3589 1 10 . 1 1 48 48 GLY N N 48 108.285 108.285 109.084 -0.799 19668 3590 1 10 . 1 1 48 48 GLY C C 48 174.495 174.495 173.547 0.948 19668 3591 1 10 . 1 1 48 48 GLY CA C 48 45.454 45.454 44.910 0.544 19668 3592 1 10 . 1 1 48 48 GLY H H 48 8.323 8.323 8.610 -0.287 19668 3593 1 10 . 1 1 49 49 GLU N N 49 121.070 121.070 119.899 1.171 19668 3594 1 10 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.501 -0.084 19668 3595 1 10 . 1 1 49 49 GLU C C 49 177.226 177.226 178.388 -1.162 19668 3596 1 10 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.117 -0.546 19668 3597 1 10 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.970 -0.304 19668 3598 1 10 . 1 1 49 49 GLU H H 49 8.483 8.483 8.215 0.268 19668 3599 1 10 . 1 1 50 50 VAL N N 50 121.794 121.794 119.875 1.919 19668 3600 1 10 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.820 -0.039 19668 3601 1 10 . 1 1 50 50 VAL C C 50 176.860 176.860 177.349 -0.489 19668 3602 1 10 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.079 0.001 19668 3603 1 10 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.084 1.169 19668 3604 1 10 . 1 1 50 50 VAL H H 50 8.068 8.068 7.946 0.122 19668 3605 1 10 . 1 1 51 51 LYS N N 51 120.593 120.593 119.201 1.392 19668 3606 1 10 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.473 -0.266 19668 3607 1 10 . 1 1 51 51 LYS C C 51 178.667 178.667 178.724 -0.057 19668 3608 1 10 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.291 0.044 19668 3609 1 10 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.548 0.710 19668 3610 1 10 . 1 1 51 51 LYS H H 51 8.253 8.253 8.468 -0.215 19668 3611 1 10 . 1 1 52 52 LYS N N 52 117.572 117.572 119.472 -1.900 19668 3612 1 10 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.092 0.076 19668 3613 1 10 . 1 1 52 52 LYS C C 52 179.248 179.248 178.581 0.667 19668 3614 1 10 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.067 -0.053 19668 3615 1 10 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.086 0.094 19668 3616 1 10 . 1 1 52 52 LYS H H 52 7.629 7.629 7.803 -0.174 19668 3617 1 10 . 1 1 53 53 VAL N N 53 119.059 119.059 118.811 0.248 19668 3618 1 10 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.784 0.008 19668 3619 1 10 . 1 1 53 53 VAL C C 53 177.987 177.987 177.991 -0.004 19668 3620 1 10 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.012 1.019 19668 3621 1 10 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.267 0.103 19668 3622 1 10 . 1 1 53 53 VAL H H 53 7.638 7.638 7.495 0.143 19668 3623 1 10 . 1 1 54 54 GLU N N 54 120.388 120.388 119.429 0.959 19668 3624 1 10 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.931 -0.087 19668 3625 1 10 . 1 1 54 54 GLU C C 54 179.624 179.624 179.096 0.528 19668 3626 1 10 . 1 1 54 54 GLU CA C 54 60.241 60.241 60.011 0.230 19668 3627 1 10 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.170 0.648 19668 3628 1 10 . 1 1 54 54 GLU H H 54 8.603 8.603 7.654 0.949 19668 3629 1 10 . 1 1 55 55 GLU N N 55 118.533 118.533 118.522 0.011 19668 3630 1 10 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.070 0.019 19668 3631 1 10 . 1 1 55 55 GLU C C 55 179.158 179.158 178.956 0.202 19668 3632 1 10 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.273 0.061 19668 3633 1 10 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.376 -0.039 19668 3634 1 10 . 1 1 55 55 GLU H H 55 7.904 7.904 7.589 0.315 19668 3635 1 10 . 1 1 56 56 GLU N N 56 120.258 120.258 119.677 0.581 19668 3636 1 10 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.049 0.051 19668 3637 1 10 . 1 1 56 56 GLU C C 56 179.867 179.867 179.303 0.564 19668 3638 1 10 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.105 0.558 19668 3639 1 10 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.379 0.671 19668 3640 1 10 . 1 1 56 56 GLU H H 56 7.902 7.902 7.433 0.469 19668 3641 1 10 . 1 1 57 57 VAL N N 57 121.168 121.168 120.053 1.115 19668 3642 1 10 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.578 -0.010 19668 3643 1 10 . 1 1 57 57 VAL C C 57 176.994 176.994 177.470 -0.476 19668 3644 1 10 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.712 2.184 19668 3645 1 10 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.435 0.092 19668 3646 1 10 . 1 1 57 57 VAL H H 57 8.613 8.613 7.514 1.099 19668 3647 1 10 . 1 1 58 58 LYS N N 58 120.234 120.234 118.305 1.929 19668 3648 1 10 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.934 0.268 19668 3649 1 10 . 1 1 58 58 LYS C C 58 179.131 179.131 178.863 0.268 19668 3650 1 10 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.594 -0.007 19668 3651 1 10 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.071 0.220 19668 3652 1 10 . 1 1 58 58 LYS H H 58 7.810 7.810 7.471 0.339 19668 3653 1 10 . 1 1 59 59 LYS N N 59 118.301 118.301 118.549 -0.248 19668 3654 1 10 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.026 0.067 19668 3655 1 10 . 1 1 59 59 LYS C C 59 179.281 179.281 178.540 0.741 19668 3656 1 10 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.115 0.313 19668 3657 1 10 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.029 0.350 19668 3658 1 10 . 1 1 59 59 LYS H H 59 7.876 7.876 7.418 0.458 19668 3659 1 10 . 1 1 60 60 LEU N N 60 121.224 121.224 120.157 1.067 19668 3660 1 10 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.992 0.242 19668 3661 1 10 . 1 1 60 60 LEU C C 60 178.636 178.636 178.696 -0.060 19668 3662 1 10 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.796 0.361 19668 3663 1 10 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.344 0.290 19668 3664 1 10 . 1 1 60 60 LEU H H 60 7.893 7.893 7.618 0.275 19668 3665 1 10 . 1 1 61 61 GLU N N 61 118.660 118.660 118.046 0.614 19668 3666 1 10 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.064 -0.265 19668 3667 1 10 . 1 1 61 61 GLU C C 61 179.094 179.094 178.846 0.248 19668 3668 1 10 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.932 1.340 19668 3669 1 10 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.671 1.332 19668 3670 1 10 . 1 1 61 61 GLU H H 61 8.644 8.644 7.838 0.806 19668 3671 1 10 . 1 1 62 62 GLU N N 62 117.555 117.555 119.088 -1.533 19668 3672 1 10 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.008 -0.012 19668 3673 1 10 . 1 1 62 62 GLU C C 62 178.940 178.940 178.913 0.027 19668 3674 1 10 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.660 -0.492 19668 3675 1 10 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.426 0.121 19668 3676 1 10 . 1 1 62 62 GLU H H 62 7.995 7.995 7.632 0.363 19668 3677 1 10 . 1 1 63 63 GLU N N 63 119.097 119.097 118.119 0.978 19668 3678 1 10 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.158 -0.129 19668 3679 1 10 . 1 1 63 63 GLU C C 63 179.890 179.890 178.976 0.914 19668 3680 1 10 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.826 0.515 19668 3681 1 10 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.070 0.597 19668 3682 1 10 . 1 1 63 63 GLU H H 63 7.983 7.983 7.764 0.219 19668 3683 1 10 . 1 1 64 64 ILE N N 64 118.247 118.247 118.593 -0.346 19668 3684 1 10 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.810 -0.090 19668 3685 1 10 . 1 1 64 64 ILE C C 64 177.858 177.858 177.815 0.043 19668 3686 1 10 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.288 0.208 19668 3687 1 10 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.458 0.523 19668 3688 1 10 . 1 1 64 64 ILE H H 64 8.261 8.261 7.220 1.041 19668 3689 1 10 . 1 1 65 65 LYS N N 65 118.693 118.693 118.687 0.006 19668 3690 1 10 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.195 -0.097 19668 3691 1 10 . 1 1 65 65 LYS C C 65 177.244 177.244 177.638 -0.394 19668 3692 1 10 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.549 0.104 19668 3693 1 10 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.180 0.525 19668 3694 1 10 . 1 1 65 65 LYS H H 65 7.661 7.661 7.787 -0.126 19668 3695 1 10 . 1 1 66 66 LYS N N 66 116.933 116.933 117.374 -0.441 19668 3696 1 10 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.143 0.195 19668 3697 1 10 . 1 1 66 66 LYS C C 66 176.011 176.011 176.959 -0.948 19668 3698 1 10 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.951 -1.492 19668 3699 1 10 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.854 0.277 19668 3700 1 10 . 1 1 66 66 LYS H H 66 7.261 7.261 7.612 -0.351 19668 3701 1 11 . 1 1 2 2 SER HA H 2 4.560 4.560 4.419 0.141 19668 3702 1 11 . 1 1 2 2 SER CA C 2 58.366 58.366 58.542 -0.176 19668 3703 1 11 . 1 1 3 3 ARG N N 3 125.213 125.213 122.376 2.837 19668 3704 1 11 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.203 0.063 19668 3705 1 11 . 1 1 3 3 ARG C C 3 178.381 178.381 178.217 0.164 19668 3706 1 11 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.429 -0.033 19668 3707 1 11 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.147 1.508 19668 3708 1 11 . 1 1 3 3 ARG H H 3 8.874 8.874 8.457 0.417 19668 3709 1 11 . 1 1 4 4 VAL N N 4 119.320 119.320 119.962 -0.642 19668 3710 1 11 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.769 0.029 19668 3711 1 11 . 1 1 4 4 VAL C C 4 177.004 177.004 177.726 -0.722 19668 3712 1 11 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.832 -0.317 19668 3713 1 11 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.688 0.115 19668 3714 1 11 . 1 1 4 4 VAL H H 4 8.112 8.112 7.964 0.148 19668 3715 1 11 . 1 1 5 5 LYS N N 5 122.279 122.279 120.497 1.782 19668 3716 1 11 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.956 0.206 19668 3717 1 11 . 1 1 5 5 LYS C C 5 178.547 178.547 178.264 0.283 19668 3718 1 11 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.916 -0.159 19668 3719 1 11 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.604 0.406 19668 3720 1 11 . 1 1 5 5 LYS H H 5 7.847 7.847 8.385 -0.538 19668 3721 1 11 . 1 1 6 6 ALA N N 6 120.295 120.295 122.296 -2.001 19668 3722 1 11 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.088 0.123 19668 3723 1 11 . 1 1 6 6 ALA C C 6 180.834 180.834 179.707 1.127 19668 3724 1 11 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.115 -0.212 19668 3725 1 11 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.874 0.258 19668 3726 1 11 . 1 1 6 6 ALA H H 6 7.975 7.975 7.555 0.420 19668 3727 1 11 . 1 1 7 7 LEU N N 7 119.570 119.570 118.587 0.983 19668 3728 1 11 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.085 0.087 19668 3729 1 11 . 1 1 7 7 LEU C C 7 178.431 178.431 178.646 -0.215 19668 3730 1 11 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.835 -0.156 19668 3731 1 11 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.151 0.884 19668 3732 1 11 . 1 1 7 7 LEU H H 7 7.650 7.650 7.502 0.148 19668 3733 1 11 . 1 1 8 8 GLU N N 8 119.934 119.934 118.349 1.585 19668 3734 1 11 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.069 -0.210 19668 3735 1 11 . 1 1 8 8 GLU C C 8 179.534 179.534 178.633 0.901 19668 3736 1 11 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.282 0.755 19668 3737 1 11 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.808 0.658 19668 3738 1 11 . 1 1 8 8 GLU H H 8 8.411 8.411 7.884 0.527 19668 3739 1 11 . 1 1 9 9 GLU N N 9 118.234 118.234 119.251 -1.017 19668 3740 1 11 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.077 -0.017 19668 3741 1 11 . 1 1 9 9 GLU C C 9 179.596 179.596 178.837 0.759 19668 3742 1 11 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.355 -0.025 19668 3743 1 11 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.465 -0.047 19668 3744 1 11 . 1 1 9 9 GLU H H 9 8.206 8.206 7.693 0.513 19668 3745 1 11 . 1 1 10 10 LYS N N 10 121.042 121.042 118.979 2.063 19668 3746 1 11 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.130 0.053 19668 3747 1 11 . 1 1 10 10 LYS C C 10 179.380 179.380 179.089 0.291 19668 3748 1 11 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.142 0.183 19668 3749 1 11 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.057 0.352 19668 3750 1 11 . 1 1 10 10 LYS H H 10 7.931 7.931 7.560 0.371 19668 3751 1 11 . 1 1 11 11 VAL N N 11 118.662 118.662 120.199 -1.537 19668 3752 1 11 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.837 -0.023 19668 3753 1 11 . 1 1 11 11 VAL C C 11 178.845 178.845 178.113 0.732 19668 3754 1 11 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.635 0.353 19668 3755 1 11 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.618 0.036 19668 3756 1 11 . 1 1 11 11 VAL H H 11 8.371 8.371 7.526 0.845 19668 3757 1 11 . 1 1 12 12 LYS N N 12 123.188 123.188 119.946 3.242 19668 3758 1 11 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.960 0.266 19668 3759 1 11 . 1 1 12 12 LYS C C 12 179.098 179.098 178.209 0.889 19668 3760 1 11 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.330 0.153 19668 3761 1 11 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.362 -0.156 19668 3762 1 11 . 1 1 12 12 LYS H H 12 8.276 8.276 7.534 0.742 19668 3763 1 11 . 1 1 13 13 ALA N N 13 121.169 121.169 121.672 -0.503 19668 3764 1 11 . 1 1 13 13 ALA HA H 13 4.258 4.258 3.989 0.269 19668 3765 1 11 . 1 1 13 13 ALA C C 13 180.169 180.169 179.279 0.890 19668 3766 1 11 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.958 -0.321 19668 3767 1 11 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.418 -0.311 19668 3768 1 11 . 1 1 13 13 ALA H H 13 7.829 7.829 7.445 0.384 19668 3769 1 11 . 1 1 14 14 LEU N N 14 118.104 118.104 118.219 -0.115 19668 3770 1 11 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.008 0.148 19668 3771 1 11 . 1 1 14 14 LEU C C 14 177.614 177.614 177.829 -0.215 19668 3772 1 11 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.087 -0.482 19668 3773 1 11 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.915 0.880 19668 3774 1 11 . 1 1 14 14 LEU H H 14 7.781 7.781 7.415 0.366 19668 3775 1 11 . 1 1 15 15 GLU N N 15 120.632 120.632 119.020 1.612 19668 3776 1 11 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.363 0.004 19668 3777 1 11 . 1 1 15 15 GLU C C 15 178.243 178.243 178.644 -0.401 19668 3778 1 11 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.506 1.080 19668 3779 1 11 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.935 0.894 19668 3780 1 11 . 1 1 15 15 GLU H H 15 7.873 7.873 7.263 0.610 19668 3781 1 11 . 1 1 16 16 GLU N N 16 115.775 115.775 116.973 -1.198 19668 3782 1 11 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.025 -0.066 19668 3783 1 11 . 1 1 16 16 GLU C C 16 179.006 179.006 178.694 0.312 19668 3784 1 11 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.068 0.024 19668 3785 1 11 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.433 -0.080 19668 3786 1 11 . 1 1 16 16 GLU H H 16 7.926 7.926 7.687 0.239 19668 3787 1 11 . 1 1 17 17 LYS N N 17 118.801 118.801 119.405 -0.604 19668 3788 1 11 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.091 0.003 19668 3789 1 11 . 1 1 17 17 LYS C C 17 178.853 178.853 178.747 0.106 19668 3790 1 11 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.835 -0.364 19668 3791 1 11 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.858 0.503 19668 3792 1 11 . 1 1 17 17 LYS H H 17 7.518 7.518 7.453 0.065 19668 3793 1 11 . 1 1 18 18 VAL N N 18 118.034 118.034 120.115 -2.081 19668 3794 1 11 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.685 -0.173 19668 3795 1 11 . 1 1 18 18 VAL C C 18 178.362 178.362 177.973 0.389 19668 3796 1 11 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.120 -0.101 19668 3797 1 11 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.600 0.049 19668 3798 1 11 . 1 1 18 18 VAL H H 18 8.048 8.048 7.437 0.611 19668 3799 1 11 . 1 1 19 19 LYS N N 19 118.427 118.427 118.019 0.408 19668 3800 1 11 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.049 -0.039 19668 3801 1 11 . 1 1 19 19 LYS C C 19 177.706 177.706 177.527 0.179 19668 3802 1 11 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.559 0.426 19668 3803 1 11 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.981 0.443 19668 3804 1 11 . 1 1 19 19 LYS H H 19 8.008 8.008 7.464 0.544 19668 3805 1 11 . 1 1 20 20 ALA N N 20 119.177 119.177 121.287 -2.110 19668 3806 1 11 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.248 0.068 19668 3807 1 11 . 1 1 20 20 ALA C C 20 178.269 178.269 178.266 0.003 19668 3808 1 11 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.368 -0.737 19668 3809 1 11 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.049 0.084 19668 3810 1 11 . 1 1 20 20 ALA H H 20 7.259 7.259 7.413 -0.154 19668 3811 1 11 . 1 1 21 21 LEU N N 21 118.596 118.596 117.580 1.016 19668 3812 1 11 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.411 -0.150 19668 3813 1 11 . 1 1 21 21 LEU C C 21 177.732 177.732 177.065 0.667 19668 3814 1 11 . 1 1 21 21 LEU CA C 21 55.657 55.657 54.828 0.829 19668 3815 1 11 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.451 0.682 19668 3816 1 11 . 1 1 21 21 LEU H H 21 7.373 7.373 7.364 0.009 19668 3817 1 11 . 1 1 22 22 GLY N N 22 107.926 107.926 108.536 -0.610 19668 3818 1 11 . 1 1 22 22 GLY C C 22 173.362 173.362 174.952 -1.590 19668 3819 1 11 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.140 0.057 19668 3820 1 11 . 1 1 22 22 GLY H H 22 8.144 8.144 8.436 -0.292 19668 3821 1 11 . 1 1 23 23 GLY N N 23 108.242 108.242 107.952 0.290 19668 3822 1 11 . 1 1 23 23 GLY C C 23 174.110 174.110 174.360 -0.250 19668 3823 1 11 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.564 0.120 19668 3824 1 11 . 1 1 23 23 GLY H H 23 8.157 8.157 7.969 0.188 19668 3825 1 11 . 1 1 24 24 GLY N N 24 106.969 106.969 107.177 -0.208 19668 3826 1 11 . 1 1 24 24 GLY C C 24 175.172 175.172 174.861 0.311 19668 3827 1 11 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.984 -0.545 19668 3828 1 11 . 1 1 24 24 GLY H H 24 8.466 8.466 8.370 0.096 19668 3829 1 11 . 1 1 25 25 GLY N N 25 108.946 108.946 110.357 -1.411 19668 3830 1 11 . 1 1 25 25 GLY C C 25 176.321 176.321 175.160 1.161 19668 3831 1 11 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.827 1.272 19668 3832 1 11 . 1 1 25 25 GLY H H 25 8.618 8.618 8.471 0.147 19668 3833 1 11 . 1 1 26 26 ARG N N 26 123.559 123.559 123.063 0.496 19668 3834 1 11 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.188 0.091 19668 3835 1 11 . 1 1 26 26 ARG C C 26 178.076 178.076 177.770 0.306 19668 3836 1 11 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.111 -1.196 19668 3837 1 11 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.297 -0.387 19668 3838 1 11 . 1 1 26 26 ARG H H 26 8.789 8.789 7.697 1.092 19668 3839 1 11 . 1 1 27 27 ILE N N 27 118.726 118.726 117.803 0.923 19668 3840 1 11 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.884 -0.098 19668 3841 1 11 . 1 1 27 27 ILE C C 27 177.639 177.639 177.738 -0.099 19668 3842 1 11 . 1 1 27 27 ILE CA C 27 63.624 63.624 62.858 0.766 19668 3843 1 11 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.508 0.447 19668 3844 1 11 . 1 1 27 27 ILE H H 27 7.762 7.762 8.387 -0.625 19668 3845 1 11 . 1 1 28 28 GLU N N 28 119.843 119.843 119.441 0.402 19668 3846 1 11 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.024 -0.011 19668 3847 1 11 . 1 1 28 28 GLU C C 28 179.447 179.447 178.738 0.709 19668 3848 1 11 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.418 0.165 19668 3849 1 11 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.808 0.252 19668 3850 1 11 . 1 1 28 28 GLU H H 28 7.867 7.867 8.890 -1.023 19668 3851 1 11 . 1 1 29 29 GLU N N 29 118.447 118.447 119.774 -1.327 19668 3852 1 11 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.083 0.004 19668 3853 1 11 . 1 1 29 29 GLU C C 29 179.310 179.310 178.810 0.500 19668 3854 1 11 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.399 0.881 19668 3855 1 11 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.273 0.063 19668 3856 1 11 . 1 1 29 29 GLU H H 29 7.755 7.755 7.662 0.093 19668 3857 1 11 . 1 1 30 30 LEU N N 30 121.135 121.135 121.635 -0.500 19668 3858 1 11 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.992 0.104 19668 3859 1 11 . 1 1 30 30 LEU C C 30 178.928 178.928 178.752 0.176 19668 3860 1 11 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.289 -0.185 19668 3861 1 11 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.121 -0.441 19668 3862 1 11 . 1 1 30 30 LEU H H 30 7.785 7.785 7.608 0.177 19668 3863 1 11 . 1 1 31 31 LYS N N 31 119.130 119.130 117.676 1.454 19668 3864 1 11 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.079 -0.209 19668 3865 1 11 . 1 1 31 31 LYS C C 31 179.104 179.104 178.932 0.172 19668 3866 1 11 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.430 1.286 19668 3867 1 11 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.812 0.444 19668 3868 1 11 . 1 1 31 31 LYS H H 31 8.413 8.413 7.680 0.733 19668 3869 1 11 . 1 1 32 32 LYS N N 32 119.200 119.200 119.952 -0.752 19668 3870 1 11 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.996 0.106 19668 3871 1 11 . 1 1 32 32 LYS C C 32 179.420 179.420 179.226 0.194 19668 3872 1 11 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.498 -0.041 19668 3873 1 11 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.250 0.016 19668 3874 1 11 . 1 1 32 32 LYS H H 32 7.826 7.826 7.514 0.312 19668 3875 1 11 . 1 1 33 33 LYS N N 33 120.322 120.322 119.249 1.073 19668 3876 1 11 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.056 0.107 19668 3877 1 11 . 1 1 33 33 LYS C C 33 179.174 179.174 178.664 0.510 19668 3878 1 11 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.340 0.408 19668 3879 1 11 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.102 -0.363 19668 3880 1 11 . 1 1 33 33 LYS H H 33 8.003 8.003 7.490 0.513 19668 3881 1 11 . 1 1 34 34 TYR N N 34 120.223 120.223 119.836 0.387 19668 3882 1 11 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.064 -0.008 19668 3883 1 11 . 1 1 34 34 TYR C C 34 176.356 176.356 177.729 -1.373 19668 3884 1 11 . 1 1 34 34 TYR CA C 34 61.055 61.055 62.106 -1.051 19668 3885 1 11 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.315 -0.288 19668 3886 1 11 . 1 1 34 34 TYR H H 34 8.614 8.614 7.646 0.968 19668 3887 1 11 . 1 1 35 35 GLU N N 35 118.813 118.813 117.237 1.576 19668 3888 1 11 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.963 -0.238 19668 3889 1 11 . 1 1 35 35 GLU C C 35 179.787 179.787 178.930 0.857 19668 3890 1 11 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.389 0.050 19668 3891 1 11 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.070 0.058 19668 3892 1 11 . 1 1 35 35 GLU H H 35 8.103 8.103 7.959 0.144 19668 3893 1 11 . 1 1 36 36 GLU N N 36 119.670 119.670 119.716 -0.046 19668 3894 1 11 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.082 -0.068 19668 3895 1 11 . 1 1 36 36 GLU C C 36 179.295 179.295 178.879 0.416 19668 3896 1 11 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.260 0.003 19668 3897 1 11 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.639 -0.070 19668 3898 1 11 . 1 1 36 36 GLU H H 36 8.028 8.028 7.669 0.359 19668 3899 1 11 . 1 1 37 37 LEU N N 37 121.416 121.416 119.727 1.689 19668 3900 1 11 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.017 0.002 19668 3901 1 11 . 1 1 37 37 LEU C C 37 178.277 178.277 179.270 -0.993 19668 3902 1 11 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.996 -0.156 19668 3903 1 11 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.395 0.234 19668 3904 1 11 . 1 1 37 37 LEU H H 37 8.176 8.176 7.333 0.843 19668 3905 1 11 . 1 1 38 38 LYS N N 38 118.998 118.998 117.843 1.155 19668 3906 1 11 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.954 -0.294 19668 3907 1 11 . 1 1 38 38 LYS C C 38 178.923 178.923 179.026 -0.103 19668 3908 1 11 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.928 0.472 19668 3909 1 11 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.001 0.061 19668 3910 1 11 . 1 1 38 38 LYS H H 38 8.260 8.260 7.589 0.671 19668 3911 1 11 . 1 1 39 39 LYS N N 39 118.070 118.070 118.357 -0.287 19668 3912 1 11 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.067 0.013 19668 3913 1 11 . 1 1 39 39 LYS C C 39 178.687 178.687 178.903 -0.216 19668 3914 1 11 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.459 -0.523 19668 3915 1 11 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.135 0.014 19668 3916 1 11 . 1 1 39 39 LYS H H 39 7.380 7.380 7.663 -0.283 19668 3917 1 11 . 1 1 40 40 LYS N N 40 118.894 118.894 119.539 -0.645 19668 3918 1 11 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.073 -0.014 19668 3919 1 11 . 1 1 40 40 LYS C C 40 179.758 179.758 179.047 0.711 19668 3920 1 11 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.562 -0.500 19668 3921 1 11 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.105 0.283 19668 3922 1 11 . 1 1 40 40 LYS H H 40 7.919 7.919 7.420 0.499 19668 3923 1 11 . 1 1 41 41 ILE N N 41 118.270 118.270 118.957 -0.687 19668 3924 1 11 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.756 -0.059 19668 3925 1 11 . 1 1 41 41 ILE C C 41 178.211 178.211 177.030 1.181 19668 3926 1 11 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.903 -0.189 19668 3927 1 11 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.719 0.120 19668 3928 1 11 . 1 1 41 41 ILE H H 41 8.199 8.199 7.442 0.757 19668 3929 1 11 . 1 1 42 42 GLU N N 42 120.117 120.117 118.059 2.058 19668 3930 1 11 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.043 0.048 19668 3931 1 11 . 1 1 42 42 GLU C C 42 178.736 178.736 178.112 0.624 19668 3932 1 11 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.668 0.212 19668 3933 1 11 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.897 -0.506 19668 3934 1 11 . 1 1 42 42 GLU H H 42 7.738 7.738 7.475 0.263 19668 3935 1 11 . 1 1 43 43 GLU N N 43 117.194 117.194 117.552 -0.358 19668 3936 1 11 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.172 0.127 19668 3937 1 11 . 1 1 43 43 GLU C C 43 177.658 177.658 177.327 0.331 19668 3938 1 11 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.493 -0.700 19668 3939 1 11 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.521 -0.588 19668 3940 1 11 . 1 1 43 43 GLU H H 43 7.698 7.698 7.516 0.182 19668 3941 1 11 . 1 1 44 44 LEU N N 44 120.812 120.812 119.311 1.501 19668 3942 1 11 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.274 -0.035 19668 3943 1 11 . 1 1 44 44 LEU C C 44 178.682 178.682 176.248 2.434 19668 3944 1 11 . 1 1 44 44 LEU CA C 44 56.496 56.496 56.015 0.481 19668 3945 1 11 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.259 0.388 19668 3946 1 11 . 1 1 44 44 LEU H H 44 7.593 7.593 7.427 0.166 19668 3947 1 11 . 1 1 45 45 GLY N N 45 108.681 108.681 109.258 -0.577 19668 3948 1 11 . 1 1 45 45 GLY C C 45 174.957 174.957 174.323 0.634 19668 3949 1 11 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.053 2.033 19668 3950 1 11 . 1 1 45 45 GLY H H 45 8.234 8.234 7.989 0.245 19668 3951 1 11 . 1 1 46 46 GLY N N 46 108.057 108.057 108.138 -0.081 19668 3952 1 11 . 1 1 46 46 GLY C C 46 174.777 174.777 174.093 0.684 19668 3953 1 11 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.655 -0.291 19668 3954 1 11 . 1 1 46 46 GLY H H 46 8.182 8.182 8.461 -0.279 19668 3955 1 11 . 1 1 47 47 GLY N N 47 108.494 108.494 107.968 0.526 19668 3956 1 11 . 1 1 47 47 GLY C C 47 174.572 174.572 174.109 0.463 19668 3957 1 11 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.936 0.219 19668 3958 1 11 . 1 1 47 47 GLY H H 47 8.087 8.087 7.818 0.269 19668 3959 1 11 . 1 1 48 48 GLY N N 48 108.285 108.285 110.953 -2.668 19668 3960 1 11 . 1 1 48 48 GLY C C 48 174.495 174.495 175.565 -1.070 19668 3961 1 11 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.376 0.078 19668 3962 1 11 . 1 1 48 48 GLY H H 48 8.323 8.323 8.374 -0.051 19668 3963 1 11 . 1 1 49 49 GLU N N 49 121.070 121.070 123.144 -2.074 19668 3964 1 11 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.131 0.286 19668 3965 1 11 . 1 1 49 49 GLU C C 49 177.226 177.226 177.864 -0.638 19668 3966 1 11 . 1 1 49 49 GLU CA C 49 56.571 56.571 58.748 -2.177 19668 3967 1 11 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.436 0.230 19668 3968 1 11 . 1 1 49 49 GLU H H 49 8.483 8.483 8.258 0.225 19668 3969 1 11 . 1 1 50 50 VAL N N 50 121.794 121.794 113.919 7.875 19668 3970 1 11 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.683 0.098 19668 3971 1 11 . 1 1 50 50 VAL C C 50 176.860 176.860 177.506 -0.646 19668 3972 1 11 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.091 -0.011 19668 3973 1 11 . 1 1 50 50 VAL CB C 50 32.253 32.253 30.702 1.551 19668 3974 1 11 . 1 1 50 50 VAL H H 50 8.068 8.068 8.144 -0.076 19668 3975 1 11 . 1 1 51 51 LYS N N 51 120.593 120.593 119.237 1.356 19668 3976 1 11 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.110 0.097 19668 3977 1 11 . 1 1 51 51 LYS C C 51 178.667 178.667 178.967 -0.300 19668 3978 1 11 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.242 0.093 19668 3979 1 11 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.825 0.433 19668 3980 1 11 . 1 1 51 51 LYS H H 51 8.253 8.253 7.764 0.489 19668 3981 1 11 . 1 1 52 52 LYS N N 52 117.572 117.572 119.600 -2.028 19668 3982 1 11 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.135 0.033 19668 3983 1 11 . 1 1 52 52 LYS C C 52 179.248 179.248 178.655 0.593 19668 3984 1 11 . 1 1 52 52 LYS CA C 52 59.014 59.014 58.451 0.563 19668 3985 1 11 . 1 1 52 52 LYS CB C 52 32.180 32.180 31.992 0.188 19668 3986 1 11 . 1 1 52 52 LYS H H 52 7.629 7.629 7.741 -0.112 19668 3987 1 11 . 1 1 53 53 VAL N N 53 119.059 119.059 119.053 0.006 19668 3988 1 11 . 1 1 53 53 VAL HA H 53 3.792 3.792 4.235 -0.443 19668 3989 1 11 . 1 1 53 53 VAL C C 53 177.987 177.987 178.389 -0.402 19668 3990 1 11 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.786 1.245 19668 3991 1 11 . 1 1 53 53 VAL CB C 53 31.371 31.371 30.899 0.472 19668 3992 1 11 . 1 1 53 53 VAL H H 53 7.638 7.638 7.446 0.192 19668 3993 1 11 . 1 1 54 54 GLU N N 54 120.388 120.388 118.970 1.418 19668 3994 1 11 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.953 -0.109 19668 3995 1 11 . 1 1 54 54 GLU C C 54 179.624 179.624 178.791 0.833 19668 3996 1 11 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.679 0.562 19668 3997 1 11 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.128 0.690 19668 3998 1 11 . 1 1 54 54 GLU H H 54 8.603 8.603 7.653 0.950 19668 3999 1 11 . 1 1 55 55 GLU N N 55 118.533 118.533 119.759 -1.226 19668 4000 1 11 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.040 0.049 19668 4001 1 11 . 1 1 55 55 GLU C C 55 179.158 179.158 178.743 0.415 19668 4002 1 11 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.269 0.065 19668 4003 1 11 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.712 -0.375 19668 4004 1 11 . 1 1 55 55 GLU H H 55 7.904 7.904 7.627 0.277 19668 4005 1 11 . 1 1 56 56 GLU N N 56 120.258 120.258 118.262 1.996 19668 4006 1 11 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.056 0.044 19668 4007 1 11 . 1 1 56 56 GLU C C 56 179.867 179.867 178.842 1.025 19668 4008 1 11 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.819 0.844 19668 4009 1 11 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.408 0.642 19668 4010 1 11 . 1 1 56 56 GLU H H 56 7.902 7.902 7.635 0.267 19668 4011 1 11 . 1 1 57 57 VAL N N 57 121.168 121.168 121.188 -0.020 19668 4012 1 11 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.513 0.055 19668 4013 1 11 . 1 1 57 57 VAL C C 57 176.994 176.994 176.741 0.253 19668 4014 1 11 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.795 1.101 19668 4015 1 11 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.995 -0.469 19668 4016 1 11 . 1 1 57 57 VAL H H 57 8.613 8.613 7.476 1.137 19668 4017 1 11 . 1 1 58 58 LYS N N 58 120.234 120.234 119.006 1.228 19668 4018 1 11 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.964 0.238 19668 4019 1 11 . 1 1 58 58 LYS C C 58 179.131 179.131 178.115 1.016 19668 4020 1 11 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.527 0.060 19668 4021 1 11 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.534 0.757 19668 4022 1 11 . 1 1 58 58 LYS H H 58 7.810 7.810 7.633 0.177 19668 4023 1 11 . 1 1 59 59 LYS N N 59 118.301 118.301 118.863 -0.562 19668 4024 1 11 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.059 0.034 19668 4025 1 11 . 1 1 59 59 LYS C C 59 179.281 179.281 178.327 0.954 19668 4026 1 11 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.056 0.372 19668 4027 1 11 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.950 0.429 19668 4028 1 11 . 1 1 59 59 LYS H H 59 7.876 7.876 7.380 0.496 19668 4029 1 11 . 1 1 60 60 LEU N N 60 121.224 121.224 120.374 0.850 19668 4030 1 11 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.013 0.221 19668 4031 1 11 . 1 1 60 60 LEU C C 60 178.636 178.636 178.664 -0.028 19668 4032 1 11 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.797 0.360 19668 4033 1 11 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.314 0.320 19668 4034 1 11 . 1 1 60 60 LEU H H 60 7.893 7.893 7.699 0.194 19668 4035 1 11 . 1 1 61 61 GLU N N 61 118.660 118.660 118.027 0.633 19668 4036 1 11 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.081 -0.282 19668 4037 1 11 . 1 1 61 61 GLU C C 61 179.094 179.094 178.823 0.271 19668 4038 1 11 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.002 1.270 19668 4039 1 11 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.630 1.373 19668 4040 1 11 . 1 1 61 61 GLU H H 61 8.644 8.644 7.820 0.824 19668 4041 1 11 . 1 1 62 62 GLU N N 62 117.555 117.555 119.491 -1.936 19668 4042 1 11 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.029 -0.033 19668 4043 1 11 . 1 1 62 62 GLU C C 62 178.940 178.940 179.102 -0.162 19668 4044 1 11 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.211 -0.043 19668 4045 1 11 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.089 0.458 19668 4046 1 11 . 1 1 62 62 GLU H H 62 7.995 7.995 7.590 0.405 19668 4047 1 11 . 1 1 63 63 GLU N N 63 119.097 119.097 118.322 0.775 19668 4048 1 11 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.139 -0.110 19668 4049 1 11 . 1 1 63 63 GLU C C 63 179.890 179.890 178.997 0.893 19668 4050 1 11 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.861 0.480 19668 4051 1 11 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.181 0.485 19668 4052 1 11 . 1 1 63 63 GLU H H 63 7.983 7.983 7.727 0.256 19668 4053 1 11 . 1 1 64 64 ILE N N 64 118.247 118.247 118.048 0.199 19668 4054 1 11 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.857 -0.137 19668 4055 1 11 . 1 1 64 64 ILE C C 64 177.858 177.858 177.614 0.244 19668 4056 1 11 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.312 0.184 19668 4057 1 11 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.427 0.554 19668 4058 1 11 . 1 1 64 64 ILE H H 64 8.261 8.261 7.263 0.998 19668 4059 1 11 . 1 1 65 65 LYS N N 65 118.693 118.693 118.121 0.572 19668 4060 1 11 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.152 -0.054 19668 4061 1 11 . 1 1 65 65 LYS C C 65 177.244 177.244 177.497 -0.253 19668 4062 1 11 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.450 0.203 19668 4063 1 11 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.351 0.354 19668 4064 1 11 . 1 1 65 65 LYS H H 65 7.661 7.661 7.511 0.150 19668 4065 1 11 . 1 1 66 66 LYS N N 66 116.933 116.933 117.009 -0.076 19668 4066 1 11 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.175 0.163 19668 4067 1 11 . 1 1 66 66 LYS C C 66 176.011 176.011 177.175 -1.164 19668 4068 1 11 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.309 -0.850 19668 4069 1 11 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.994 0.137 19668 4070 1 11 . 1 1 66 66 LYS H H 66 7.261 7.261 7.549 -0.288 19668 4071 1 12 . 1 1 2 2 SER HA H 2 4.560 4.560 4.561 -0.001 19668 4072 1 12 . 1 1 2 2 SER CA C 2 58.366 58.366 59.115 -0.749 19668 4073 1 12 . 1 1 3 3 ARG N N 3 125.213 125.213 121.920 3.293 19668 4074 1 12 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.180 0.086 19668 4075 1 12 . 1 1 3 3 ARG C C 3 178.381 178.381 178.220 0.161 19668 4076 1 12 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.577 -0.181 19668 4077 1 12 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.541 1.115 19668 4078 1 12 . 1 1 3 3 ARG H H 3 8.874 8.874 8.434 0.440 19668 4079 1 12 . 1 1 4 4 VAL N N 4 119.320 119.320 119.389 -0.069 19668 4080 1 12 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.783 0.015 19668 4081 1 12 . 1 1 4 4 VAL C C 4 177.004 177.004 177.665 -0.661 19668 4082 1 12 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.969 -0.454 19668 4083 1 12 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.487 0.316 19668 4084 1 12 . 1 1 4 4 VAL H H 4 8.112 8.112 7.895 0.217 19668 4085 1 12 . 1 1 5 5 LYS N N 5 122.279 122.279 120.440 1.839 19668 4086 1 12 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.928 0.234 19668 4087 1 12 . 1 1 5 5 LYS C C 5 178.547 178.547 178.370 0.177 19668 4088 1 12 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.803 -0.046 19668 4089 1 12 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.576 0.434 19668 4090 1 12 . 1 1 5 5 LYS H H 5 7.847 7.847 8.013 -0.166 19668 4091 1 12 . 1 1 6 6 ALA N N 6 120.295 120.295 121.694 -1.399 19668 4092 1 12 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.109 0.102 19668 4093 1 12 . 1 1 6 6 ALA C C 6 180.834 180.834 179.739 1.095 19668 4094 1 12 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.915 -0.012 19668 4095 1 12 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.053 0.079 19668 4096 1 12 . 1 1 6 6 ALA H H 6 7.975 7.975 7.766 0.209 19668 4097 1 12 . 1 1 7 7 LEU N N 7 119.570 119.570 118.350 1.220 19668 4098 1 12 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.073 0.099 19668 4099 1 12 . 1 1 7 7 LEU C C 7 178.431 178.431 178.431 0.000 19668 4100 1 12 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.782 -0.103 19668 4101 1 12 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.076 0.959 19668 4102 1 12 . 1 1 7 7 LEU H H 7 7.650 7.650 7.658 -0.008 19668 4103 1 12 . 1 1 8 8 GLU N N 8 119.934 119.934 118.325 1.609 19668 4104 1 12 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.100 -0.241 19668 4105 1 12 . 1 1 8 8 GLU C C 8 179.534 179.534 179.158 0.376 19668 4106 1 12 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.163 0.873 19668 4107 1 12 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.877 0.590 19668 4108 1 12 . 1 1 8 8 GLU H H 8 8.411 8.411 7.906 0.505 19668 4109 1 12 . 1 1 9 9 GLU N N 9 118.234 118.234 119.762 -1.528 19668 4110 1 12 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.096 -0.036 19668 4111 1 12 . 1 1 9 9 GLU C C 9 179.596 179.596 178.608 0.988 19668 4112 1 12 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.383 -0.053 19668 4113 1 12 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.335 0.083 19668 4114 1 12 . 1 1 9 9 GLU H H 9 8.206 8.206 7.740 0.466 19668 4115 1 12 . 1 1 10 10 LYS N N 10 121.042 121.042 118.875 2.167 19668 4116 1 12 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.156 0.027 19668 4117 1 12 . 1 1 10 10 LYS C C 10 179.380 179.380 179.133 0.247 19668 4118 1 12 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.177 0.148 19668 4119 1 12 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.160 0.249 19668 4120 1 12 . 1 1 10 10 LYS H H 10 7.931 7.931 7.547 0.384 19668 4121 1 12 . 1 1 11 11 VAL N N 11 118.662 118.662 119.847 -1.185 19668 4122 1 12 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.891 -0.077 19668 4123 1 12 . 1 1 11 11 VAL C C 11 178.845 178.845 178.166 0.679 19668 4124 1 12 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.688 1.300 19668 4125 1 12 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.099 0.555 19668 4126 1 12 . 1 1 11 11 VAL H H 11 8.371 8.371 7.621 0.750 19668 4127 1 12 . 1 1 12 12 LYS N N 12 123.188 123.188 120.114 3.074 19668 4128 1 12 . 1 1 12 12 LYS HA H 12 4.226 4.226 4.014 0.212 19668 4129 1 12 . 1 1 12 12 LYS C C 12 179.098 179.098 178.384 0.714 19668 4130 1 12 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.420 0.063 19668 4131 1 12 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.329 -0.123 19668 4132 1 12 . 1 1 12 12 LYS H H 12 8.276 8.276 7.576 0.700 19668 4133 1 12 . 1 1 13 13 ALA N N 13 121.169 121.169 121.785 -0.616 19668 4134 1 12 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.002 0.256 19668 4135 1 12 . 1 1 13 13 ALA C C 13 180.169 180.169 179.347 0.822 19668 4136 1 12 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.947 -0.311 19668 4137 1 12 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.442 -0.335 19668 4138 1 12 . 1 1 13 13 ALA H H 13 7.829 7.829 7.438 0.391 19668 4139 1 12 . 1 1 14 14 LEU N N 14 118.104 118.104 118.392 -0.288 19668 4140 1 12 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.951 0.205 19668 4141 1 12 . 1 1 14 14 LEU C C 14 177.614 177.614 177.975 -0.361 19668 4142 1 12 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.121 -0.516 19668 4143 1 12 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.999 0.796 19668 4144 1 12 . 1 1 14 14 LEU H H 14 7.781 7.781 7.411 0.370 19668 4145 1 12 . 1 1 15 15 GLU N N 15 120.632 120.632 118.837 1.795 19668 4146 1 12 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.364 0.003 19668 4147 1 12 . 1 1 15 15 GLU C C 15 178.243 178.243 178.479 -0.236 19668 4148 1 12 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.575 1.010 19668 4149 1 12 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.235 0.594 19668 4150 1 12 . 1 1 15 15 GLU H H 15 7.873 7.873 7.370 0.503 19668 4151 1 12 . 1 1 16 16 GLU N N 16 115.775 115.775 117.049 -1.274 19668 4152 1 12 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.991 -0.032 19668 4153 1 12 . 1 1 16 16 GLU C C 16 179.006 179.006 178.538 0.468 19668 4154 1 12 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.211 -0.119 19668 4155 1 12 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.014 0.339 19668 4156 1 12 . 1 1 16 16 GLU H H 16 7.926 7.926 7.823 0.103 19668 4157 1 12 . 1 1 17 17 LYS N N 17 118.801 118.801 119.344 -0.543 19668 4158 1 12 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.065 0.029 19668 4159 1 12 . 1 1 17 17 LYS C C 17 178.853 178.853 178.596 0.257 19668 4160 1 12 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.646 -0.175 19668 4161 1 12 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.908 0.454 19668 4162 1 12 . 1 1 17 17 LYS H H 17 7.518 7.518 7.455 0.063 19668 4163 1 12 . 1 1 18 18 VAL N N 18 118.034 118.034 120.131 -2.097 19668 4164 1 12 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.605 -0.093 19668 4165 1 12 . 1 1 18 18 VAL C C 18 178.362 178.362 177.689 0.673 19668 4166 1 12 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.979 0.040 19668 4167 1 12 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.400 0.249 19668 4168 1 12 . 1 1 18 18 VAL H H 18 8.048 8.048 7.398 0.650 19668 4169 1 12 . 1 1 19 19 LYS N N 19 118.427 118.427 117.821 0.606 19668 4170 1 12 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.077 -0.067 19668 4171 1 12 . 1 1 19 19 LYS C C 19 177.706 177.706 177.284 0.422 19668 4172 1 12 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.526 0.459 19668 4173 1 12 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.940 0.484 19668 4174 1 12 . 1 1 19 19 LYS H H 19 8.008 8.008 7.380 0.628 19668 4175 1 12 . 1 1 20 20 ALA N N 20 119.177 119.177 119.823 -0.646 19668 4176 1 12 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.341 -0.025 19668 4177 1 12 . 1 1 20 20 ALA C C 20 178.269 178.269 178.883 -0.614 19668 4178 1 12 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.355 -0.724 19668 4179 1 12 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.000 0.133 19668 4180 1 12 . 1 1 20 20 ALA H H 20 7.259 7.259 7.523 -0.264 19668 4181 1 12 . 1 1 21 21 LEU N N 21 118.596 118.596 114.942 3.654 19668 4182 1 12 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.265 -0.004 19668 4183 1 12 . 1 1 21 21 LEU C C 21 177.732 177.732 177.037 0.695 19668 4184 1 12 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.739 -0.082 19668 4185 1 12 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.292 0.841 19668 4186 1 12 . 1 1 21 21 LEU H H 21 7.373 7.373 7.230 0.143 19668 4187 1 12 . 1 1 22 22 GLY N N 22 107.926 107.926 104.799 3.127 19668 4188 1 12 . 1 1 22 22 GLY C C 22 173.362 173.362 172.455 0.907 19668 4189 1 12 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.692 0.505 19668 4190 1 12 . 1 1 22 22 GLY H H 22 8.144 8.144 7.232 0.912 19668 4191 1 12 . 1 1 23 23 GLY N N 23 108.242 108.242 105.202 3.040 19668 4192 1 12 . 1 1 23 23 GLY C C 23 174.110 174.110 172.842 1.268 19668 4193 1 12 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.120 -0.436 19668 4194 1 12 . 1 1 23 23 GLY H H 23 8.157 8.157 7.971 0.186 19668 4195 1 12 . 1 1 24 24 GLY N N 24 106.969 106.969 108.213 -1.244 19668 4196 1 12 . 1 1 24 24 GLY C C 24 175.172 175.172 174.764 0.408 19668 4197 1 12 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.701 -0.262 19668 4198 1 12 . 1 1 24 24 GLY H H 24 8.466 8.466 8.116 0.350 19668 4199 1 12 . 1 1 25 25 GLY N N 25 108.946 108.946 113.679 -4.733 19668 4200 1 12 . 1 1 25 25 GLY C C 25 176.321 176.321 175.462 0.859 19668 4201 1 12 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.405 1.694 19668 4202 1 12 . 1 1 25 25 GLY H H 25 8.618 8.618 8.030 0.588 19668 4203 1 12 . 1 1 26 26 ARG N N 26 123.559 123.559 123.421 0.138 19668 4204 1 12 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.306 -0.027 19668 4205 1 12 . 1 1 26 26 ARG C C 26 178.076 178.076 178.588 -0.512 19668 4206 1 12 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.658 -0.743 19668 4207 1 12 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.736 0.174 19668 4208 1 12 . 1 1 26 26 ARG H H 26 8.789 8.789 8.165 0.624 19668 4209 1 12 . 1 1 27 27 ILE N N 27 118.726 118.726 118.771 -0.045 19668 4210 1 12 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.831 -0.045 19668 4211 1 12 . 1 1 27 27 ILE C C 27 177.639 177.639 177.749 -0.110 19668 4212 1 12 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.403 0.221 19668 4213 1 12 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.584 0.371 19668 4214 1 12 . 1 1 27 27 ILE H H 27 7.762 7.762 8.171 -0.409 19668 4215 1 12 . 1 1 28 28 GLU N N 28 119.843 119.843 119.376 0.467 19668 4216 1 12 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.000 0.013 19668 4217 1 12 . 1 1 28 28 GLU C C 28 179.447 179.447 178.943 0.504 19668 4218 1 12 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.861 -0.278 19668 4219 1 12 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.384 -0.324 19668 4220 1 12 . 1 1 28 28 GLU H H 28 7.867 7.867 8.462 -0.595 19668 4221 1 12 . 1 1 29 29 GLU N N 29 118.447 118.447 119.339 -0.892 19668 4222 1 12 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.023 0.064 19668 4223 1 12 . 1 1 29 29 GLU C C 29 179.310 179.310 179.010 0.300 19668 4224 1 12 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.929 0.351 19668 4225 1 12 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.194 0.142 19668 4226 1 12 . 1 1 29 29 GLU H H 29 7.755 7.755 8.520 -0.765 19668 4227 1 12 . 1 1 30 30 LEU N N 30 121.135 121.135 121.088 0.047 19668 4228 1 12 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.019 0.077 19668 4229 1 12 . 1 1 30 30 LEU C C 30 178.928 178.928 178.709 0.219 19668 4230 1 12 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.077 0.028 19668 4231 1 12 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.093 -0.413 19668 4232 1 12 . 1 1 30 30 LEU H H 30 7.785 7.785 7.591 0.194 19668 4233 1 12 . 1 1 31 31 LYS N N 31 119.130 119.130 117.942 1.188 19668 4234 1 12 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.040 -0.170 19668 4235 1 12 . 1 1 31 31 LYS C C 31 179.104 179.104 178.994 0.110 19668 4236 1 12 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.200 1.516 19668 4237 1 12 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.868 0.388 19668 4238 1 12 . 1 1 31 31 LYS H H 31 8.413 8.413 7.494 0.919 19668 4239 1 12 . 1 1 32 32 LYS N N 32 119.200 119.200 119.103 0.097 19668 4240 1 12 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.047 0.055 19668 4241 1 12 . 1 1 32 32 LYS C C 32 179.420 179.420 178.903 0.517 19668 4242 1 12 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.061 0.396 19668 4243 1 12 . 1 1 32 32 LYS CB C 32 32.266 32.266 31.903 0.363 19668 4244 1 12 . 1 1 32 32 LYS H H 32 7.826 7.826 7.761 0.065 19668 4245 1 12 . 1 1 33 33 LYS N N 33 120.322 120.322 119.265 1.057 19668 4246 1 12 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.053 0.110 19668 4247 1 12 . 1 1 33 33 LYS C C 33 179.174 179.174 178.934 0.240 19668 4248 1 12 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.485 -0.737 19668 4249 1 12 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.278 -0.538 19668 4250 1 12 . 1 1 33 33 LYS H H 33 8.003 8.003 7.707 0.296 19668 4251 1 12 . 1 1 34 34 TYR N N 34 120.223 120.223 117.871 2.352 19668 4252 1 12 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.152 -0.096 19668 4253 1 12 . 1 1 34 34 TYR C C 34 176.356 176.356 177.724 -1.368 19668 4254 1 12 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.594 -0.539 19668 4255 1 12 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.235 -0.208 19668 4256 1 12 . 1 1 34 34 TYR H H 34 8.614 8.614 7.507 1.107 19668 4257 1 12 . 1 1 35 35 GLU N N 35 118.813 118.813 117.182 1.631 19668 4258 1 12 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.965 -0.240 19668 4259 1 12 . 1 1 35 35 GLU C C 35 179.787 179.787 178.914 0.873 19668 4260 1 12 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.880 -0.441 19668 4261 1 12 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.041 0.087 19668 4262 1 12 . 1 1 35 35 GLU H H 35 8.103 8.103 7.833 0.270 19668 4263 1 12 . 1 1 36 36 GLU N N 36 119.670 119.670 119.404 0.266 19668 4264 1 12 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.082 -0.068 19668 4265 1 12 . 1 1 36 36 GLU C C 36 179.295 179.295 178.978 0.317 19668 4266 1 12 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.162 0.101 19668 4267 1 12 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.578 -0.010 19668 4268 1 12 . 1 1 36 36 GLU H H 36 8.028 8.028 7.664 0.364 19668 4269 1 12 . 1 1 37 37 LEU N N 37 121.416 121.416 119.987 1.429 19668 4270 1 12 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.021 -0.002 19668 4271 1 12 . 1 1 37 37 LEU C C 37 178.277 178.277 179.154 -0.877 19668 4272 1 12 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.951 -0.111 19668 4273 1 12 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.317 0.312 19668 4274 1 12 . 1 1 37 37 LEU H H 37 8.176 8.176 7.454 0.722 19668 4275 1 12 . 1 1 38 38 LYS N N 38 118.998 118.998 118.091 0.907 19668 4276 1 12 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.973 -0.313 19668 4277 1 12 . 1 1 38 38 LYS C C 38 178.923 178.923 179.420 -0.497 19668 4278 1 12 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.699 0.701 19668 4279 1 12 . 1 1 38 38 LYS CB C 38 32.062 32.062 31.959 0.103 19668 4280 1 12 . 1 1 38 38 LYS H H 38 8.260 8.260 7.613 0.647 19668 4281 1 12 . 1 1 39 39 LYS N N 39 118.070 118.070 119.121 -1.051 19668 4282 1 12 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.040 0.040 19668 4283 1 12 . 1 1 39 39 LYS C C 39 178.687 178.687 179.056 -0.369 19668 4284 1 12 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.652 -0.716 19668 4285 1 12 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.210 -0.061 19668 4286 1 12 . 1 1 39 39 LYS H H 39 7.380 7.380 7.572 -0.192 19668 4287 1 12 . 1 1 40 40 LYS N N 40 118.894 118.894 120.079 -1.185 19668 4288 1 12 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.044 0.015 19668 4289 1 12 . 1 1 40 40 LYS C C 40 179.758 179.758 179.084 0.674 19668 4290 1 12 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.461 -0.398 19668 4291 1 12 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.429 -0.041 19668 4292 1 12 . 1 1 40 40 LYS H H 40 7.919 7.919 7.460 0.459 19668 4293 1 12 . 1 1 41 41 ILE N N 41 118.270 118.270 119.075 -0.805 19668 4294 1 12 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.738 -0.041 19668 4295 1 12 . 1 1 41 41 ILE C C 41 178.211 178.211 178.051 0.160 19668 4296 1 12 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.660 0.054 19668 4297 1 12 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.802 0.037 19668 4298 1 12 . 1 1 41 41 ILE H H 41 8.199 8.199 7.572 0.627 19668 4299 1 12 . 1 1 42 42 GLU N N 42 120.117 120.117 118.551 1.566 19668 4300 1 12 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.021 0.070 19668 4301 1 12 . 1 1 42 42 GLU C C 42 178.736 178.736 177.667 1.069 19668 4302 1 12 . 1 1 42 42 GLU CA C 42 58.880 58.880 59.174 -0.294 19668 4303 1 12 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.776 -0.384 19668 4304 1 12 . 1 1 42 42 GLU H H 42 7.738 7.738 7.729 0.009 19668 4305 1 12 . 1 1 43 43 GLU N N 43 117.194 117.194 117.530 -0.336 19668 4306 1 12 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.174 0.125 19668 4307 1 12 . 1 1 43 43 GLU C C 43 177.658 177.658 177.337 0.321 19668 4308 1 12 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.860 -0.067 19668 4309 1 12 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.994 -0.061 19668 4310 1 12 . 1 1 43 43 GLU H H 43 7.698 7.698 7.465 0.233 19668 4311 1 12 . 1 1 44 44 LEU N N 44 120.812 120.812 120.756 0.056 19668 4312 1 12 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.155 0.084 19668 4313 1 12 . 1 1 44 44 LEU C C 44 178.682 178.682 177.575 1.107 19668 4314 1 12 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.069 1.427 19668 4315 1 12 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.579 0.068 19668 4316 1 12 . 1 1 44 44 LEU H H 44 7.593 7.593 7.479 0.114 19668 4317 1 12 . 1 1 45 45 GLY N N 45 108.681 108.681 111.970 -3.289 19668 4318 1 12 . 1 1 45 45 GLY C C 45 174.957 174.957 173.745 1.212 19668 4319 1 12 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.372 0.714 19668 4320 1 12 . 1 1 45 45 GLY H H 45 8.234 8.234 8.552 -0.318 19668 4321 1 12 . 1 1 46 46 GLY N N 46 108.057 108.057 107.747 0.310 19668 4322 1 12 . 1 1 46 46 GLY C C 46 174.777 174.777 173.980 0.797 19668 4323 1 12 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.013 0.351 19668 4324 1 12 . 1 1 46 46 GLY H H 46 8.182 8.182 7.921 0.261 19668 4325 1 12 . 1 1 47 47 GLY N N 47 108.494 108.494 110.674 -2.180 19668 4326 1 12 . 1 1 47 47 GLY C C 47 174.572 174.572 174.078 0.494 19668 4327 1 12 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.083 0.072 19668 4328 1 12 . 1 1 47 47 GLY H H 47 8.087 8.087 8.123 -0.036 19668 4329 1 12 . 1 1 48 48 GLY N N 48 108.285 108.285 110.436 -2.151 19668 4330 1 12 . 1 1 48 48 GLY C C 48 174.495 174.495 174.231 0.264 19668 4331 1 12 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.254 0.200 19668 4332 1 12 . 1 1 48 48 GLY H H 48 8.323 8.323 8.080 0.243 19668 4333 1 12 . 1 1 49 49 GLU N N 49 121.070 121.070 121.831 -0.761 19668 4334 1 12 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.716 -0.299 19668 4335 1 12 . 1 1 49 49 GLU C C 49 177.226 177.226 178.027 -0.801 19668 4336 1 12 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.036 0.535 19668 4337 1 12 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.091 -0.425 19668 4338 1 12 . 1 1 49 49 GLU H H 49 8.483 8.483 8.501 -0.018 19668 4339 1 12 . 1 1 50 50 VAL N N 50 121.794 121.794 119.056 2.738 19668 4340 1 12 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.748 0.033 19668 4341 1 12 . 1 1 50 50 VAL C C 50 176.860 176.860 177.341 -0.481 19668 4342 1 12 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.338 -0.258 19668 4343 1 12 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.045 1.208 19668 4344 1 12 . 1 1 50 50 VAL H H 50 8.068 8.068 8.077 -0.009 19668 4345 1 12 . 1 1 51 51 LYS N N 51 120.593 120.593 119.365 1.228 19668 4346 1 12 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.139 0.068 19668 4347 1 12 . 1 1 51 51 LYS C C 51 178.667 178.667 179.050 -0.383 19668 4348 1 12 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.594 -0.259 19668 4349 1 12 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.801 0.457 19668 4350 1 12 . 1 1 51 51 LYS H H 51 8.253 8.253 8.331 -0.078 19668 4351 1 12 . 1 1 52 52 LYS N N 52 117.572 117.572 119.715 -2.143 19668 4352 1 12 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.066 0.102 19668 4353 1 12 . 1 1 52 52 LYS C C 52 179.248 179.248 178.673 0.575 19668 4354 1 12 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.310 -0.296 19668 4355 1 12 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.197 -0.017 19668 4356 1 12 . 1 1 52 52 LYS H H 52 7.629 7.629 7.355 0.274 19668 4357 1 12 . 1 1 53 53 VAL N N 53 119.059 119.059 118.843 0.216 19668 4358 1 12 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.825 -0.033 19668 4359 1 12 . 1 1 53 53 VAL C C 53 177.987 177.987 177.804 0.183 19668 4360 1 12 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.866 -0.835 19668 4361 1 12 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.392 -0.021 19668 4362 1 12 . 1 1 53 53 VAL H H 53 7.638 7.638 7.939 -0.301 19668 4363 1 12 . 1 1 54 54 GLU N N 54 120.388 120.388 118.927 1.461 19668 4364 1 12 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.944 -0.100 19668 4365 1 12 . 1 1 54 54 GLU C C 54 179.624 179.624 178.747 0.877 19668 4366 1 12 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.697 0.544 19668 4367 1 12 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.165 0.653 19668 4368 1 12 . 1 1 54 54 GLU H H 54 8.603 8.603 7.668 0.935 19668 4369 1 12 . 1 1 55 55 GLU N N 55 118.533 118.533 119.216 -0.683 19668 4370 1 12 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.061 0.028 19668 4371 1 12 . 1 1 55 55 GLU C C 55 179.158 179.158 178.809 0.349 19668 4372 1 12 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.316 0.018 19668 4373 1 12 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.819 -0.482 19668 4374 1 12 . 1 1 55 55 GLU H H 55 7.904 7.904 7.524 0.380 19668 4375 1 12 . 1 1 56 56 GLU N N 56 120.258 120.258 118.481 1.777 19668 4376 1 12 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.056 0.044 19668 4377 1 12 . 1 1 56 56 GLU C C 56 179.867 179.867 178.923 0.944 19668 4378 1 12 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.786 0.876 19668 4379 1 12 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.248 0.802 19668 4380 1 12 . 1 1 56 56 GLU H H 56 7.902 7.902 7.641 0.261 19668 4381 1 12 . 1 1 57 57 VAL N N 57 121.168 121.168 120.856 0.312 19668 4382 1 12 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.459 0.109 19668 4383 1 12 . 1 1 57 57 VAL C C 57 176.994 176.994 176.752 0.242 19668 4384 1 12 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.880 1.016 19668 4385 1 12 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.970 -0.443 19668 4386 1 12 . 1 1 57 57 VAL H H 57 8.613 8.613 7.447 1.166 19668 4387 1 12 . 1 1 58 58 LYS N N 58 120.234 120.234 118.371 1.863 19668 4388 1 12 . 1 1 58 58 LYS HA H 58 4.202 4.202 4.014 0.188 19668 4389 1 12 . 1 1 58 58 LYS C C 58 179.131 179.131 178.174 0.957 19668 4390 1 12 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.353 0.234 19668 4391 1 12 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.619 0.672 19668 4392 1 12 . 1 1 58 58 LYS H H 58 7.810 7.810 7.605 0.205 19668 4393 1 12 . 1 1 59 59 LYS N N 59 118.301 118.301 118.340 -0.039 19668 4394 1 12 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.098 -0.005 19668 4395 1 12 . 1 1 59 59 LYS C C 59 179.281 179.281 178.335 0.946 19668 4396 1 12 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.112 1.316 19668 4397 1 12 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.279 1.099 19668 4398 1 12 . 1 1 59 59 LYS H H 59 7.876 7.876 7.336 0.540 19668 4399 1 12 . 1 1 60 60 LEU N N 60 121.224 121.224 120.554 0.670 19668 4400 1 12 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.059 0.175 19668 4401 1 12 . 1 1 60 60 LEU C C 60 178.636 178.636 178.817 -0.181 19668 4402 1 12 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.864 0.293 19668 4403 1 12 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.280 0.354 19668 4404 1 12 . 1 1 60 60 LEU H H 60 7.893 7.893 7.527 0.366 19668 4405 1 12 . 1 1 61 61 GLU N N 61 118.660 118.660 117.956 0.704 19668 4406 1 12 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.056 -0.257 19668 4407 1 12 . 1 1 61 61 GLU C C 61 179.094 179.094 178.793 0.301 19668 4408 1 12 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.264 1.008 19668 4409 1 12 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.808 1.195 19668 4410 1 12 . 1 1 61 61 GLU H H 61 8.644 8.644 7.814 0.830 19668 4411 1 12 . 1 1 62 62 GLU N N 62 117.555 117.555 119.669 -2.114 19668 4412 1 12 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.021 -0.025 19668 4413 1 12 . 1 1 62 62 GLU C C 62 178.940 178.940 179.096 -0.156 19668 4414 1 12 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.438 -0.270 19668 4415 1 12 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.326 0.221 19668 4416 1 12 . 1 1 62 62 GLU H H 62 7.995 7.995 7.554 0.441 19668 4417 1 12 . 1 1 63 63 GLU N N 63 119.097 119.097 118.268 0.829 19668 4418 1 12 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.145 -0.116 19668 4419 1 12 . 1 1 63 63 GLU C C 63 179.890 179.890 179.043 0.847 19668 4420 1 12 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.685 0.656 19668 4421 1 12 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.023 0.643 19668 4422 1 12 . 1 1 63 63 GLU H H 63 7.983 7.983 7.745 0.238 19668 4423 1 12 . 1 1 64 64 ILE N N 64 118.247 118.247 119.172 -0.925 19668 4424 1 12 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.787 -0.067 19668 4425 1 12 . 1 1 64 64 ILE C C 64 177.858 177.858 178.257 -0.399 19668 4426 1 12 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.448 0.048 19668 4427 1 12 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.611 0.369 19668 4428 1 12 . 1 1 64 64 ILE H H 64 8.261 8.261 7.287 0.974 19668 4429 1 12 . 1 1 65 65 LYS N N 65 118.693 118.693 119.019 -0.326 19668 4430 1 12 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.149 -0.051 19668 4431 1 12 . 1 1 65 65 LYS C C 65 177.244 177.244 178.009 -0.765 19668 4432 1 12 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.734 -0.081 19668 4433 1 12 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.209 0.496 19668 4434 1 12 . 1 1 65 65 LYS H H 65 7.661 7.661 7.717 -0.056 19668 4435 1 12 . 1 1 66 66 LYS N N 66 116.933 116.933 117.388 -0.455 19668 4436 1 12 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.103 0.235 19668 4437 1 12 . 1 1 66 66 LYS C C 66 176.011 176.011 177.405 -1.394 19668 4438 1 12 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.206 -1.747 19668 4439 1 12 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.996 0.135 19668 4440 1 12 . 1 1 66 66 LYS H H 66 7.261 7.261 7.546 -0.285 19668 4441 1 13 . 1 1 2 2 SER HA H 2 4.560 4.560 4.401 0.159 19668 4442 1 13 . 1 1 2 2 SER CA C 2 58.366 58.366 58.048 0.318 19668 4443 1 13 . 1 1 3 3 ARG N N 3 125.213 125.213 121.326 3.887 19668 4444 1 13 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.427 -0.161 19668 4445 1 13 . 1 1 3 3 ARG C C 3 178.381 178.381 177.819 0.562 19668 4446 1 13 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.870 0.526 19668 4447 1 13 . 1 1 3 3 ARG CB C 3 30.655 30.655 30.051 0.604 19668 4448 1 13 . 1 1 3 3 ARG H H 3 8.874 8.874 8.404 0.470 19668 4449 1 13 . 1 1 4 4 VAL N N 4 119.320 119.320 121.045 -1.725 19668 4450 1 13 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.870 -0.072 19668 4451 1 13 . 1 1 4 4 VAL C C 4 177.004 177.004 177.694 -0.690 19668 4452 1 13 . 1 1 4 4 VAL CA C 4 65.515 65.515 64.948 0.567 19668 4453 1 13 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.188 0.615 19668 4454 1 13 . 1 1 4 4 VAL H H 4 8.112 8.112 8.037 0.075 19668 4455 1 13 . 1 1 5 5 LYS N N 5 122.279 122.279 120.707 1.572 19668 4456 1 13 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.077 0.085 19668 4457 1 13 . 1 1 5 5 LYS C C 5 178.547 178.547 178.012 0.535 19668 4458 1 13 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.885 -0.127 19668 4459 1 13 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.792 0.218 19668 4460 1 13 . 1 1 5 5 LYS H H 5 7.847 7.847 8.338 -0.491 19668 4461 1 13 . 1 1 6 6 ALA N N 6 120.295 120.295 121.016 -0.721 19668 4462 1 13 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.053 0.158 19668 4463 1 13 . 1 1 6 6 ALA C C 6 180.834 180.834 179.247 1.587 19668 4464 1 13 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.877 0.026 19668 4465 1 13 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.082 0.050 19668 4466 1 13 . 1 1 6 6 ALA H H 6 7.975 7.975 7.762 0.213 19668 4467 1 13 . 1 1 7 7 LEU N N 7 119.570 119.570 118.296 1.274 19668 4468 1 13 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.054 0.118 19668 4469 1 13 . 1 1 7 7 LEU C C 7 178.431 178.431 178.668 -0.237 19668 4470 1 13 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.786 -0.107 19668 4471 1 13 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.154 0.881 19668 4472 1 13 . 1 1 7 7 LEU H H 7 7.650 7.650 7.678 -0.028 19668 4473 1 13 . 1 1 8 8 GLU N N 8 119.934 119.934 118.379 1.555 19668 4474 1 13 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.033 -0.174 19668 4475 1 13 . 1 1 8 8 GLU C C 8 179.534 179.534 178.296 1.238 19668 4476 1 13 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.248 0.789 19668 4477 1 13 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.570 0.897 19668 4478 1 13 . 1 1 8 8 GLU H H 8 8.411 8.411 7.844 0.567 19668 4479 1 13 . 1 1 9 9 GLU N N 9 118.234 118.234 118.995 -0.761 19668 4480 1 13 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.087 -0.027 19668 4481 1 13 . 1 1 9 9 GLU C C 9 179.596 179.596 178.970 0.626 19668 4482 1 13 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.206 0.124 19668 4483 1 13 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.271 0.147 19668 4484 1 13 . 1 1 9 9 GLU H H 9 8.206 8.206 7.744 0.462 19668 4485 1 13 . 1 1 10 10 LYS N N 10 121.042 121.042 119.100 1.942 19668 4486 1 13 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.154 0.029 19668 4487 1 13 . 1 1 10 10 LYS C C 10 179.380 179.380 179.104 0.276 19668 4488 1 13 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.129 0.196 19668 4489 1 13 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.109 0.300 19668 4490 1 13 . 1 1 10 10 LYS H H 10 7.931 7.931 7.557 0.374 19668 4491 1 13 . 1 1 11 11 VAL N N 11 118.662 118.662 120.288 -1.626 19668 4492 1 13 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.791 0.023 19668 4493 1 13 . 1 1 11 11 VAL C C 11 178.845 178.845 178.057 0.788 19668 4494 1 13 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.460 0.528 19668 4495 1 13 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.621 0.033 19668 4496 1 13 . 1 1 11 11 VAL H H 11 8.371 8.371 7.578 0.793 19668 4497 1 13 . 1 1 12 12 LYS N N 12 123.188 123.188 119.348 3.840 19668 4498 1 13 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.885 0.341 19668 4499 1 13 . 1 1 12 12 LYS C C 12 179.098 179.098 178.445 0.653 19668 4500 1 13 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.339 0.145 19668 4501 1 13 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.340 -0.134 19668 4502 1 13 . 1 1 12 12 LYS H H 12 8.276 8.276 7.467 0.809 19668 4503 1 13 . 1 1 13 13 ALA N N 13 121.169 121.169 121.510 -0.341 19668 4504 1 13 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.059 0.199 19668 4505 1 13 . 1 1 13 13 ALA C C 13 180.169 180.169 179.748 0.421 19668 4506 1 13 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.755 -0.119 19668 4507 1 13 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.230 -0.123 19668 4508 1 13 . 1 1 13 13 ALA H H 13 7.829 7.829 7.434 0.395 19668 4509 1 13 . 1 1 14 14 LEU N N 14 118.104 118.104 118.249 -0.145 19668 4510 1 13 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.014 0.142 19668 4511 1 13 . 1 1 14 14 LEU C C 14 177.614 177.614 177.857 -0.243 19668 4512 1 13 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.108 -0.503 19668 4513 1 13 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.932 0.863 19668 4514 1 13 . 1 1 14 14 LEU H H 14 7.781 7.781 7.406 0.375 19668 4515 1 13 . 1 1 15 15 GLU N N 15 120.632 120.632 118.772 1.860 19668 4516 1 13 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.377 -0.010 19668 4517 1 13 . 1 1 15 15 GLU C C 15 178.243 178.243 178.483 -0.240 19668 4518 1 13 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.582 1.004 19668 4519 1 13 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.180 0.649 19668 4520 1 13 . 1 1 15 15 GLU H H 15 7.873 7.873 7.291 0.582 19668 4521 1 13 . 1 1 16 16 GLU N N 16 115.775 115.775 117.161 -1.386 19668 4522 1 13 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.994 -0.035 19668 4523 1 13 . 1 1 16 16 GLU C C 16 179.006 179.006 178.567 0.439 19668 4524 1 13 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.238 -0.146 19668 4525 1 13 . 1 1 16 16 GLU CB C 16 29.353 29.353 28.972 0.381 19668 4526 1 13 . 1 1 16 16 GLU H H 16 7.926 7.926 7.803 0.123 19668 4527 1 13 . 1 1 17 17 LYS N N 17 118.801 118.801 119.305 -0.504 19668 4528 1 13 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.069 0.025 19668 4529 1 13 . 1 1 17 17 LYS C C 17 178.853 178.853 178.641 0.212 19668 4530 1 13 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.626 -0.154 19668 4531 1 13 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.929 0.433 19668 4532 1 13 . 1 1 17 17 LYS H H 17 7.518 7.518 7.508 0.010 19668 4533 1 13 . 1 1 18 18 VAL N N 18 118.034 118.034 120.178 -2.144 19668 4534 1 13 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.623 -0.111 19668 4535 1 13 . 1 1 18 18 VAL C C 18 178.362 178.362 177.620 0.742 19668 4536 1 13 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.563 -0.544 19668 4537 1 13 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.593 0.056 19668 4538 1 13 . 1 1 18 18 VAL H H 18 8.048 8.048 7.433 0.615 19668 4539 1 13 . 1 1 19 19 LYS N N 19 118.427 118.427 117.196 1.231 19668 4540 1 13 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.065 -0.055 19668 4541 1 13 . 1 1 19 19 LYS C C 19 177.706 177.706 177.207 0.499 19668 4542 1 13 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.593 0.392 19668 4543 1 13 . 1 1 19 19 LYS CB C 19 32.424 32.424 32.001 0.423 19668 4544 1 13 . 1 1 19 19 LYS H H 19 8.008 8.008 7.432 0.576 19668 4545 1 13 . 1 1 20 20 ALA N N 20 119.177 119.177 119.700 -0.523 19668 4546 1 13 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.393 -0.077 19668 4547 1 13 . 1 1 20 20 ALA C C 20 178.269 178.269 178.843 -0.574 19668 4548 1 13 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.871 -0.240 19668 4549 1 13 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.212 -0.079 19668 4550 1 13 . 1 1 20 20 ALA H H 20 7.259 7.259 7.523 -0.264 19668 4551 1 13 . 1 1 21 21 LEU N N 21 118.596 118.596 116.125 2.471 19668 4552 1 13 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.275 -0.014 19668 4553 1 13 . 1 1 21 21 LEU C C 21 177.732 177.732 177.353 0.379 19668 4554 1 13 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.125 -0.468 19668 4555 1 13 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.560 0.573 19668 4556 1 13 . 1 1 21 21 LEU H H 21 7.373 7.373 7.290 0.083 19668 4557 1 13 . 1 1 22 22 GLY N N 22 107.926 107.926 104.939 2.987 19668 4558 1 13 . 1 1 22 22 GLY C C 22 173.362 173.362 172.192 1.170 19668 4559 1 13 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.140 0.057 19668 4560 1 13 . 1 1 22 22 GLY H H 22 8.144 8.144 7.450 0.694 19668 4561 1 13 . 1 1 23 23 GLY N N 23 108.242 108.242 105.808 2.434 19668 4562 1 13 . 1 1 23 23 GLY C C 23 174.110 174.110 173.269 0.841 19668 4563 1 13 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.628 -0.944 19668 4564 1 13 . 1 1 23 23 GLY H H 23 8.157 8.157 8.078 0.079 19668 4565 1 13 . 1 1 24 24 GLY N N 24 106.969 106.969 109.855 -2.886 19668 4566 1 13 . 1 1 24 24 GLY C C 24 175.172 175.172 174.129 1.043 19668 4567 1 13 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.780 -1.341 19668 4568 1 13 . 1 1 24 24 GLY H H 24 8.466 8.466 7.784 0.682 19668 4569 1 13 . 1 1 25 25 GLY N N 25 108.946 108.946 107.368 1.578 19668 4570 1 13 . 1 1 25 25 GLY C C 25 176.321 176.321 176.118 0.203 19668 4571 1 13 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.270 0.829 19668 4572 1 13 . 1 1 25 25 GLY H H 25 8.618 8.618 8.422 0.196 19668 4573 1 13 . 1 1 26 26 ARG N N 26 123.559 123.559 120.968 2.591 19668 4574 1 13 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.607 -0.328 19668 4575 1 13 . 1 1 26 26 ARG C C 26 178.076 178.076 178.196 -0.120 19668 4576 1 13 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.678 -0.763 19668 4577 1 13 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.279 -0.369 19668 4578 1 13 . 1 1 26 26 ARG H H 26 8.789 8.789 8.285 0.504 19668 4579 1 13 . 1 1 27 27 ILE N N 27 118.726 118.726 119.101 -0.375 19668 4580 1 13 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.895 -0.109 19668 4581 1 13 . 1 1 27 27 ILE C C 27 177.639 177.639 178.429 -0.790 19668 4582 1 13 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.398 0.226 19668 4583 1 13 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.531 0.424 19668 4584 1 13 . 1 1 27 27 ILE H H 27 7.762 7.762 8.030 -0.268 19668 4585 1 13 . 1 1 28 28 GLU N N 28 119.843 119.843 118.498 1.345 19668 4586 1 13 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.005 0.008 19668 4587 1 13 . 1 1 28 28 GLU C C 28 179.447 179.447 179.151 0.296 19668 4588 1 13 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.264 0.319 19668 4589 1 13 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.155 -0.095 19668 4590 1 13 . 1 1 28 28 GLU H H 28 7.867 7.867 8.094 -0.227 19668 4591 1 13 . 1 1 29 29 GLU N N 29 118.447 118.447 119.222 -0.775 19668 4592 1 13 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.087 0.000 19668 4593 1 13 . 1 1 29 29 GLU C C 29 179.310 179.310 178.860 0.450 19668 4594 1 13 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.605 0.675 19668 4595 1 13 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.026 0.310 19668 4596 1 13 . 1 1 29 29 GLU H H 29 7.755 7.755 7.664 0.091 19668 4597 1 13 . 1 1 30 30 LEU N N 30 121.135 121.135 121.518 -0.383 19668 4598 1 13 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.990 0.106 19668 4599 1 13 . 1 1 30 30 LEU C C 30 178.928 178.928 178.757 0.171 19668 4600 1 13 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.188 -0.083 19668 4601 1 13 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.102 -0.422 19668 4602 1 13 . 1 1 30 30 LEU H H 30 7.785 7.785 7.610 0.175 19668 4603 1 13 . 1 1 31 31 LYS N N 31 119.130 119.130 117.753 1.377 19668 4604 1 13 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.118 -0.248 19668 4605 1 13 . 1 1 31 31 LYS C C 31 179.104 179.104 178.995 0.109 19668 4606 1 13 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.434 1.282 19668 4607 1 13 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.853 0.403 19668 4608 1 13 . 1 1 31 31 LYS H H 31 8.413 8.413 7.645 0.768 19668 4609 1 13 . 1 1 32 32 LYS N N 32 119.200 119.200 119.717 -0.517 19668 4610 1 13 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.983 0.119 19668 4611 1 13 . 1 1 32 32 LYS C C 32 179.420 179.420 178.968 0.452 19668 4612 1 13 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.517 -0.060 19668 4613 1 13 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.213 0.053 19668 4614 1 13 . 1 1 32 32 LYS H H 32 7.826 7.826 7.560 0.266 19668 4615 1 13 . 1 1 33 33 LYS N N 33 120.322 120.322 119.430 0.892 19668 4616 1 13 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.060 0.103 19668 4617 1 13 . 1 1 33 33 LYS C C 33 179.174 179.174 178.700 0.474 19668 4618 1 13 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.036 -0.288 19668 4619 1 13 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.228 -0.489 19668 4620 1 13 . 1 1 33 33 LYS H H 33 8.003 8.003 7.460 0.543 19668 4621 1 13 . 1 1 34 34 TYR N N 34 120.223 120.223 119.646 0.577 19668 4622 1 13 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.114 -0.058 19668 4623 1 13 . 1 1 34 34 TYR C C 34 176.356 176.356 178.083 -1.727 19668 4624 1 13 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.376 -0.321 19668 4625 1 13 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.266 -0.239 19668 4626 1 13 . 1 1 34 34 TYR H H 34 8.614 8.614 7.554 1.060 19668 4627 1 13 . 1 1 35 35 GLU N N 35 118.813 118.813 117.158 1.655 19668 4628 1 13 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.940 -0.215 19668 4629 1 13 . 1 1 35 35 GLU C C 35 179.787 179.787 178.830 0.957 19668 4630 1 13 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.044 -0.605 19668 4631 1 13 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.071 0.057 19668 4632 1 13 . 1 1 35 35 GLU H H 35 8.103 8.103 7.862 0.241 19668 4633 1 13 . 1 1 36 36 GLU N N 36 119.670 119.670 119.719 -0.049 19668 4634 1 13 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.105 -0.091 19668 4635 1 13 . 1 1 36 36 GLU C C 36 179.295 179.295 179.118 0.177 19668 4636 1 13 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.316 -0.053 19668 4637 1 13 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.386 0.183 19668 4638 1 13 . 1 1 36 36 GLU H H 36 8.028 8.028 7.671 0.357 19668 4639 1 13 . 1 1 37 37 LEU N N 37 121.416 121.416 117.803 3.613 19668 4640 1 13 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.975 0.044 19668 4641 1 13 . 1 1 37 37 LEU C C 37 178.277 178.277 178.845 -0.568 19668 4642 1 13 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.640 0.200 19668 4643 1 13 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.723 -0.094 19668 4644 1 13 . 1 1 37 37 LEU H H 37 8.176 8.176 7.397 0.779 19668 4645 1 13 . 1 1 38 38 LYS N N 38 118.998 118.998 118.537 0.461 19668 4646 1 13 . 1 1 38 38 LYS HA H 38 3.660 3.660 4.023 -0.363 19668 4647 1 13 . 1 1 38 38 LYS C C 38 178.923 178.923 178.671 0.252 19668 4648 1 13 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.863 0.537 19668 4649 1 13 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.039 0.023 19668 4650 1 13 . 1 1 38 38 LYS H H 38 8.260 8.260 7.479 0.781 19668 4651 1 13 . 1 1 39 39 LYS N N 39 118.070 118.070 119.189 -1.119 19668 4652 1 13 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.028 0.052 19668 4653 1 13 . 1 1 39 39 LYS C C 39 178.687 178.687 178.866 -0.179 19668 4654 1 13 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.654 -0.718 19668 4655 1 13 . 1 1 39 39 LYS CB C 39 32.149 32.149 31.987 0.162 19668 4656 1 13 . 1 1 39 39 LYS H H 39 7.380 7.380 7.747 -0.367 19668 4657 1 13 . 1 1 40 40 LYS N N 40 118.894 118.894 119.477 -0.583 19668 4658 1 13 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.442 -0.383 19668 4659 1 13 . 1 1 40 40 LYS C C 40 179.758 179.758 178.902 0.856 19668 4660 1 13 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.511 -0.449 19668 4661 1 13 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.467 -0.079 19668 4662 1 13 . 1 1 40 40 LYS H H 40 7.919 7.919 7.471 0.448 19668 4663 1 13 . 1 1 41 41 ILE N N 41 118.270 118.270 116.015 2.255 19668 4664 1 13 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.891 -0.194 19668 4665 1 13 . 1 1 41 41 ILE C C 41 178.211 178.211 177.490 0.721 19668 4666 1 13 . 1 1 41 41 ILE CA C 41 64.714 64.714 63.718 0.996 19668 4667 1 13 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.827 0.012 19668 4668 1 13 . 1 1 41 41 ILE H H 41 8.199 8.199 7.403 0.796 19668 4669 1 13 . 1 1 42 42 GLU N N 42 120.117 120.117 117.865 2.252 19668 4670 1 13 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.063 0.028 19668 4671 1 13 . 1 1 42 42 GLU C C 42 178.736 178.736 177.488 1.248 19668 4672 1 13 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.818 0.062 19668 4673 1 13 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.154 -0.763 19668 4674 1 13 . 1 1 42 42 GLU H H 42 7.738 7.738 7.620 0.118 19668 4675 1 13 . 1 1 43 43 GLU N N 43 117.194 117.194 116.308 0.886 19668 4676 1 13 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.190 0.109 19668 4677 1 13 . 1 1 43 43 GLU C C 43 177.658 177.658 177.494 0.164 19668 4678 1 13 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.866 -0.073 19668 4679 1 13 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.991 -0.057 19668 4680 1 13 . 1 1 43 43 GLU H H 43 7.698 7.698 7.560 0.138 19668 4681 1 13 . 1 1 44 44 LEU N N 44 120.812 120.812 122.611 -1.799 19668 4682 1 13 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.093 0.146 19668 4683 1 13 . 1 1 44 44 LEU C C 44 178.682 178.682 177.210 1.472 19668 4684 1 13 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.342 1.154 19668 4685 1 13 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.547 1.100 19668 4686 1 13 . 1 1 44 44 LEU H H 44 7.593 7.593 7.422 0.171 19668 4687 1 13 . 1 1 45 45 GLY N N 45 108.681 108.681 111.995 -3.314 19668 4688 1 13 . 1 1 45 45 GLY C C 45 174.957 174.957 173.702 1.255 19668 4689 1 13 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.944 0.142 19668 4690 1 13 . 1 1 45 45 GLY H H 45 8.234 8.234 7.920 0.314 19668 4691 1 13 . 1 1 46 46 GLY N N 46 108.057 108.057 107.313 0.744 19668 4692 1 13 . 1 1 46 46 GLY C C 46 174.777 174.777 173.702 1.075 19668 4693 1 13 . 1 1 46 46 GLY CA C 46 45.364 45.364 43.942 1.422 19668 4694 1 13 . 1 1 46 46 GLY H H 46 8.182 8.182 7.756 0.426 19668 4695 1 13 . 1 1 47 47 GLY N N 47 108.494 108.494 106.011 2.483 19668 4696 1 13 . 1 1 47 47 GLY C C 47 174.572 174.572 174.791 -0.219 19668 4697 1 13 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.740 0.415 19668 4698 1 13 . 1 1 47 47 GLY H H 47 8.087 8.087 8.232 -0.145 19668 4699 1 13 . 1 1 48 48 GLY N N 48 108.285 108.285 110.003 -1.718 19668 4700 1 13 . 1 1 48 48 GLY C C 48 174.495 174.495 175.596 -1.101 19668 4701 1 13 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.375 0.079 19668 4702 1 13 . 1 1 48 48 GLY H H 48 8.323 8.323 8.256 0.067 19668 4703 1 13 . 1 1 49 49 GLU N N 49 121.070 121.070 123.647 -2.577 19668 4704 1 13 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.326 0.091 19668 4705 1 13 . 1 1 49 49 GLU C C 49 177.226 177.226 178.035 -0.809 19668 4706 1 13 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.281 -0.710 19668 4707 1 13 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.543 0.123 19668 4708 1 13 . 1 1 49 49 GLU H H 49 8.483 8.483 8.549 -0.066 19668 4709 1 13 . 1 1 50 50 VAL N N 50 121.794 121.794 116.116 5.678 19668 4710 1 13 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.783 -0.002 19668 4711 1 13 . 1 1 50 50 VAL C C 50 176.860 176.860 177.527 -0.667 19668 4712 1 13 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.532 -0.452 19668 4713 1 13 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.122 1.131 19668 4714 1 13 . 1 1 50 50 VAL H H 50 8.068 8.068 8.157 -0.089 19668 4715 1 13 . 1 1 51 51 LYS N N 51 120.593 120.593 118.457 2.136 19668 4716 1 13 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.170 0.037 19668 4717 1 13 . 1 1 51 51 LYS C C 51 178.667 178.667 178.952 -0.285 19668 4718 1 13 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.366 0.969 19668 4719 1 13 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.634 0.625 19668 4720 1 13 . 1 1 51 51 LYS H H 51 8.253 8.253 7.610 0.643 19668 4721 1 13 . 1 1 52 52 LYS N N 52 117.572 117.572 119.590 -2.018 19668 4722 1 13 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.096 0.072 19668 4723 1 13 . 1 1 52 52 LYS C C 52 179.248 179.248 178.944 0.304 19668 4724 1 13 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.157 -0.143 19668 4725 1 13 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.282 -0.102 19668 4726 1 13 . 1 1 52 52 LYS H H 52 7.629 7.629 7.603 0.026 19668 4727 1 13 . 1 1 53 53 VAL N N 53 119.059 119.059 118.501 0.558 19668 4728 1 13 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.713 0.079 19668 4729 1 13 . 1 1 53 53 VAL C C 53 177.987 177.987 177.891 0.096 19668 4730 1 13 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.113 0.918 19668 4731 1 13 . 1 1 53 53 VAL CB C 53 31.371 31.371 30.733 0.638 19668 4732 1 13 . 1 1 53 53 VAL H H 53 7.638 7.638 7.462 0.176 19668 4733 1 13 . 1 1 54 54 GLU N N 54 120.388 120.388 119.511 0.877 19668 4734 1 13 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.939 -0.095 19668 4735 1 13 . 1 1 54 54 GLU C C 54 179.624 179.624 178.976 0.648 19668 4736 1 13 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.967 0.274 19668 4737 1 13 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.426 0.392 19668 4738 1 13 . 1 1 54 54 GLU H H 54 8.603 8.603 7.663 0.940 19668 4739 1 13 . 1 1 55 55 GLU N N 55 118.533 118.533 118.304 0.229 19668 4740 1 13 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.053 0.036 19668 4741 1 13 . 1 1 55 55 GLU C C 55 179.158 179.158 178.955 0.203 19668 4742 1 13 . 1 1 55 55 GLU CA C 55 59.334 59.334 58.938 0.396 19668 4743 1 13 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.108 0.229 19668 4744 1 13 . 1 1 55 55 GLU H H 55 7.904 7.904 7.682 0.222 19668 4745 1 13 . 1 1 56 56 GLU N N 56 120.258 120.258 120.154 0.104 19668 4746 1 13 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.030 0.070 19668 4747 1 13 . 1 1 56 56 GLU C C 56 179.867 179.867 179.103 0.764 19668 4748 1 13 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.984 0.679 19668 4749 1 13 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.401 0.649 19668 4750 1 13 . 1 1 56 56 GLU H H 56 7.902 7.902 7.471 0.431 19668 4751 1 13 . 1 1 57 57 VAL N N 57 121.168 121.168 120.136 1.032 19668 4752 1 13 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.569 -0.001 19668 4753 1 13 . 1 1 57 57 VAL C C 57 176.994 176.994 177.377 -0.383 19668 4754 1 13 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.714 2.182 19668 4755 1 13 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.451 0.076 19668 4756 1 13 . 1 1 57 57 VAL H H 57 8.613 8.613 7.528 1.085 19668 4757 1 13 . 1 1 58 58 LYS N N 58 120.234 120.234 118.215 2.019 19668 4758 1 13 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.970 0.232 19668 4759 1 13 . 1 1 58 58 LYS C C 58 179.131 179.131 178.620 0.511 19668 4760 1 13 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.683 -0.096 19668 4761 1 13 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.139 0.152 19668 4762 1 13 . 1 1 58 58 LYS H H 58 7.810 7.810 7.519 0.291 19668 4763 1 13 . 1 1 59 59 LYS N N 59 118.301 118.301 118.069 0.232 19668 4764 1 13 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.094 -0.001 19668 4765 1 13 . 1 1 59 59 LYS C C 59 179.281 179.281 178.453 0.828 19668 4766 1 13 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.051 1.377 19668 4767 1 13 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.519 0.860 19668 4768 1 13 . 1 1 59 59 LYS H H 59 7.876 7.876 7.392 0.484 19668 4769 1 13 . 1 1 60 60 LEU N N 60 121.224 121.224 120.399 0.825 19668 4770 1 13 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.000 0.234 19668 4771 1 13 . 1 1 60 60 LEU C C 60 178.636 178.636 178.805 -0.169 19668 4772 1 13 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.944 0.213 19668 4773 1 13 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.242 0.392 19668 4774 1 13 . 1 1 60 60 LEU H H 60 7.893 7.893 7.676 0.217 19668 4775 1 13 . 1 1 61 61 GLU N N 61 118.660 118.660 117.879 0.781 19668 4776 1 13 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.045 -0.246 19668 4777 1 13 . 1 1 61 61 GLU C C 61 179.094 179.094 178.751 0.343 19668 4778 1 13 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.085 1.187 19668 4779 1 13 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.735 1.268 19668 4780 1 13 . 1 1 61 61 GLU H H 61 8.644 8.644 7.778 0.866 19668 4781 1 13 . 1 1 62 62 GLU N N 62 117.555 117.555 119.848 -2.293 19668 4782 1 13 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.004 -0.008 19668 4783 1 13 . 1 1 62 62 GLU C C 62 178.940 178.940 179.078 -0.138 19668 4784 1 13 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.352 -0.184 19668 4785 1 13 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.281 0.266 19668 4786 1 13 . 1 1 62 62 GLU H H 62 7.995 7.995 7.526 0.469 19668 4787 1 13 . 1 1 63 63 GLU N N 63 119.097 119.097 118.285 0.812 19668 4788 1 13 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.116 -0.087 19668 4789 1 13 . 1 1 63 63 GLU C C 63 179.890 179.890 179.124 0.766 19668 4790 1 13 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.846 0.494 19668 4791 1 13 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.000 0.667 19668 4792 1 13 . 1 1 63 63 GLU H H 63 7.983 7.983 7.717 0.266 19668 4793 1 13 . 1 1 64 64 ILE N N 64 118.247 118.247 117.851 0.396 19668 4794 1 13 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.893 -0.173 19668 4795 1 13 . 1 1 64 64 ILE C C 64 177.858 177.858 177.483 0.375 19668 4796 1 13 . 1 1 64 64 ILE CA C 64 64.496 64.496 63.969 0.527 19668 4797 1 13 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.463 0.518 19668 4798 1 13 . 1 1 64 64 ILE H H 64 8.261 8.261 7.230 1.031 19668 4799 1 13 . 1 1 65 65 LYS N N 65 118.693 118.693 118.094 0.599 19668 4800 1 13 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.187 -0.089 19668 4801 1 13 . 1 1 65 65 LYS C C 65 177.244 177.244 177.862 -0.618 19668 4802 1 13 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.651 1.002 19668 4803 1 13 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.297 0.408 19668 4804 1 13 . 1 1 65 65 LYS H H 65 7.661 7.661 7.593 0.068 19668 4805 1 13 . 1 1 66 66 LYS N N 66 116.933 116.933 117.591 -0.658 19668 4806 1 13 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.104 0.234 19668 4807 1 13 . 1 1 66 66 LYS C C 66 176.011 176.011 177.402 -1.391 19668 4808 1 13 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.033 -1.574 19668 4809 1 13 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.893 0.238 19668 4810 1 13 . 1 1 66 66 LYS H H 66 7.261 7.261 7.545 -0.284 19668 4811 1 14 . 1 1 2 2 SER HA H 2 4.560 4.560 4.601 -0.041 19668 4812 1 14 . 1 1 2 2 SER CA C 2 58.366 58.366 60.176 -1.810 19668 4813 1 14 . 1 1 3 3 ARG N N 3 125.213 125.213 120.150 5.063 19668 4814 1 14 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.414 -0.148 19668 4815 1 14 . 1 1 3 3 ARG C C 3 178.381 178.381 177.733 0.648 19668 4816 1 14 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.566 0.829 19668 4817 1 14 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.698 0.957 19668 4818 1 14 . 1 1 3 3 ARG H H 3 8.874 8.874 8.269 0.605 19668 4819 1 14 . 1 1 4 4 VAL N N 4 119.320 119.320 120.085 -0.765 19668 4820 1 14 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.738 0.060 19668 4821 1 14 . 1 1 4 4 VAL C C 4 177.004 177.004 177.501 -0.497 19668 4822 1 14 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.590 -0.075 19668 4823 1 14 . 1 1 4 4 VAL CB C 4 31.803 31.803 30.929 0.874 19668 4824 1 14 . 1 1 4 4 VAL H H 4 8.112 8.112 8.263 -0.151 19668 4825 1 14 . 1 1 5 5 LYS N N 5 122.279 122.279 120.536 1.743 19668 4826 1 14 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.032 0.130 19668 4827 1 14 . 1 1 5 5 LYS C C 5 178.547 178.547 177.892 0.655 19668 4828 1 14 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.809 -0.051 19668 4829 1 14 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.625 0.385 19668 4830 1 14 . 1 1 5 5 LYS H H 5 7.847 7.847 8.172 -0.325 19668 4831 1 14 . 1 1 6 6 ALA N N 6 120.295 120.295 120.615 -0.320 19668 4832 1 14 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.057 0.154 19668 4833 1 14 . 1 1 6 6 ALA C C 6 180.834 180.834 179.249 1.585 19668 4834 1 14 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.853 0.050 19668 4835 1 14 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.034 0.098 19668 4836 1 14 . 1 1 6 6 ALA H H 6 7.975 7.975 7.859 0.116 19668 4837 1 14 . 1 1 7 7 LEU N N 7 119.570 119.570 118.295 1.275 19668 4838 1 14 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.042 0.130 19668 4839 1 14 . 1 1 7 7 LEU C C 7 178.431 178.431 178.638 -0.207 19668 4840 1 14 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.944 -0.265 19668 4841 1 14 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.201 0.834 19668 4842 1 14 . 1 1 7 7 LEU H H 7 7.650 7.650 7.672 -0.022 19668 4843 1 14 . 1 1 8 8 GLU N N 8 119.934 119.934 118.612 1.322 19668 4844 1 14 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.031 -0.172 19668 4845 1 14 . 1 1 8 8 GLU C C 8 179.534 179.534 178.461 1.073 19668 4846 1 14 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.178 0.859 19668 4847 1 14 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.890 0.577 19668 4848 1 14 . 1 1 8 8 GLU H H 8 8.411 8.411 7.866 0.545 19668 4849 1 14 . 1 1 9 9 GLU N N 9 118.234 118.234 119.552 -1.318 19668 4850 1 14 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.015 0.045 19668 4851 1 14 . 1 1 9 9 GLU C C 9 179.596 179.596 178.990 0.606 19668 4852 1 14 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.157 0.173 19668 4853 1 14 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.239 0.179 19668 4854 1 14 . 1 1 9 9 GLU H H 9 8.206 8.206 7.748 0.458 19668 4855 1 14 . 1 1 10 10 LYS N N 10 121.042 121.042 119.274 1.768 19668 4856 1 14 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.125 0.058 19668 4857 1 14 . 1 1 10 10 LYS C C 10 179.380 179.380 179.017 0.363 19668 4858 1 14 . 1 1 10 10 LYS CA C 10 59.325 59.325 58.950 0.375 19668 4859 1 14 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.182 0.227 19668 4860 1 14 . 1 1 10 10 LYS H H 10 7.931 7.931 7.561 0.370 19668 4861 1 14 . 1 1 11 11 VAL N N 11 118.662 118.662 120.017 -1.355 19668 4862 1 14 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.816 -0.002 19668 4863 1 14 . 1 1 11 11 VAL C C 11 178.845 178.845 178.092 0.753 19668 4864 1 14 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.183 0.805 19668 4865 1 14 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.677 -0.023 19668 4866 1 14 . 1 1 11 11 VAL H H 11 8.371 8.371 7.597 0.774 19668 4867 1 14 . 1 1 12 12 LYS N N 12 123.188 123.188 119.455 3.733 19668 4868 1 14 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.911 0.315 19668 4869 1 14 . 1 1 12 12 LYS C C 12 179.098 179.098 178.399 0.699 19668 4870 1 14 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.360 0.123 19668 4871 1 14 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.163 0.042 19668 4872 1 14 . 1 1 12 12 LYS H H 12 8.276 8.276 7.519 0.757 19668 4873 1 14 . 1 1 13 13 ALA N N 13 121.169 121.169 121.803 -0.634 19668 4874 1 14 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.043 0.215 19668 4875 1 14 . 1 1 13 13 ALA C C 13 180.169 180.169 179.400 0.769 19668 4876 1 14 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.859 -0.223 19668 4877 1 14 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.417 -0.310 19668 4878 1 14 . 1 1 13 13 ALA H H 13 7.829 7.829 7.418 0.411 19668 4879 1 14 . 1 1 14 14 LEU N N 14 118.104 118.104 118.189 -0.085 19668 4880 1 14 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.009 0.147 19668 4881 1 14 . 1 1 14 14 LEU C C 14 177.614 177.614 177.957 -0.343 19668 4882 1 14 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.179 -0.574 19668 4883 1 14 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.950 0.845 19668 4884 1 14 . 1 1 14 14 LEU H H 14 7.781 7.781 7.387 0.394 19668 4885 1 14 . 1 1 15 15 GLU N N 15 120.632 120.632 118.953 1.679 19668 4886 1 14 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.391 -0.024 19668 4887 1 14 . 1 1 15 15 GLU C C 15 178.243 178.243 178.637 -0.394 19668 4888 1 14 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.497 1.089 19668 4889 1 14 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.933 0.896 19668 4890 1 14 . 1 1 15 15 GLU H H 15 7.873 7.873 7.247 0.626 19668 4891 1 14 . 1 1 16 16 GLU N N 16 115.775 115.775 116.992 -1.217 19668 4892 1 14 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.017 -0.058 19668 4893 1 14 . 1 1 16 16 GLU C C 16 179.006 179.006 178.664 0.342 19668 4894 1 14 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.992 0.100 19668 4895 1 14 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.380 -0.027 19668 4896 1 14 . 1 1 16 16 GLU H H 16 7.926 7.926 7.697 0.229 19668 4897 1 14 . 1 1 17 17 LYS N N 17 118.801 118.801 119.436 -0.635 19668 4898 1 14 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.111 -0.017 19668 4899 1 14 . 1 1 17 17 LYS C C 17 178.853 178.853 178.690 0.163 19668 4900 1 14 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.816 -0.345 19668 4901 1 14 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.826 0.536 19668 4902 1 14 . 1 1 17 17 LYS H H 17 7.518 7.518 7.364 0.154 19668 4903 1 14 . 1 1 18 18 VAL N N 18 118.034 118.034 120.053 -2.019 19668 4904 1 14 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.655 -0.143 19668 4905 1 14 . 1 1 18 18 VAL C C 18 178.362 178.362 177.777 0.585 19668 4906 1 14 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.059 -0.041 19668 4907 1 14 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.724 -0.074 19668 4908 1 14 . 1 1 18 18 VAL H H 18 8.048 8.048 7.431 0.617 19668 4909 1 14 . 1 1 19 19 LYS N N 19 118.427 118.427 117.207 1.220 19668 4910 1 14 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.127 -0.117 19668 4911 1 14 . 1 1 19 19 LYS C C 19 177.706 177.706 177.382 0.324 19668 4912 1 14 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.337 0.648 19668 4913 1 14 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.758 0.666 19668 4914 1 14 . 1 1 19 19 LYS H H 19 8.008 8.008 7.388 0.620 19668 4915 1 14 . 1 1 20 20 ALA N N 20 119.177 119.177 120.288 -1.111 19668 4916 1 14 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.261 0.055 19668 4917 1 14 . 1 1 20 20 ALA C C 20 178.269 178.269 179.317 -1.048 19668 4918 1 14 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.898 -1.267 19668 4919 1 14 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.782 0.351 19668 4920 1 14 . 1 1 20 20 ALA H H 20 7.259 7.259 7.449 -0.190 19668 4921 1 14 . 1 1 21 21 LEU N N 21 118.596 118.596 114.604 3.992 19668 4922 1 14 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.204 0.057 19668 4923 1 14 . 1 1 21 21 LEU C C 21 177.732 177.732 177.135 0.597 19668 4924 1 14 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.866 -0.209 19668 4925 1 14 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.197 0.936 19668 4926 1 14 . 1 1 21 21 LEU H H 21 7.373 7.373 7.360 0.013 19668 4927 1 14 . 1 1 22 22 GLY N N 22 107.926 107.926 104.579 3.347 19668 4928 1 14 . 1 1 22 22 GLY C C 22 173.362 173.362 172.419 0.943 19668 4929 1 14 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.313 0.884 19668 4930 1 14 . 1 1 22 22 GLY H H 22 8.144 8.144 7.256 0.888 19668 4931 1 14 . 1 1 23 23 GLY N N 23 108.242 108.242 105.663 2.579 19668 4932 1 14 . 1 1 23 23 GLY C C 23 174.110 174.110 172.512 1.598 19668 4933 1 14 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.752 -0.068 19668 4934 1 14 . 1 1 23 23 GLY H H 23 8.157 8.157 8.099 0.058 19668 4935 1 14 . 1 1 24 24 GLY N N 24 106.969 106.969 109.880 -2.911 19668 4936 1 14 . 1 1 24 24 GLY C C 24 175.172 175.172 174.696 0.476 19668 4937 1 14 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.151 -0.712 19668 4938 1 14 . 1 1 24 24 GLY H H 24 8.466 8.466 8.414 0.052 19668 4939 1 14 . 1 1 25 25 GLY N N 25 108.946 108.946 113.504 -4.558 19668 4940 1 14 . 1 1 25 25 GLY C C 25 176.321 176.321 174.840 1.481 19668 4941 1 14 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.186 1.913 19668 4942 1 14 . 1 1 25 25 GLY H H 25 8.618 8.618 7.975 0.643 19668 4943 1 14 . 1 1 26 26 ARG N N 26 123.559 123.559 124.408 -0.849 19668 4944 1 14 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.401 -0.121 19668 4945 1 14 . 1 1 26 26 ARG C C 26 178.076 178.076 178.646 -0.570 19668 4946 1 14 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.522 -0.607 19668 4947 1 14 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.305 -0.395 19668 4948 1 14 . 1 1 26 26 ARG H H 26 8.789 8.789 8.476 0.313 19668 4949 1 14 . 1 1 27 27 ILE N N 27 118.726 118.726 118.321 0.405 19668 4950 1 14 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.785 0.001 19668 4951 1 14 . 1 1 27 27 ILE C C 27 177.639 177.639 177.881 -0.242 19668 4952 1 14 . 1 1 27 27 ILE CA C 27 63.624 63.624 65.126 -1.502 19668 4953 1 14 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.279 -0.324 19668 4954 1 14 . 1 1 27 27 ILE H H 27 7.762 7.762 8.132 -0.370 19668 4955 1 14 . 1 1 28 28 GLU N N 28 119.843 119.843 119.258 0.585 19668 4956 1 14 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.016 -0.003 19668 4957 1 14 . 1 1 28 28 GLU C C 28 179.447 179.447 179.010 0.437 19668 4958 1 14 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.004 -0.421 19668 4959 1 14 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.342 -0.282 19668 4960 1 14 . 1 1 28 28 GLU H H 28 7.867 7.867 8.427 -0.560 19668 4961 1 14 . 1 1 29 29 GLU N N 29 118.447 118.447 119.328 -0.881 19668 4962 1 14 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.042 0.045 19668 4963 1 14 . 1 1 29 29 GLU C C 29 179.310 179.310 178.996 0.314 19668 4964 1 14 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.940 0.340 19668 4965 1 14 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.188 0.148 19668 4966 1 14 . 1 1 29 29 GLU H H 29 7.755 7.755 8.391 -0.636 19668 4967 1 14 . 1 1 30 30 LEU N N 30 121.135 121.135 121.202 -0.067 19668 4968 1 14 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.992 0.104 19668 4969 1 14 . 1 1 30 30 LEU C C 30 178.928 178.928 178.701 0.227 19668 4970 1 14 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.166 -0.061 19668 4971 1 14 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.111 -0.431 19668 4972 1 14 . 1 1 30 30 LEU H H 30 7.785 7.785 7.613 0.172 19668 4973 1 14 . 1 1 31 31 LYS N N 31 119.130 119.130 117.830 1.300 19668 4974 1 14 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.124 -0.254 19668 4975 1 14 . 1 1 31 31 LYS C C 31 179.104 179.104 178.998 0.106 19668 4976 1 14 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.408 1.308 19668 4977 1 14 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.853 0.403 19668 4978 1 14 . 1 1 31 31 LYS H H 31 8.413 8.413 7.555 0.858 19668 4979 1 14 . 1 1 32 32 LYS N N 32 119.200 119.200 119.688 -0.488 19668 4980 1 14 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.989 0.113 19668 4981 1 14 . 1 1 32 32 LYS C C 32 179.420 179.420 179.107 0.313 19668 4982 1 14 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.434 0.022 19668 4983 1 14 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.233 0.033 19668 4984 1 14 . 1 1 32 32 LYS H H 32 7.826 7.826 7.645 0.181 19668 4985 1 14 . 1 1 33 33 LYS N N 33 120.322 120.322 119.122 1.200 19668 4986 1 14 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.057 0.106 19668 4987 1 14 . 1 1 33 33 LYS C C 33 179.174 179.174 178.935 0.239 19668 4988 1 14 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.637 0.111 19668 4989 1 14 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.184 -0.445 19668 4990 1 14 . 1 1 33 33 LYS H H 33 8.003 8.003 7.477 0.526 19668 4991 1 14 . 1 1 34 34 TYR N N 34 120.223 120.223 119.591 0.632 19668 4992 1 14 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.108 -0.052 19668 4993 1 14 . 1 1 34 34 TYR C C 34 176.356 176.356 177.985 -1.629 19668 4994 1 14 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.279 -0.224 19668 4995 1 14 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.303 -0.276 19668 4996 1 14 . 1 1 34 34 TYR H H 34 8.614 8.614 7.590 1.024 19668 4997 1 14 . 1 1 35 35 GLU N N 35 118.813 118.813 117.369 1.444 19668 4998 1 14 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.965 -0.240 19668 4999 1 14 . 1 1 35 35 GLU C C 35 179.787 179.787 179.500 0.287 19668 5000 1 14 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.865 -0.426 19668 5001 1 14 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.005 0.123 19668 5002 1 14 . 1 1 35 35 GLU H H 35 8.103 8.103 7.941 0.163 19668 5003 1 14 . 1 1 36 36 GLU N N 36 119.670 119.670 120.516 -0.846 19668 5004 1 14 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.110 -0.096 19668 5005 1 14 . 1 1 36 36 GLU C C 36 179.295 179.295 178.720 0.575 19668 5006 1 14 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.220 0.043 19668 5007 1 14 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.248 0.321 19668 5008 1 14 . 1 1 36 36 GLU H H 36 8.028 8.028 7.840 0.188 19668 5009 1 14 . 1 1 37 37 LEU N N 37 121.416 121.416 117.718 3.698 19668 5010 1 14 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.995 0.024 19668 5011 1 14 . 1 1 37 37 LEU C C 37 178.277 178.277 178.744 -0.467 19668 5012 1 14 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.632 0.208 19668 5013 1 14 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.700 -0.071 19668 5014 1 14 . 1 1 37 37 LEU H H 37 8.176 8.176 7.422 0.754 19668 5015 1 14 . 1 1 38 38 LYS N N 38 118.998 118.998 118.199 0.799 19668 5016 1 14 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.983 -0.323 19668 5017 1 14 . 1 1 38 38 LYS C C 38 178.923 178.923 178.810 0.113 19668 5018 1 14 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.583 0.817 19668 5019 1 14 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.230 -0.168 19668 5020 1 14 . 1 1 38 38 LYS H H 38 8.260 8.260 7.534 0.726 19668 5021 1 14 . 1 1 39 39 LYS N N 39 118.070 118.070 118.545 -0.475 19668 5022 1 14 . 1 1 39 39 LYS HA H 39 4.080 4.080 3.995 0.085 19668 5023 1 14 . 1 1 39 39 LYS C C 39 178.687 178.687 178.945 -0.258 19668 5024 1 14 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.132 -0.196 19668 5025 1 14 . 1 1 39 39 LYS CB C 39 32.149 32.149 31.905 0.244 19668 5026 1 14 . 1 1 39 39 LYS H H 39 7.380 7.380 7.621 -0.241 19668 5027 1 14 . 1 1 40 40 LYS N N 40 118.894 118.894 119.469 -0.575 19668 5028 1 14 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.363 -0.304 19668 5029 1 14 . 1 1 40 40 LYS C C 40 179.758 179.758 178.983 0.775 19668 5030 1 14 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.251 -0.189 19668 5031 1 14 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.339 0.049 19668 5032 1 14 . 1 1 40 40 LYS H H 40 7.919 7.919 7.454 0.465 19668 5033 1 14 . 1 1 41 41 ILE N N 41 118.270 118.270 119.131 -0.861 19668 5034 1 14 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.797 -0.100 19668 5035 1 14 . 1 1 41 41 ILE C C 41 178.211 178.211 177.810 0.401 19668 5036 1 14 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.133 0.581 19668 5037 1 14 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.761 0.078 19668 5038 1 14 . 1 1 41 41 ILE H H 41 8.199 8.199 7.480 0.719 19668 5039 1 14 . 1 1 42 42 GLU N N 42 120.117 120.117 119.348 0.769 19668 5040 1 14 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.015 0.076 19668 5041 1 14 . 1 1 42 42 GLU C C 42 178.736 178.736 177.986 0.750 19668 5042 1 14 . 1 1 42 42 GLU CA C 42 58.880 58.880 59.373 -0.493 19668 5043 1 14 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.775 -0.384 19668 5044 1 14 . 1 1 42 42 GLU H H 42 7.738 7.738 7.648 0.090 19668 5045 1 14 . 1 1 43 43 GLU N N 43 117.194 117.194 116.707 0.487 19668 5046 1 14 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.200 0.099 19668 5047 1 14 . 1 1 43 43 GLU C C 43 177.658 177.658 177.242 0.416 19668 5048 1 14 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.108 -0.315 19668 5049 1 14 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.189 -0.256 19668 5050 1 14 . 1 1 43 43 GLU H H 43 7.698 7.698 7.490 0.208 19668 5051 1 14 . 1 1 44 44 LEU N N 44 120.812 120.812 120.066 0.746 19668 5052 1 14 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.014 0.225 19668 5053 1 14 . 1 1 44 44 LEU C C 44 178.682 178.682 177.255 1.427 19668 5054 1 14 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.282 1.214 19668 5055 1 14 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.594 0.053 19668 5056 1 14 . 1 1 44 44 LEU H H 44 7.593 7.593 7.336 0.257 19668 5057 1 14 . 1 1 45 45 GLY N N 45 108.681 108.681 110.963 -2.282 19668 5058 1 14 . 1 1 45 45 GLY C C 45 174.957 174.957 173.638 1.319 19668 5059 1 14 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.364 0.722 19668 5060 1 14 . 1 1 45 45 GLY H H 45 8.234 8.234 8.586 -0.352 19668 5061 1 14 . 1 1 46 46 GLY N N 46 108.057 108.057 106.551 1.506 19668 5062 1 14 . 1 1 46 46 GLY C C 46 174.777 174.777 172.836 1.941 19668 5063 1 14 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.025 0.339 19668 5064 1 14 . 1 1 46 46 GLY H H 46 8.182 8.182 7.763 0.419 19668 5065 1 14 . 1 1 47 47 GLY N N 47 108.494 108.494 109.383 -0.889 19668 5066 1 14 . 1 1 47 47 GLY C C 47 174.572 174.572 174.783 -0.211 19668 5067 1 14 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.066 0.089 19668 5068 1 14 . 1 1 47 47 GLY H H 47 8.087 8.087 7.964 0.123 19668 5069 1 14 . 1 1 48 48 GLY N N 48 108.285 108.285 106.885 1.400 19668 5070 1 14 . 1 1 48 48 GLY C C 48 174.495 174.495 175.649 -1.154 19668 5071 1 14 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.159 -0.705 19668 5072 1 14 . 1 1 48 48 GLY H H 48 8.323 8.323 8.461 -0.138 19668 5073 1 14 . 1 1 49 49 GLU N N 49 121.070 121.070 121.783 -0.713 19668 5074 1 14 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.117 0.300 19668 5075 1 14 . 1 1 49 49 GLU C C 49 177.226 177.226 178.226 -1.000 19668 5076 1 14 . 1 1 49 49 GLU CA C 49 56.571 56.571 58.463 -1.892 19668 5077 1 14 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.326 0.340 19668 5078 1 14 . 1 1 49 49 GLU H H 49 8.483 8.483 8.736 -0.253 19668 5079 1 14 . 1 1 50 50 VAL N N 50 121.794 121.794 115.953 5.841 19668 5080 1 14 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.640 0.141 19668 5081 1 14 . 1 1 50 50 VAL C C 50 176.860 176.860 177.821 -0.961 19668 5082 1 14 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.491 -0.411 19668 5083 1 14 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.547 0.706 19668 5084 1 14 . 1 1 50 50 VAL H H 50 8.068 8.068 7.436 0.632 19668 5085 1 14 . 1 1 51 51 LYS N N 51 120.593 120.593 119.127 1.466 19668 5086 1 14 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.127 0.080 19668 5087 1 14 . 1 1 51 51 LYS C C 51 178.667 178.667 178.732 -0.065 19668 5088 1 14 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.846 0.489 19668 5089 1 14 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.883 0.375 19668 5090 1 14 . 1 1 51 51 LYS H H 51 8.253 8.253 7.724 0.529 19668 5091 1 14 . 1 1 52 52 LYS N N 52 117.572 117.572 119.627 -2.055 19668 5092 1 14 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.058 0.110 19668 5093 1 14 . 1 1 52 52 LYS C C 52 179.248 179.248 178.621 0.627 19668 5094 1 14 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.535 -0.521 19668 5095 1 14 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.135 0.045 19668 5096 1 14 . 1 1 52 52 LYS H H 52 7.629 7.629 7.653 -0.024 19668 5097 1 14 . 1 1 53 53 VAL N N 53 119.059 119.059 118.316 0.743 19668 5098 1 14 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.735 0.057 19668 5099 1 14 . 1 1 53 53 VAL C C 53 177.987 177.987 177.797 0.190 19668 5100 1 14 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.611 0.420 19668 5101 1 14 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.217 0.154 19668 5102 1 14 . 1 1 53 53 VAL H H 53 7.638 7.638 7.337 0.301 19668 5103 1 14 . 1 1 54 54 GLU N N 54 120.388 120.388 118.703 1.685 19668 5104 1 14 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.932 -0.088 19668 5105 1 14 . 1 1 54 54 GLU C C 54 179.624 179.624 179.011 0.613 19668 5106 1 14 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.910 0.332 19668 5107 1 14 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.003 0.815 19668 5108 1 14 . 1 1 54 54 GLU H H 54 8.603 8.603 7.930 0.673 19668 5109 1 14 . 1 1 55 55 GLU N N 55 118.533 118.533 118.995 -0.462 19668 5110 1 14 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.114 -0.025 19668 5111 1 14 . 1 1 55 55 GLU C C 55 179.158 179.158 179.703 -0.545 19668 5112 1 14 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.080 0.254 19668 5113 1 14 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.443 -0.106 19668 5114 1 14 . 1 1 55 55 GLU H H 55 7.904 7.904 7.503 0.401 19668 5115 1 14 . 1 1 56 56 GLU N N 56 120.258 120.258 120.658 -0.400 19668 5116 1 14 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.040 0.060 19668 5117 1 14 . 1 1 56 56 GLU C C 56 179.867 179.867 178.960 0.907 19668 5118 1 14 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.160 0.503 19668 5119 1 14 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.561 0.489 19668 5120 1 14 . 1 1 56 56 GLU H H 56 7.902 7.902 7.554 0.348 19668 5121 1 14 . 1 1 57 57 VAL N N 57 121.168 121.168 118.953 2.215 19668 5122 1 14 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.571 -0.003 19668 5123 1 14 . 1 1 57 57 VAL C C 57 176.994 176.994 176.882 0.112 19668 5124 1 14 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.397 1.499 19668 5125 1 14 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.829 -0.302 19668 5126 1 14 . 1 1 57 57 VAL H H 57 8.613 8.613 7.498 1.115 19668 5127 1 14 . 1 1 58 58 LYS N N 58 120.234 120.234 118.867 1.367 19668 5128 1 14 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.970 0.232 19668 5129 1 14 . 1 1 58 58 LYS C C 58 179.131 179.131 178.112 1.019 19668 5130 1 14 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.454 0.133 19668 5131 1 14 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.537 0.754 19668 5132 1 14 . 1 1 58 58 LYS H H 58 7.810 7.810 7.642 0.168 19668 5133 1 14 . 1 1 59 59 LYS N N 59 118.301 118.301 118.963 -0.662 19668 5134 1 14 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.039 0.054 19668 5135 1 14 . 1 1 59 59 LYS C C 59 179.281 179.281 178.321 0.960 19668 5136 1 14 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.043 0.385 19668 5137 1 14 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.952 0.427 19668 5138 1 14 . 1 1 59 59 LYS H H 59 7.876 7.876 7.374 0.502 19668 5139 1 14 . 1 1 60 60 LEU N N 60 121.224 121.224 120.200 1.024 19668 5140 1 14 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.945 0.289 19668 5141 1 14 . 1 1 60 60 LEU C C 60 178.636 178.636 178.683 -0.047 19668 5142 1 14 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.781 0.376 19668 5143 1 14 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.261 0.373 19668 5144 1 14 . 1 1 60 60 LEU H H 60 7.893 7.893 7.646 0.247 19668 5145 1 14 . 1 1 61 61 GLU N N 61 118.660 118.660 117.811 0.849 19668 5146 1 14 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.044 -0.245 19668 5147 1 14 . 1 1 61 61 GLU C C 61 179.094 179.094 178.765 0.329 19668 5148 1 14 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.164 1.108 19668 5149 1 14 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.869 1.135 19668 5150 1 14 . 1 1 61 61 GLU H H 61 8.644 8.644 7.755 0.889 19668 5151 1 14 . 1 1 62 62 GLU N N 62 117.555 117.555 119.559 -2.004 19668 5152 1 14 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.008 -0.012 19668 5153 1 14 . 1 1 62 62 GLU C C 62 178.940 178.940 179.103 -0.163 19668 5154 1 14 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.305 -0.137 19668 5155 1 14 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.213 0.334 19668 5156 1 14 . 1 1 62 62 GLU H H 62 7.995 7.995 7.551 0.444 19668 5157 1 14 . 1 1 63 63 GLU N N 63 119.097 119.097 118.197 0.900 19668 5158 1 14 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.130 -0.101 19668 5159 1 14 . 1 1 63 63 GLU C C 63 179.890 179.890 179.018 0.872 19668 5160 1 14 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.723 0.618 19668 5161 1 14 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.125 0.542 19668 5162 1 14 . 1 1 63 63 GLU H H 63 7.983 7.983 7.681 0.302 19668 5163 1 14 . 1 1 64 64 ILE N N 64 118.247 118.247 118.598 -0.351 19668 5164 1 14 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.860 -0.140 19668 5165 1 14 . 1 1 64 64 ILE C C 64 177.858 177.858 177.907 -0.049 19668 5166 1 14 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.325 0.171 19668 5167 1 14 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.398 0.583 19668 5168 1 14 . 1 1 64 64 ILE H H 64 8.261 8.261 7.262 0.999 19668 5169 1 14 . 1 1 65 65 LYS N N 65 118.693 118.693 118.398 0.295 19668 5170 1 14 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.173 -0.075 19668 5171 1 14 . 1 1 65 65 LYS C C 65 177.244 177.244 177.611 -0.367 19668 5172 1 14 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.852 0.801 19668 5173 1 14 . 1 1 65 65 LYS CB C 65 32.705 32.705 31.888 0.817 19668 5174 1 14 . 1 1 65 65 LYS H H 65 7.661 7.661 7.565 0.096 19668 5175 1 14 . 1 1 66 66 LYS N N 66 116.933 116.933 118.094 -1.161 19668 5176 1 14 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.154 0.184 19668 5177 1 14 . 1 1 66 66 LYS C C 66 176.011 176.011 176.817 -0.806 19668 5178 1 14 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.306 -0.847 19668 5179 1 14 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.953 0.178 19668 5180 1 14 . 1 1 66 66 LYS H H 66 7.261 7.261 7.680 -0.419 19668 5181 1 15 . 1 1 2 2 SER HA H 2 4.560 4.560 4.077 0.483 19668 5182 1 15 . 1 1 2 2 SER CA C 2 58.366 58.366 61.737 -3.371 19668 5183 1 15 . 1 1 3 3 ARG N N 3 125.213 125.213 120.305 4.908 19668 5184 1 15 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.151 0.115 19668 5185 1 15 . 1 1 3 3 ARG C C 3 178.381 178.381 177.942 0.439 19668 5186 1 15 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.804 -0.408 19668 5187 1 15 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.482 1.173 19668 5188 1 15 . 1 1 3 3 ARG H H 3 8.874 8.874 8.318 0.556 19668 5189 1 15 . 1 1 4 4 VAL N N 4 119.320 119.320 120.170 -0.850 19668 5190 1 15 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.848 -0.050 19668 5191 1 15 . 1 1 4 4 VAL C C 4 177.004 177.004 177.705 -0.701 19668 5192 1 15 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.666 -0.151 19668 5193 1 15 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.503 0.300 19668 5194 1 15 . 1 1 4 4 VAL H H 4 8.112 8.112 7.392 0.720 19668 5195 1 15 . 1 1 5 5 LYS N N 5 122.279 122.279 120.318 1.961 19668 5196 1 15 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.967 0.195 19668 5197 1 15 . 1 1 5 5 LYS C C 5 178.547 178.547 178.484 0.063 19668 5198 1 15 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.773 -0.015 19668 5199 1 15 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.919 0.091 19668 5200 1 15 . 1 1 5 5 LYS H H 5 7.847 7.847 8.560 -0.713 19668 5201 1 15 . 1 1 6 6 ALA N N 6 120.295 120.295 122.028 -1.733 19668 5202 1 15 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.100 0.111 19668 5203 1 15 . 1 1 6 6 ALA C C 6 180.834 180.834 179.708 1.126 19668 5204 1 15 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.082 -0.179 19668 5205 1 15 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.936 0.197 19668 5206 1 15 . 1 1 6 6 ALA H H 6 7.975 7.975 7.767 0.208 19668 5207 1 15 . 1 1 7 7 LEU N N 7 119.570 119.570 118.447 1.123 19668 5208 1 15 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.088 0.084 19668 5209 1 15 . 1 1 7 7 LEU C C 7 178.431 178.431 178.609 -0.178 19668 5210 1 15 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.878 -0.199 19668 5211 1 15 . 1 1 7 7 LEU CB C 7 42.035 42.035 40.977 1.058 19668 5212 1 15 . 1 1 7 7 LEU H H 7 7.650 7.650 7.545 0.105 19668 5213 1 15 . 1 1 8 8 GLU N N 8 119.934 119.934 118.388 1.546 19668 5214 1 15 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.069 -0.210 19668 5215 1 15 . 1 1 8 8 GLU C C 8 179.534 179.534 178.423 1.111 19668 5216 1 15 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.355 0.682 19668 5217 1 15 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.788 0.679 19668 5218 1 15 . 1 1 8 8 GLU H H 8 8.411 8.411 7.883 0.528 19668 5219 1 15 . 1 1 9 9 GLU N N 9 118.234 118.234 118.982 -0.748 19668 5220 1 15 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.070 -0.010 19668 5221 1 15 . 1 1 9 9 GLU C C 9 179.596 179.596 178.955 0.641 19668 5222 1 15 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.347 -0.017 19668 5223 1 15 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.275 0.143 19668 5224 1 15 . 1 1 9 9 GLU H H 9 8.206 8.206 7.717 0.489 19668 5225 1 15 . 1 1 10 10 LYS N N 10 121.042 121.042 119.088 1.954 19668 5226 1 15 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.158 0.025 19668 5227 1 15 . 1 1 10 10 LYS C C 10 179.380 179.380 179.118 0.262 19668 5228 1 15 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.104 0.221 19668 5229 1 15 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.156 0.253 19668 5230 1 15 . 1 1 10 10 LYS H H 10 7.931 7.931 7.564 0.367 19668 5231 1 15 . 1 1 11 11 VAL N N 11 118.662 118.662 120.188 -1.526 19668 5232 1 15 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.855 -0.041 19668 5233 1 15 . 1 1 11 11 VAL C C 11 178.845 178.845 178.350 0.495 19668 5234 1 15 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.105 0.883 19668 5235 1 15 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.698 -0.044 19668 5236 1 15 . 1 1 11 11 VAL H H 11 8.371 8.371 7.620 0.751 19668 5237 1 15 . 1 1 12 12 LYS N N 12 123.188 123.188 119.308 3.880 19668 5238 1 15 . 1 1 12 12 LYS HA H 12 4.226 4.226 4.014 0.212 19668 5239 1 15 . 1 1 12 12 LYS C C 12 179.098 179.098 178.408 0.690 19668 5240 1 15 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.250 0.233 19668 5241 1 15 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.198 0.008 19668 5242 1 15 . 1 1 12 12 LYS H H 12 8.276 8.276 7.549 0.727 19668 5243 1 15 . 1 1 13 13 ALA N N 13 121.169 121.169 121.715 -0.546 19668 5244 1 15 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.044 0.214 19668 5245 1 15 . 1 1 13 13 ALA C C 13 180.169 180.169 179.378 0.791 19668 5246 1 15 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.957 -0.321 19668 5247 1 15 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.416 -0.309 19668 5248 1 15 . 1 1 13 13 ALA H H 13 7.829 7.829 7.443 0.386 19668 5249 1 15 . 1 1 14 14 LEU N N 14 118.104 118.104 118.372 -0.268 19668 5250 1 15 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.009 0.147 19668 5251 1 15 . 1 1 14 14 LEU C C 14 177.614 177.614 177.850 -0.236 19668 5252 1 15 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.224 -0.619 19668 5253 1 15 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.922 0.872 19668 5254 1 15 . 1 1 14 14 LEU H H 14 7.781 7.781 7.428 0.353 19668 5255 1 15 . 1 1 15 15 GLU N N 15 120.632 120.632 118.896 1.736 19668 5256 1 15 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.440 -0.073 19668 5257 1 15 . 1 1 15 15 GLU C C 15 178.243 178.243 178.649 -0.406 19668 5258 1 15 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.556 1.030 19668 5259 1 15 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.000 0.829 19668 5260 1 15 . 1 1 15 15 GLU H H 15 7.873 7.873 7.342 0.531 19668 5261 1 15 . 1 1 16 16 GLU N N 16 115.775 115.775 117.070 -1.295 19668 5262 1 15 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.020 -0.061 19668 5263 1 15 . 1 1 16 16 GLU C C 16 179.006 179.006 178.717 0.289 19668 5264 1 15 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.165 -0.073 19668 5265 1 15 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.399 -0.046 19668 5266 1 15 . 1 1 16 16 GLU H H 16 7.926 7.926 7.701 0.225 19668 5267 1 15 . 1 1 17 17 LYS N N 17 118.801 118.801 118.977 -0.176 19668 5268 1 15 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.066 0.027 19668 5269 1 15 . 1 1 17 17 LYS C C 17 178.853 178.853 178.478 0.375 19668 5270 1 15 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.739 -0.268 19668 5271 1 15 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.797 0.565 19668 5272 1 15 . 1 1 17 17 LYS H H 17 7.518 7.518 7.356 0.162 19668 5273 1 15 . 1 1 18 18 VAL N N 18 118.034 118.034 119.404 -1.370 19668 5274 1 15 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.715 -0.203 19668 5275 1 15 . 1 1 18 18 VAL C C 18 178.362 178.362 178.419 -0.057 19668 5276 1 15 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.296 0.723 19668 5277 1 15 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.384 0.265 19668 5278 1 15 . 1 1 18 18 VAL H H 18 8.048 8.048 7.419 0.629 19668 5279 1 15 . 1 1 19 19 LYS N N 19 118.427 118.427 120.123 -1.696 19668 5280 1 15 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.078 -0.068 19668 5281 1 15 . 1 1 19 19 LYS C C 19 177.706 177.706 177.722 -0.016 19668 5282 1 15 . 1 1 19 19 LYS CA C 19 58.985 58.985 59.133 -0.148 19668 5283 1 15 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.685 0.739 19668 5284 1 15 . 1 1 19 19 LYS H H 19 8.008 8.008 7.631 0.377 19668 5285 1 15 . 1 1 20 20 ALA N N 20 119.177 119.177 120.259 -1.082 19668 5286 1 15 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.297 0.019 19668 5287 1 15 . 1 1 20 20 ALA C C 20 178.269 178.269 178.316 -0.047 19668 5288 1 15 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.892 -0.262 19668 5289 1 15 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.761 0.372 19668 5290 1 15 . 1 1 20 20 ALA H H 20 7.259 7.259 7.448 -0.189 19668 5291 1 15 . 1 1 21 21 LEU N N 21 118.596 118.596 117.662 0.934 19668 5292 1 15 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.068 0.193 19668 5293 1 15 . 1 1 21 21 LEU C C 21 177.732 177.732 177.188 0.544 19668 5294 1 15 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.069 -0.412 19668 5295 1 15 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.433 0.700 19668 5296 1 15 . 1 1 21 21 LEU H H 21 7.373 7.373 7.523 -0.150 19668 5297 1 15 . 1 1 22 22 GLY N N 22 107.926 107.926 105.535 2.391 19668 5298 1 15 . 1 1 22 22 GLY C C 22 173.362 173.362 173.080 0.282 19668 5299 1 15 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.808 0.389 19668 5300 1 15 . 1 1 22 22 GLY H H 22 8.144 8.144 7.481 0.663 19668 5301 1 15 . 1 1 23 23 GLY N N 23 108.242 108.242 107.168 1.074 19668 5302 1 15 . 1 1 23 23 GLY C C 23 174.110 174.110 173.276 0.834 19668 5303 1 15 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.901 -0.217 19668 5304 1 15 . 1 1 23 23 GLY H H 23 8.157 8.157 7.849 0.308 19668 5305 1 15 . 1 1 24 24 GLY N N 24 106.969 106.969 109.064 -2.095 19668 5306 1 15 . 1 1 24 24 GLY C C 24 175.172 175.172 175.193 -0.021 19668 5307 1 15 . 1 1 24 24 GLY CA C 24 44.439 44.439 46.263 -1.824 19668 5308 1 15 . 1 1 24 24 GLY H H 24 8.466 8.466 9.580 -1.114 19668 5309 1 15 . 1 1 25 25 GLY N N 25 108.946 108.946 109.235 -0.289 19668 5310 1 15 . 1 1 25 25 GLY C C 25 176.321 176.321 174.614 1.707 19668 5311 1 15 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.137 1.962 19668 5312 1 15 . 1 1 25 25 GLY H H 25 8.618 8.618 7.891 0.727 19668 5313 1 15 . 1 1 26 26 ARG N N 26 123.559 123.559 121.755 1.804 19668 5314 1 15 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.382 -0.103 19668 5315 1 15 . 1 1 26 26 ARG C C 26 178.076 178.076 178.313 -0.237 19668 5316 1 15 . 1 1 26 26 ARG CA C 26 57.915 57.915 57.514 0.401 19668 5317 1 15 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.508 -0.598 19668 5318 1 15 . 1 1 26 26 ARG H H 26 8.789 8.789 8.479 0.310 19668 5319 1 15 . 1 1 27 27 ILE N N 27 118.726 118.726 120.452 -1.726 19668 5320 1 15 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.812 -0.026 19668 5321 1 15 . 1 1 27 27 ILE C C 27 177.639 177.639 177.929 -0.290 19668 5322 1 15 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.541 -0.917 19668 5323 1 15 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.347 -0.392 19668 5324 1 15 . 1 1 27 27 ILE H H 27 7.762 7.762 8.053 -0.291 19668 5325 1 15 . 1 1 28 28 GLU N N 28 119.843 119.843 118.776 1.067 19668 5326 1 15 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.020 -0.007 19668 5327 1 15 . 1 1 28 28 GLU C C 28 179.447 179.447 179.294 0.153 19668 5328 1 15 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.138 -0.555 19668 5329 1 15 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.133 -0.073 19668 5330 1 15 . 1 1 28 28 GLU H H 28 7.867 7.867 8.713 -0.846 19668 5331 1 15 . 1 1 29 29 GLU N N 29 118.447 118.447 119.288 -0.841 19668 5332 1 15 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.083 0.004 19668 5333 1 15 . 1 1 29 29 GLU C C 29 179.310 179.310 179.176 0.134 19668 5334 1 15 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.638 0.642 19668 5335 1 15 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.498 -0.162 19668 5336 1 15 . 1 1 29 29 GLU H H 29 7.755 7.755 7.685 0.070 19668 5337 1 15 . 1 1 30 30 LEU N N 30 121.135 121.135 120.028 1.107 19668 5338 1 15 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.018 0.078 19668 5339 1 15 . 1 1 30 30 LEU C C 30 178.928 178.928 178.499 0.429 19668 5340 1 15 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.292 -0.187 19668 5341 1 15 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.128 -0.448 19668 5342 1 15 . 1 1 30 30 LEU H H 30 7.785 7.785 7.636 0.149 19668 5343 1 15 . 1 1 31 31 LYS N N 31 119.130 119.130 118.025 1.105 19668 5344 1 15 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.049 -0.179 19668 5345 1 15 . 1 1 31 31 LYS C C 31 179.104 179.104 178.952 0.152 19668 5346 1 15 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.367 1.349 19668 5347 1 15 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.690 0.566 19668 5348 1 15 . 1 1 31 31 LYS H H 31 8.413 8.413 7.629 0.784 19668 5349 1 15 . 1 1 32 32 LYS N N 32 119.200 119.200 119.737 -0.537 19668 5350 1 15 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.976 0.126 19668 5351 1 15 . 1 1 32 32 LYS C C 32 179.420 179.420 179.019 0.401 19668 5352 1 15 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.556 -0.099 19668 5353 1 15 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.292 -0.026 19668 5354 1 15 . 1 1 32 32 LYS H H 32 7.826 7.826 7.552 0.274 19668 5355 1 15 . 1 1 33 33 LYS N N 33 120.322 120.322 119.039 1.283 19668 5356 1 15 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.042 0.121 19668 5357 1 15 . 1 1 33 33 LYS C C 33 179.174 179.174 178.953 0.221 19668 5358 1 15 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.046 -0.298 19668 5359 1 15 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.338 -0.599 19668 5360 1 15 . 1 1 33 33 LYS H H 33 8.003 8.003 7.498 0.505 19668 5361 1 15 . 1 1 34 34 TYR N N 34 120.223 120.223 119.583 0.640 19668 5362 1 15 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.080 -0.024 19668 5363 1 15 . 1 1 34 34 TYR C C 34 176.356 176.356 177.912 -1.556 19668 5364 1 15 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.821 -0.765 19668 5365 1 15 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.443 -0.416 19668 5366 1 15 . 1 1 34 34 TYR H H 34 8.614 8.614 7.593 1.021 19668 5367 1 15 . 1 1 35 35 GLU N N 35 118.813 118.813 117.251 1.562 19668 5368 1 15 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.901 -0.176 19668 5369 1 15 . 1 1 35 35 GLU C C 35 179.787 179.787 178.531 1.256 19668 5370 1 15 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.053 -0.614 19668 5371 1 15 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.050 0.078 19668 5372 1 15 . 1 1 35 35 GLU H H 35 8.103 8.103 7.902 0.201 19668 5373 1 15 . 1 1 36 36 GLU N N 36 119.670 119.670 119.452 0.218 19668 5374 1 15 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.071 -0.057 19668 5375 1 15 . 1 1 36 36 GLU C C 36 179.295 179.295 178.973 0.322 19668 5376 1 15 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.056 0.207 19668 5377 1 15 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.499 0.070 19668 5378 1 15 . 1 1 36 36 GLU H H 36 8.028 8.028 7.673 0.355 19668 5379 1 15 . 1 1 37 37 LEU N N 37 121.416 121.416 120.108 1.308 19668 5380 1 15 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.988 0.031 19668 5381 1 15 . 1 1 37 37 LEU C C 37 178.277 178.277 179.190 -0.913 19668 5382 1 15 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.871 -0.031 19668 5383 1 15 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.211 0.418 19668 5384 1 15 . 1 1 37 37 LEU H H 37 8.176 8.176 7.412 0.764 19668 5385 1 15 . 1 1 38 38 LYS N N 38 118.998 118.998 118.604 0.394 19668 5386 1 15 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.970 -0.310 19668 5387 1 15 . 1 1 38 38 LYS C C 38 178.923 178.923 178.972 -0.049 19668 5388 1 15 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.034 0.366 19668 5389 1 15 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.174 -0.112 19668 5390 1 15 . 1 1 38 38 LYS H H 38 8.260 8.260 7.564 0.696 19668 5391 1 15 . 1 1 39 39 LYS N N 39 118.070 118.070 117.492 0.578 19668 5392 1 15 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.037 0.043 19668 5393 1 15 . 1 1 39 39 LYS C C 39 178.687 178.687 179.074 -0.387 19668 5394 1 15 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.797 -0.861 19668 5395 1 15 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.117 0.032 19668 5396 1 15 . 1 1 39 39 LYS H H 39 7.380 7.380 7.751 -0.371 19668 5397 1 15 . 1 1 40 40 LYS N N 40 118.894 118.894 120.061 -1.167 19668 5398 1 15 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.063 -0.004 19668 5399 1 15 . 1 1 40 40 LYS C C 40 179.758 179.758 179.048 0.710 19668 5400 1 15 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.229 -0.167 19668 5401 1 15 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.274 0.114 19668 5402 1 15 . 1 1 40 40 LYS H H 40 7.919 7.919 7.360 0.559 19668 5403 1 15 . 1 1 41 41 ILE N N 41 118.270 118.270 118.609 -0.339 19668 5404 1 15 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.729 -0.032 19668 5405 1 15 . 1 1 41 41 ILE C C 41 178.211 178.211 177.104 1.107 19668 5406 1 15 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.840 -0.126 19668 5407 1 15 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.737 0.102 19668 5408 1 15 . 1 1 41 41 ILE H H 41 8.199 8.199 7.465 0.734 19668 5409 1 15 . 1 1 42 42 GLU N N 42 120.117 120.117 117.299 2.818 19668 5410 1 15 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.031 0.060 19668 5411 1 15 . 1 1 42 42 GLU C C 42 178.736 178.736 177.722 1.014 19668 5412 1 15 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.788 0.093 19668 5413 1 15 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.981 -0.590 19668 5414 1 15 . 1 1 42 42 GLU H H 42 7.738 7.738 7.587 0.151 19668 5415 1 15 . 1 1 43 43 GLU N N 43 117.194 117.194 117.297 -0.103 19668 5416 1 15 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.182 0.117 19668 5417 1 15 . 1 1 43 43 GLU C C 43 177.658 177.658 177.851 -0.193 19668 5418 1 15 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.995 -0.202 19668 5419 1 15 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.879 0.054 19668 5420 1 15 . 1 1 43 43 GLU H H 43 7.698 7.698 7.481 0.217 19668 5421 1 15 . 1 1 44 44 LEU N N 44 120.812 120.812 121.553 -0.741 19668 5422 1 15 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.097 0.142 19668 5423 1 15 . 1 1 44 44 LEU C C 44 178.682 178.682 177.611 1.071 19668 5424 1 15 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.283 1.213 19668 5425 1 15 . 1 1 44 44 LEU CB C 44 42.647 42.647 40.845 1.802 19668 5426 1 15 . 1 1 44 44 LEU H H 44 7.593 7.593 7.529 0.064 19668 5427 1 15 . 1 1 45 45 GLY N N 45 108.681 108.681 111.253 -2.572 19668 5428 1 15 . 1 1 45 45 GLY C C 45 174.957 174.957 174.041 0.916 19668 5429 1 15 . 1 1 45 45 GLY CA C 45 46.086 46.086 46.089 -0.003 19668 5430 1 15 . 1 1 45 45 GLY H H 45 8.234 8.234 8.137 0.097 19668 5431 1 15 . 1 1 46 46 GLY N N 46 108.057 108.057 108.663 -0.606 19668 5432 1 15 . 1 1 46 46 GLY C C 46 174.777 174.777 173.739 1.038 19668 5433 1 15 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.288 1.076 19668 5434 1 15 . 1 1 46 46 GLY H H 46 8.182 8.182 7.951 0.231 19668 5435 1 15 . 1 1 47 47 GLY N N 47 108.494 108.494 107.468 1.026 19668 5436 1 15 . 1 1 47 47 GLY C C 47 174.572 174.572 173.812 0.760 19668 5437 1 15 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.871 0.284 19668 5438 1 15 . 1 1 47 47 GLY H H 47 8.087 8.087 8.114 -0.027 19668 5439 1 15 . 1 1 48 48 GLY N N 48 108.285 108.285 110.982 -2.697 19668 5440 1 15 . 1 1 48 48 GLY C C 48 174.495 174.495 174.664 -0.169 19668 5441 1 15 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.255 -0.801 19668 5442 1 15 . 1 1 48 48 GLY H H 48 8.323 8.323 8.304 0.019 19668 5443 1 15 . 1 1 49 49 GLU N N 49 121.070 121.070 120.933 0.137 19668 5444 1 15 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.575 -0.158 19668 5445 1 15 . 1 1 49 49 GLU C C 49 177.226 177.226 177.754 -0.528 19668 5446 1 15 . 1 1 49 49 GLU CA C 49 56.571 56.571 55.748 0.823 19668 5447 1 15 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.978 -0.312 19668 5448 1 15 . 1 1 49 49 GLU H H 49 8.483 8.483 8.429 0.054 19668 5449 1 15 . 1 1 50 50 VAL N N 50 121.794 121.794 120.985 0.809 19668 5450 1 15 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.688 0.093 19668 5451 1 15 . 1 1 50 50 VAL C C 50 176.860 176.860 177.175 -0.315 19668 5452 1 15 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.687 -0.607 19668 5453 1 15 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.777 0.476 19668 5454 1 15 . 1 1 50 50 VAL H H 50 8.068 8.068 7.940 0.128 19668 5455 1 15 . 1 1 51 51 LYS N N 51 120.593 120.593 116.905 3.688 19668 5456 1 15 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.090 0.117 19668 5457 1 15 . 1 1 51 51 LYS C C 51 178.667 178.667 178.668 -0.001 19668 5458 1 15 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.238 0.097 19668 5459 1 15 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.777 0.481 19668 5460 1 15 . 1 1 51 51 LYS H H 51 8.253 8.253 8.464 -0.211 19668 5461 1 15 . 1 1 52 52 LYS N N 52 117.572 117.572 119.443 -1.871 19668 5462 1 15 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.074 0.094 19668 5463 1 15 . 1 1 52 52 LYS C C 52 179.248 179.248 178.624 0.624 19668 5464 1 15 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.208 -0.194 19668 5465 1 15 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.112 0.068 19668 5466 1 15 . 1 1 52 52 LYS H H 52 7.629 7.629 7.339 0.290 19668 5467 1 15 . 1 1 53 53 VAL N N 53 119.059 119.059 118.702 0.357 19668 5468 1 15 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.804 -0.012 19668 5469 1 15 . 1 1 53 53 VAL C C 53 177.987 177.987 177.753 0.234 19668 5470 1 15 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.430 -0.399 19668 5471 1 15 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.142 0.229 19668 5472 1 15 . 1 1 53 53 VAL H H 53 7.638 7.638 7.760 -0.122 19668 5473 1 15 . 1 1 54 54 GLU N N 54 120.388 120.388 119.103 1.285 19668 5474 1 15 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.950 -0.106 19668 5475 1 15 . 1 1 54 54 GLU C C 54 179.624 179.624 178.939 0.685 19668 5476 1 15 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.696 0.545 19668 5477 1 15 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.084 0.734 19668 5478 1 15 . 1 1 54 54 GLU H H 54 8.603 8.603 7.692 0.911 19668 5479 1 15 . 1 1 55 55 GLU N N 55 118.533 118.533 119.492 -0.959 19668 5480 1 15 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.026 0.063 19668 5481 1 15 . 1 1 55 55 GLU C C 55 179.158 179.158 178.748 0.410 19668 5482 1 15 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.326 0.008 19668 5483 1 15 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.765 -0.427 19668 5484 1 15 . 1 1 55 55 GLU H H 55 7.904 7.904 7.640 0.264 19668 5485 1 15 . 1 1 56 56 GLU N N 56 120.258 120.258 119.014 1.244 19668 5486 1 15 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.004 0.096 19668 5487 1 15 . 1 1 56 56 GLU C C 56 179.867 179.867 179.042 0.825 19668 5488 1 15 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.932 0.731 19668 5489 1 15 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.203 0.847 19668 5490 1 15 . 1 1 56 56 GLU H H 56 7.902 7.902 7.606 0.296 19668 5491 1 15 . 1 1 57 57 VAL N N 57 121.168 121.168 120.736 0.432 19668 5492 1 15 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.603 -0.035 19668 5493 1 15 . 1 1 57 57 VAL C C 57 176.994 176.994 177.265 -0.271 19668 5494 1 15 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.819 2.077 19668 5495 1 15 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.340 0.187 19668 5496 1 15 . 1 1 57 57 VAL H H 57 8.613 8.613 7.456 1.157 19668 5497 1 15 . 1 1 58 58 LYS N N 58 120.234 120.234 118.073 2.161 19668 5498 1 15 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.935 0.267 19668 5499 1 15 . 1 1 58 58 LYS C C 58 179.131 179.131 178.710 0.421 19668 5500 1 15 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.568 0.019 19668 5501 1 15 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.095 0.196 19668 5502 1 15 . 1 1 58 58 LYS H H 58 7.810 7.810 7.503 0.307 19668 5503 1 15 . 1 1 59 59 LYS N N 59 118.301 118.301 117.706 0.595 19668 5504 1 15 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.085 0.008 19668 5505 1 15 . 1 1 59 59 LYS C C 59 179.281 179.281 178.286 0.995 19668 5506 1 15 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.086 0.343 19668 5507 1 15 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.661 0.718 19668 5508 1 15 . 1 1 59 59 LYS H H 59 7.876 7.876 7.421 0.455 19668 5509 1 15 . 1 1 60 60 LEU N N 60 121.224 121.224 121.568 -0.344 19668 5510 1 15 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.074 0.160 19668 5511 1 15 . 1 1 60 60 LEU C C 60 178.636 178.636 178.830 -0.194 19668 5512 1 15 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.817 0.340 19668 5513 1 15 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.352 0.282 19668 5514 1 15 . 1 1 60 60 LEU H H 60 7.893 7.893 7.640 0.253 19668 5515 1 15 . 1 1 61 61 GLU N N 61 118.660 118.660 117.975 0.685 19668 5516 1 15 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.071 -0.272 19668 5517 1 15 . 1 1 61 61 GLU C C 61 179.094 179.094 178.776 0.318 19668 5518 1 15 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.986 1.286 19668 5519 1 15 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.603 1.400 19668 5520 1 15 . 1 1 61 61 GLU H H 61 8.644 8.644 7.846 0.798 19668 5521 1 15 . 1 1 62 62 GLU N N 62 117.555 117.555 119.478 -1.923 19668 5522 1 15 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.036 -0.040 19668 5523 1 15 . 1 1 62 62 GLU C C 62 178.940 178.940 179.157 -0.217 19668 5524 1 15 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.137 0.031 19668 5525 1 15 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.040 0.507 19668 5526 1 15 . 1 1 62 62 GLU H H 62 7.995 7.995 7.603 0.392 19668 5527 1 15 . 1 1 63 63 GLU N N 63 119.097 119.097 118.397 0.700 19668 5528 1 15 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.154 -0.125 19668 5529 1 15 . 1 1 63 63 GLU C C 63 179.890 179.890 178.974 0.916 19668 5530 1 15 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.881 0.460 19668 5531 1 15 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.209 0.458 19668 5532 1 15 . 1 1 63 63 GLU H H 63 7.983 7.983 7.723 0.260 19668 5533 1 15 . 1 1 64 64 ILE N N 64 118.247 118.247 119.264 -1.017 19668 5534 1 15 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.817 -0.097 19668 5535 1 15 . 1 1 64 64 ILE C C 64 177.858 177.858 178.108 -0.250 19668 5536 1 15 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.402 0.094 19668 5537 1 15 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.508 0.473 19668 5538 1 15 . 1 1 64 64 ILE H H 64 8.261 8.261 7.237 1.024 19668 5539 1 15 . 1 1 65 65 LYS N N 65 118.693 118.693 118.318 0.375 19668 5540 1 15 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.152 -0.054 19668 5541 1 15 . 1 1 65 65 LYS C C 65 177.244 177.244 177.904 -0.660 19668 5542 1 15 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.730 -0.076 19668 5543 1 15 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.488 0.217 19668 5544 1 15 . 1 1 65 65 LYS H H 65 7.661 7.661 7.552 0.109 19668 5545 1 15 . 1 1 66 66 LYS N N 66 116.933 116.933 117.695 -0.762 19668 5546 1 15 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.136 0.202 19668 5547 1 15 . 1 1 66 66 LYS C C 66 176.011 176.011 177.228 -1.217 19668 5548 1 15 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.071 -1.612 19668 5549 1 15 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.942 0.189 19668 5550 1 15 . 1 1 66 66 LYS H H 66 7.261 7.261 7.604 -0.343 19668 5551 1 16 . 1 1 2 2 SER HA H 2 4.560 4.560 4.502 0.058 19668 5552 1 16 . 1 1 2 2 SER CA C 2 58.366 58.366 59.734 -1.368 19668 5553 1 16 . 1 1 3 3 ARG N N 3 125.213 125.213 120.802 4.411 19668 5554 1 16 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.402 -0.136 19668 5555 1 16 . 1 1 3 3 ARG C C 3 178.381 178.381 177.910 0.471 19668 5556 1 16 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.527 0.869 19668 5557 1 16 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.608 1.048 19668 5558 1 16 . 1 1 3 3 ARG H H 3 8.874 8.874 8.351 0.523 19668 5559 1 16 . 1 1 4 4 VAL N N 4 119.320 119.320 120.926 -1.606 19668 5560 1 16 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.795 0.003 19668 5561 1 16 . 1 1 4 4 VAL C C 4 177.004 177.004 177.673 -0.669 19668 5562 1 16 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.452 0.063 19668 5563 1 16 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.378 0.425 19668 5564 1 16 . 1 1 4 4 VAL H H 4 8.112 8.112 8.219 -0.107 19668 5565 1 16 . 1 1 5 5 LYS N N 5 122.279 122.279 120.861 1.418 19668 5566 1 16 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.071 0.091 19668 5567 1 16 . 1 1 5 5 LYS C C 5 178.547 178.547 178.001 0.546 19668 5568 1 16 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.967 -0.209 19668 5569 1 16 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.823 0.187 19668 5570 1 16 . 1 1 5 5 LYS H H 5 7.847 7.847 8.320 -0.473 19668 5571 1 16 . 1 1 6 6 ALA N N 6 120.295 120.295 121.101 -0.806 19668 5572 1 16 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.126 0.085 19668 5573 1 16 . 1 1 6 6 ALA C C 6 180.834 180.834 179.769 1.065 19668 5574 1 16 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.799 0.104 19668 5575 1 16 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.900 0.232 19668 5576 1 16 . 1 1 6 6 ALA H H 6 7.975 7.975 7.868 0.107 19668 5577 1 16 . 1 1 7 7 LEU N N 7 119.570 119.570 118.282 1.288 19668 5578 1 16 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.052 0.120 19668 5579 1 16 . 1 1 7 7 LEU C C 7 178.431 178.431 178.646 -0.215 19668 5580 1 16 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.824 -0.145 19668 5581 1 16 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.160 0.875 19668 5582 1 16 . 1 1 7 7 LEU H H 7 7.650 7.650 7.671 -0.021 19668 5583 1 16 . 1 1 8 8 GLU N N 8 119.934 119.934 118.387 1.547 19668 5584 1 16 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.061 -0.202 19668 5585 1 16 . 1 1 8 8 GLU C C 8 179.534 179.534 178.620 0.914 19668 5586 1 16 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.366 0.671 19668 5587 1 16 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.766 0.701 19668 5588 1 16 . 1 1 8 8 GLU H H 8 8.411 8.411 7.841 0.570 19668 5589 1 16 . 1 1 9 9 GLU N N 9 118.234 118.234 119.213 -0.979 19668 5590 1 16 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.087 -0.027 19668 5591 1 16 . 1 1 9 9 GLU C C 9 179.596 179.596 178.863 0.733 19668 5592 1 16 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.320 0.010 19668 5593 1 16 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.433 -0.015 19668 5594 1 16 . 1 1 9 9 GLU H H 9 8.206 8.206 7.722 0.484 19668 5595 1 16 . 1 1 10 10 LYS N N 10 121.042 121.042 118.896 2.146 19668 5596 1 16 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.149 0.034 19668 5597 1 16 . 1 1 10 10 LYS C C 10 179.380 179.380 179.150 0.230 19668 5598 1 16 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.197 0.128 19668 5599 1 16 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.133 0.276 19668 5600 1 16 . 1 1 10 10 LYS H H 10 7.931 7.931 7.550 0.381 19668 5601 1 16 . 1 1 11 11 VAL N N 11 118.662 118.662 120.038 -1.376 19668 5602 1 16 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.902 -0.088 19668 5603 1 16 . 1 1 11 11 VAL C C 11 178.845 178.845 178.211 0.634 19668 5604 1 16 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.416 1.572 19668 5605 1 16 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.083 0.571 19668 5606 1 16 . 1 1 11 11 VAL H H 11 8.371 8.371 7.619 0.752 19668 5607 1 16 . 1 1 12 12 LYS N N 12 123.188 123.188 119.614 3.574 19668 5608 1 16 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.808 0.418 19668 5609 1 16 . 1 1 12 12 LYS C C 12 179.098 179.098 178.500 0.598 19668 5610 1 16 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.810 -0.327 19668 5611 1 16 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.258 -0.052 19668 5612 1 16 . 1 1 12 12 LYS H H 12 8.276 8.276 7.569 0.707 19668 5613 1 16 . 1 1 13 13 ALA N N 13 121.169 121.169 121.622 -0.453 19668 5614 1 16 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.026 0.232 19668 5615 1 16 . 1 1 13 13 ALA C C 13 180.169 180.169 179.481 0.688 19668 5616 1 16 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.886 -0.249 19668 5617 1 16 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.426 -0.319 19668 5618 1 16 . 1 1 13 13 ALA H H 13 7.829 7.829 7.405 0.424 19668 5619 1 16 . 1 1 14 14 LEU N N 14 118.104 118.104 118.143 -0.039 19668 5620 1 16 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.995 0.161 19668 5621 1 16 . 1 1 14 14 LEU C C 14 177.614 177.614 177.876 -0.262 19668 5622 1 16 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.144 -0.539 19668 5623 1 16 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.959 0.836 19668 5624 1 16 . 1 1 14 14 LEU H H 14 7.781 7.781 7.528 0.253 19668 5625 1 16 . 1 1 15 15 GLU N N 15 120.632 120.632 119.004 1.628 19668 5626 1 16 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.343 0.024 19668 5627 1 16 . 1 1 15 15 GLU C C 15 178.243 178.243 178.655 -0.412 19668 5628 1 16 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.628 0.958 19668 5629 1 16 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.948 0.881 19668 5630 1 16 . 1 1 15 15 GLU H H 15 7.873 7.873 7.297 0.576 19668 5631 1 16 . 1 1 16 16 GLU N N 16 115.775 115.775 117.185 -1.410 19668 5632 1 16 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.989 -0.030 19668 5633 1 16 . 1 1 16 16 GLU C C 16 179.006 179.006 178.716 0.290 19668 5634 1 16 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.978 0.114 19668 5635 1 16 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.599 -0.246 19668 5636 1 16 . 1 1 16 16 GLU H H 16 7.926 7.926 7.699 0.227 19668 5637 1 16 . 1 1 17 17 LYS N N 17 118.801 118.801 119.269 -0.468 19668 5638 1 16 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.082 0.012 19668 5639 1 16 . 1 1 17 17 LYS C C 17 178.853 178.853 178.882 -0.029 19668 5640 1 16 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.971 -0.500 19668 5641 1 16 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.903 0.459 19668 5642 1 16 . 1 1 17 17 LYS H H 17 7.518 7.518 7.495 0.024 19668 5643 1 16 . 1 1 18 18 VAL N N 18 118.034 118.034 119.807 -1.773 19668 5644 1 16 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.695 -0.183 19668 5645 1 16 . 1 1 18 18 VAL C C 18 178.362 178.362 177.834 0.528 19668 5646 1 16 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.697 0.322 19668 5647 1 16 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.220 0.429 19668 5648 1 16 . 1 1 18 18 VAL H H 18 8.048 8.048 7.459 0.589 19668 5649 1 16 . 1 1 19 19 LYS N N 19 118.427 118.427 117.705 0.722 19668 5650 1 16 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.124 -0.114 19668 5651 1 16 . 1 1 19 19 LYS C C 19 177.706 177.706 178.099 -0.393 19668 5652 1 16 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.639 0.346 19668 5653 1 16 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.810 0.614 19668 5654 1 16 . 1 1 19 19 LYS H H 19 8.008 8.008 7.446 0.562 19668 5655 1 16 . 1 1 20 20 ALA N N 20 119.177 119.177 121.105 -1.928 19668 5656 1 16 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.348 -0.032 19668 5657 1 16 . 1 1 20 20 ALA C C 20 178.269 178.269 178.418 -0.149 19668 5658 1 16 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.903 -0.272 19668 5659 1 16 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.036 0.097 19668 5660 1 16 . 1 1 20 20 ALA H H 20 7.259 7.259 7.484 -0.225 19668 5661 1 16 . 1 1 21 21 LEU N N 21 118.596 118.596 116.355 2.241 19668 5662 1 16 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.220 0.041 19668 5663 1 16 . 1 1 21 21 LEU C C 21 177.732 177.732 177.449 0.283 19668 5664 1 16 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.219 -0.562 19668 5665 1 16 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.450 0.683 19668 5666 1 16 . 1 1 21 21 LEU H H 21 7.373 7.373 7.303 0.070 19668 5667 1 16 . 1 1 22 22 GLY N N 22 107.926 107.926 105.043 2.883 19668 5668 1 16 . 1 1 22 22 GLY C C 22 173.362 173.362 172.519 0.843 19668 5669 1 16 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.117 0.080 19668 5670 1 16 . 1 1 22 22 GLY H H 22 8.144 8.144 7.485 0.659 19668 5671 1 16 . 1 1 23 23 GLY N N 23 108.242 108.242 105.746 2.496 19668 5672 1 16 . 1 1 23 23 GLY C C 23 174.110 174.110 172.772 1.338 19668 5673 1 16 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.182 -0.498 19668 5674 1 16 . 1 1 23 23 GLY H H 23 8.157 8.157 7.955 0.202 19668 5675 1 16 . 1 1 24 24 GLY N N 24 106.969 106.969 110.026 -3.057 19668 5676 1 16 . 1 1 24 24 GLY C C 24 175.172 175.172 174.485 0.687 19668 5677 1 16 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.106 -0.667 19668 5678 1 16 . 1 1 24 24 GLY H H 24 8.466 8.466 7.939 0.527 19668 5679 1 16 . 1 1 25 25 GLY N N 25 108.946 108.946 113.656 -4.710 19668 5680 1 16 . 1 1 25 25 GLY C C 25 176.321 176.321 174.943 1.378 19668 5681 1 16 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.106 0.993 19668 5682 1 16 . 1 1 25 25 GLY H H 25 8.618 8.618 8.250 0.368 19668 5683 1 16 . 1 1 26 26 ARG N N 26 123.559 123.559 123.624 -0.065 19668 5684 1 16 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.217 0.062 19668 5685 1 16 . 1 1 26 26 ARG C C 26 178.076 178.076 178.297 -0.221 19668 5686 1 16 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.129 -1.214 19668 5687 1 16 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.332 -0.422 19668 5688 1 16 . 1 1 26 26 ARG H H 26 8.789 8.789 7.993 0.796 19668 5689 1 16 . 1 1 27 27 ILE N N 27 118.726 118.726 117.324 1.402 19668 5690 1 16 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.892 -0.106 19668 5691 1 16 . 1 1 27 27 ILE C C 27 177.639 177.639 178.360 -0.721 19668 5692 1 16 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.849 -0.225 19668 5693 1 16 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.571 0.384 19668 5694 1 16 . 1 1 27 27 ILE H H 27 7.762 7.762 7.909 -0.147 19668 5695 1 16 . 1 1 28 28 GLU N N 28 119.843 119.843 120.820 -0.977 19668 5696 1 16 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.063 -0.050 19668 5697 1 16 . 1 1 28 28 GLU C C 28 179.447 179.447 178.613 0.834 19668 5698 1 16 . 1 1 28 28 GLU CA C 28 59.583 59.583 58.943 0.640 19668 5699 1 16 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.994 0.066 19668 5700 1 16 . 1 1 28 28 GLU H H 28 7.867 7.867 8.706 -0.839 19668 5701 1 16 . 1 1 29 29 GLU N N 29 118.447 118.447 120.216 -1.769 19668 5702 1 16 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.043 0.044 19668 5703 1 16 . 1 1 29 29 GLU C C 29 179.310 179.310 178.627 0.683 19668 5704 1 16 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.711 0.569 19668 5705 1 16 . 1 1 29 29 GLU CB C 29 29.336 29.336 28.854 0.482 19668 5706 1 16 . 1 1 29 29 GLU H H 29 7.755 7.755 8.471 -0.716 19668 5707 1 16 . 1 1 30 30 LEU N N 30 121.135 121.135 120.733 0.402 19668 5708 1 16 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.005 0.091 19668 5709 1 16 . 1 1 30 30 LEU C C 30 178.928 178.928 178.682 0.246 19668 5710 1 16 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.277 -0.172 19668 5711 1 16 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.093 -0.413 19668 5712 1 16 . 1 1 30 30 LEU H H 30 7.785 7.785 7.610 0.175 19668 5713 1 16 . 1 1 31 31 LYS N N 31 119.130 119.130 117.684 1.446 19668 5714 1 16 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.096 -0.226 19668 5715 1 16 . 1 1 31 31 LYS C C 31 179.104 179.104 178.910 0.194 19668 5716 1 16 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.440 1.276 19668 5717 1 16 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.864 0.392 19668 5718 1 16 . 1 1 31 31 LYS H H 31 8.413 8.413 7.523 0.890 19668 5719 1 16 . 1 1 32 32 LYS N N 32 119.200 119.200 119.635 -0.435 19668 5720 1 16 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.034 0.068 19668 5721 1 16 . 1 1 32 32 LYS C C 32 179.420 179.420 179.071 0.349 19668 5722 1 16 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.036 0.421 19668 5723 1 16 . 1 1 32 32 LYS CB C 32 32.266 32.266 31.949 0.317 19668 5724 1 16 . 1 1 32 32 LYS H H 32 7.826 7.826 7.658 0.168 19668 5725 1 16 . 1 1 33 33 LYS N N 33 120.322 120.322 119.570 0.752 19668 5726 1 16 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.048 0.115 19668 5727 1 16 . 1 1 33 33 LYS C C 33 179.174 179.174 178.962 0.212 19668 5728 1 16 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.052 -0.304 19668 5729 1 16 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.252 -0.513 19668 5730 1 16 . 1 1 33 33 LYS H H 33 8.003 8.003 7.494 0.509 19668 5731 1 16 . 1 1 34 34 TYR N N 34 120.223 120.223 119.519 0.704 19668 5732 1 16 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.108 -0.052 19668 5733 1 16 . 1 1 34 34 TYR C C 34 176.356 176.356 178.030 -1.674 19668 5734 1 16 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.586 -0.531 19668 5735 1 16 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.328 -0.301 19668 5736 1 16 . 1 1 34 34 TYR H H 34 8.614 8.614 7.580 1.034 19668 5737 1 16 . 1 1 35 35 GLU N N 35 118.813 118.813 117.490 1.323 19668 5738 1 16 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.953 -0.228 19668 5739 1 16 . 1 1 35 35 GLU C C 35 179.787 179.787 178.864 0.923 19668 5740 1 16 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.979 -0.540 19668 5741 1 16 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.080 0.048 19668 5742 1 16 . 1 1 35 35 GLU H H 35 8.103 8.103 7.841 0.262 19668 5743 1 16 . 1 1 36 36 GLU N N 36 119.670 119.670 119.789 -0.119 19668 5744 1 16 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.097 -0.083 19668 5745 1 16 . 1 1 36 36 GLU C C 36 179.295 179.295 179.037 0.258 19668 5746 1 16 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.344 -0.081 19668 5747 1 16 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.332 0.237 19668 5748 1 16 . 1 1 36 36 GLU H H 36 8.028 8.028 7.660 0.368 19668 5749 1 16 . 1 1 37 37 LEU N N 37 121.416 121.416 118.157 3.259 19668 5750 1 16 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.967 0.052 19668 5751 1 16 . 1 1 37 37 LEU C C 37 178.277 178.277 179.048 -0.771 19668 5752 1 16 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.653 0.187 19668 5753 1 16 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.679 -0.050 19668 5754 1 16 . 1 1 37 37 LEU H H 37 8.176 8.176 7.354 0.822 19668 5755 1 16 . 1 1 38 38 LYS N N 38 118.998 118.998 118.396 0.602 19668 5756 1 16 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.992 -0.332 19668 5757 1 16 . 1 1 38 38 LYS C C 38 178.923 178.923 178.771 0.152 19668 5758 1 16 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.760 0.640 19668 5759 1 16 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.355 -0.293 19668 5760 1 16 . 1 1 38 38 LYS H H 38 8.260 8.260 7.522 0.738 19668 5761 1 16 . 1 1 39 39 LYS N N 39 118.070 118.070 118.508 -0.438 19668 5762 1 16 . 1 1 39 39 LYS HA H 39 4.080 4.080 3.979 0.101 19668 5763 1 16 . 1 1 39 39 LYS C C 39 178.687 178.687 178.867 -0.180 19668 5764 1 16 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.204 -0.268 19668 5765 1 16 . 1 1 39 39 LYS CB C 39 32.149 32.149 31.937 0.212 19668 5766 1 16 . 1 1 39 39 LYS H H 39 7.380 7.380 7.630 -0.250 19668 5767 1 16 . 1 1 40 40 LYS N N 40 118.894 118.894 119.249 -0.355 19668 5768 1 16 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.066 -0.007 19668 5769 1 16 . 1 1 40 40 LYS C C 40 179.758 179.758 179.072 0.686 19668 5770 1 16 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.158 -0.096 19668 5771 1 16 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.375 0.013 19668 5772 1 16 . 1 1 40 40 LYS H H 40 7.919 7.919 7.498 0.421 19668 5773 1 16 . 1 1 41 41 ILE N N 41 118.270 118.270 118.765 -0.495 19668 5774 1 16 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.780 -0.083 19668 5775 1 16 . 1 1 41 41 ILE C C 41 178.211 178.211 176.921 1.290 19668 5776 1 16 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.246 0.468 19668 5777 1 16 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.763 0.076 19668 5778 1 16 . 1 1 41 41 ILE H H 41 8.199 8.199 7.467 0.732 19668 5779 1 16 . 1 1 42 42 GLU N N 42 120.117 120.117 117.795 2.322 19668 5780 1 16 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.030 0.061 19668 5781 1 16 . 1 1 42 42 GLU C C 42 178.736 178.736 177.608 1.128 19668 5782 1 16 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.814 0.066 19668 5783 1 16 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.872 -0.481 19668 5784 1 16 . 1 1 42 42 GLU H H 42 7.738 7.738 7.512 0.226 19668 5785 1 16 . 1 1 43 43 GLU N N 43 117.194 117.194 116.619 0.575 19668 5786 1 16 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.209 0.090 19668 5787 1 16 . 1 1 43 43 GLU C C 43 177.658 177.658 177.211 0.447 19668 5788 1 16 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.072 -0.279 19668 5789 1 16 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.463 -0.530 19668 5790 1 16 . 1 1 43 43 GLU H H 43 7.698 7.698 7.459 0.239 19668 5791 1 16 . 1 1 44 44 LEU N N 44 120.812 120.812 121.062 -0.250 19668 5792 1 16 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.110 0.129 19668 5793 1 16 . 1 1 44 44 LEU C C 44 178.682 178.682 177.315 1.367 19668 5794 1 16 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.647 0.849 19668 5795 1 16 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.063 0.584 19668 5796 1 16 . 1 1 44 44 LEU H H 44 7.593 7.593 7.391 0.202 19668 5797 1 16 . 1 1 45 45 GLY N N 45 108.681 108.681 111.146 -2.465 19668 5798 1 16 . 1 1 45 45 GLY C C 45 174.957 174.957 173.754 1.203 19668 5799 1 16 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.075 1.012 19668 5800 1 16 . 1 1 45 45 GLY H H 45 8.234 8.234 8.386 -0.152 19668 5801 1 16 . 1 1 46 46 GLY N N 46 108.057 108.057 107.593 0.464 19668 5802 1 16 . 1 1 46 46 GLY C C 46 174.777 174.777 173.837 0.940 19668 5803 1 16 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.279 0.085 19668 5804 1 16 . 1 1 46 46 GLY H H 46 8.182 8.182 7.889 0.293 19668 5805 1 16 . 1 1 47 47 GLY N N 47 108.494 108.494 109.887 -1.393 19668 5806 1 16 . 1 1 47 47 GLY C C 47 174.572 174.572 173.574 0.998 19668 5807 1 16 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.248 -0.093 19668 5808 1 16 . 1 1 47 47 GLY H H 47 8.087 8.087 8.103 -0.016 19668 5809 1 16 . 1 1 48 48 GLY N N 48 108.285 108.285 107.896 0.389 19668 5810 1 16 . 1 1 48 48 GLY C C 48 174.495 174.495 174.475 0.020 19668 5811 1 16 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.072 0.382 19668 5812 1 16 . 1 1 48 48 GLY H H 48 8.323 8.323 8.542 -0.219 19668 5813 1 16 . 1 1 49 49 GLU N N 49 121.070 121.070 120.588 0.482 19668 5814 1 16 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.442 -0.025 19668 5815 1 16 . 1 1 49 49 GLU C C 49 177.226 177.226 178.291 -1.065 19668 5816 1 16 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.015 -0.444 19668 5817 1 16 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.869 -0.203 19668 5818 1 16 . 1 1 49 49 GLU H H 49 8.483 8.483 8.192 0.291 19668 5819 1 16 . 1 1 50 50 VAL N N 50 121.794 121.794 118.390 3.404 19668 5820 1 16 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.728 0.053 19668 5821 1 16 . 1 1 50 50 VAL C C 50 176.860 176.860 177.368 -0.508 19668 5822 1 16 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.708 -0.628 19668 5823 1 16 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.101 1.152 19668 5824 1 16 . 1 1 50 50 VAL H H 50 8.068 8.068 8.054 0.014 19668 5825 1 16 . 1 1 51 51 LYS N N 51 120.593 120.593 119.578 1.015 19668 5826 1 16 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.315 -0.108 19668 5827 1 16 . 1 1 51 51 LYS C C 51 178.667 178.667 178.712 -0.045 19668 5828 1 16 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.255 0.080 19668 5829 1 16 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.499 0.759 19668 5830 1 16 . 1 1 51 51 LYS H H 51 8.253 8.253 8.443 -0.190 19668 5831 1 16 . 1 1 52 52 LYS N N 52 117.572 117.572 118.859 -1.287 19668 5832 1 16 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.122 0.046 19668 5833 1 16 . 1 1 52 52 LYS C C 52 179.248 179.248 178.352 0.896 19668 5834 1 16 . 1 1 52 52 LYS CA C 52 59.014 59.014 58.617 0.397 19668 5835 1 16 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.027 0.153 19668 5836 1 16 . 1 1 52 52 LYS H H 52 7.629 7.629 7.951 -0.322 19668 5837 1 16 . 1 1 53 53 VAL N N 53 119.059 119.059 118.999 0.060 19668 5838 1 16 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.772 0.020 19668 5839 1 16 . 1 1 53 53 VAL C C 53 177.987 177.987 177.952 0.035 19668 5840 1 16 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.977 1.054 19668 5841 1 16 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.323 0.048 19668 5842 1 16 . 1 1 53 53 VAL H H 53 7.638 7.638 7.310 0.328 19668 5843 1 16 . 1 1 54 54 GLU N N 54 120.388 120.388 119.532 0.856 19668 5844 1 16 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.906 -0.062 19668 5845 1 16 . 1 1 54 54 GLU C C 54 179.624 179.624 178.766 0.858 19668 5846 1 16 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.992 0.249 19668 5847 1 16 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.177 0.641 19668 5848 1 16 . 1 1 54 54 GLU H H 54 8.603 8.603 7.603 1.000 19668 5849 1 16 . 1 1 55 55 GLU N N 55 118.533 118.533 119.097 -0.564 19668 5850 1 16 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.063 0.026 19668 5851 1 16 . 1 1 55 55 GLU C C 55 179.158 179.158 178.708 0.450 19668 5852 1 16 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.113 0.221 19668 5853 1 16 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.635 -0.298 19668 5854 1 16 . 1 1 55 55 GLU H H 55 7.904 7.904 7.559 0.345 19668 5855 1 16 . 1 1 56 56 GLU N N 56 120.258 120.258 119.501 0.757 19668 5856 1 16 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.021 0.079 19668 5857 1 16 . 1 1 56 56 GLU C C 56 179.867 179.867 179.261 0.606 19668 5858 1 16 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.294 0.368 19668 5859 1 16 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.426 0.624 19668 5860 1 16 . 1 1 56 56 GLU H H 56 7.902 7.902 7.525 0.377 19668 5861 1 16 . 1 1 57 57 VAL N N 57 121.168 121.168 120.190 0.978 19668 5862 1 16 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.601 -0.033 19668 5863 1 16 . 1 1 57 57 VAL C C 57 176.994 176.994 177.313 -0.319 19668 5864 1 16 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.566 2.330 19668 5865 1 16 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.409 0.118 19668 5866 1 16 . 1 1 57 57 VAL H H 57 8.613 8.613 7.534 1.079 19668 5867 1 16 . 1 1 58 58 LYS N N 58 120.234 120.234 119.205 1.029 19668 5868 1 16 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.944 0.258 19668 5869 1 16 . 1 1 58 58 LYS C C 58 179.131 179.131 179.247 -0.116 19668 5870 1 16 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.380 0.207 19668 5871 1 16 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.922 0.369 19668 5872 1 16 . 1 1 58 58 LYS H H 58 7.810 7.810 7.422 0.388 19668 5873 1 16 . 1 1 59 59 LYS N N 59 118.301 118.301 118.516 -0.215 19668 5874 1 16 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.035 0.058 19668 5875 1 16 . 1 1 59 59 LYS C C 59 179.281 179.281 178.542 0.739 19668 5876 1 16 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.174 0.254 19668 5877 1 16 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.114 0.266 19668 5878 1 16 . 1 1 59 59 LYS H H 59 7.876 7.876 7.436 0.440 19668 5879 1 16 . 1 1 60 60 LEU N N 60 121.224 121.224 120.104 1.120 19668 5880 1 16 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.983 0.251 19668 5881 1 16 . 1 1 60 60 LEU C C 60 178.636 178.636 178.794 -0.158 19668 5882 1 16 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.839 0.318 19668 5883 1 16 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.290 0.344 19668 5884 1 16 . 1 1 60 60 LEU H H 60 7.893 7.893 7.546 0.347 19668 5885 1 16 . 1 1 61 61 GLU N N 61 118.660 118.660 117.865 0.795 19668 5886 1 16 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.072 -0.273 19668 5887 1 16 . 1 1 61 61 GLU C C 61 179.094 179.094 178.790 0.304 19668 5888 1 16 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.912 1.360 19668 5889 1 16 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.561 1.442 19668 5890 1 16 . 1 1 61 61 GLU H H 61 8.644 8.644 7.802 0.842 19668 5891 1 16 . 1 1 62 62 GLU N N 62 117.555 117.555 119.734 -2.179 19668 5892 1 16 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.030 -0.034 19668 5893 1 16 . 1 1 62 62 GLU C C 62 178.940 178.940 179.090 -0.150 19668 5894 1 16 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.172 -0.004 19668 5895 1 16 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.155 0.392 19668 5896 1 16 . 1 1 62 62 GLU H H 62 7.995 7.995 7.553 0.442 19668 5897 1 16 . 1 1 63 63 GLU N N 63 119.097 119.097 118.407 0.690 19668 5898 1 16 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.132 -0.103 19668 5899 1 16 . 1 1 63 63 GLU C C 63 179.890 179.890 179.077 0.813 19668 5900 1 16 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.954 0.387 19668 5901 1 16 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.123 0.543 19668 5902 1 16 . 1 1 63 63 GLU H H 63 7.983 7.983 7.725 0.258 19668 5903 1 16 . 1 1 64 64 ILE N N 64 118.247 118.247 117.910 0.337 19668 5904 1 16 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.892 -0.172 19668 5905 1 16 . 1 1 64 64 ILE C C 64 177.858 177.858 177.226 0.632 19668 5906 1 16 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.019 0.477 19668 5907 1 16 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.459 0.522 19668 5908 1 16 . 1 1 64 64 ILE H H 64 8.261 8.261 7.239 1.022 19668 5909 1 16 . 1 1 65 65 LYS N N 65 118.693 118.693 118.086 0.607 19668 5910 1 16 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.197 -0.099 19668 5911 1 16 . 1 1 65 65 LYS C C 65 177.244 177.244 177.738 -0.494 19668 5912 1 16 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.802 0.851 19668 5913 1 16 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.200 0.505 19668 5914 1 16 . 1 1 65 65 LYS H H 65 7.661 7.661 7.501 0.160 19668 5915 1 16 . 1 1 66 66 LYS N N 66 116.933 116.933 117.287 -0.354 19668 5916 1 16 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.074 0.264 19668 5917 1 16 . 1 1 66 66 LYS C C 66 176.011 176.011 177.521 -1.510 19668 5918 1 16 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.125 -1.666 19668 5919 1 16 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.913 0.218 19668 5920 1 16 . 1 1 66 66 LYS H H 66 7.261 7.261 7.568 -0.307 19668 5921 1 17 . 1 1 2 2 SER HA H 2 4.560 4.560 4.356 0.204 19668 5922 1 17 . 1 1 2 2 SER CA C 2 58.366 58.366 59.369 -1.003 19668 5923 1 17 . 1 1 3 3 ARG N N 3 125.213 125.213 121.893 3.320 19668 5924 1 17 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.184 0.082 19668 5925 1 17 . 1 1 3 3 ARG C C 3 178.381 178.381 178.068 0.313 19668 5926 1 17 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.548 -0.152 19668 5927 1 17 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.462 1.193 19668 5928 1 17 . 1 1 3 3 ARG H H 3 8.874 8.874 8.516 0.358 19668 5929 1 17 . 1 1 4 4 VAL N N 4 119.320 119.320 119.470 -0.150 19668 5930 1 17 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.825 -0.027 19668 5931 1 17 . 1 1 4 4 VAL C C 4 177.004 177.004 177.498 -0.494 19668 5932 1 17 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.506 0.009 19668 5933 1 17 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.577 0.226 19668 5934 1 17 . 1 1 4 4 VAL H H 4 8.112 8.112 7.600 0.512 19668 5935 1 17 . 1 1 5 5 LYS N N 5 122.279 122.279 120.158 2.121 19668 5936 1 17 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.017 0.145 19668 5937 1 17 . 1 1 5 5 LYS C C 5 178.547 178.547 178.319 0.228 19668 5938 1 17 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.713 0.045 19668 5939 1 17 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.821 0.189 19668 5940 1 17 . 1 1 5 5 LYS H H 5 7.847 7.847 7.492 0.355 19668 5941 1 17 . 1 1 6 6 ALA N N 6 120.295 120.295 122.199 -1.904 19668 5942 1 17 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.095 0.116 19668 5943 1 17 . 1 1 6 6 ALA C C 6 180.834 180.834 179.711 1.123 19668 5944 1 17 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.086 -0.183 19668 5945 1 17 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.916 0.216 19668 5946 1 17 . 1 1 6 6 ALA H H 6 7.975 7.975 7.679 0.296 19668 5947 1 17 . 1 1 7 7 LEU N N 7 119.570 119.570 118.512 1.058 19668 5948 1 17 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.079 0.093 19668 5949 1 17 . 1 1 7 7 LEU C C 7 178.431 178.431 178.533 -0.102 19668 5950 1 17 . 1 1 7 7 LEU CA C 7 57.679 57.679 58.047 -0.368 19668 5951 1 17 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.036 0.999 19668 5952 1 17 . 1 1 7 7 LEU H H 7 7.650 7.650 7.574 0.076 19668 5953 1 17 . 1 1 8 8 GLU N N 8 119.934 119.934 118.392 1.542 19668 5954 1 17 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.051 -0.192 19668 5955 1 17 . 1 1 8 8 GLU C C 8 179.534 179.534 178.531 1.003 19668 5956 1 17 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.383 0.654 19668 5957 1 17 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.711 0.756 19668 5958 1 17 . 1 1 8 8 GLU H H 8 8.411 8.411 7.827 0.584 19668 5959 1 17 . 1 1 9 9 GLU N N 9 118.234 118.234 118.987 -0.753 19668 5960 1 17 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.065 -0.005 19668 5961 1 17 . 1 1 9 9 GLU C C 9 179.596 179.596 178.909 0.687 19668 5962 1 17 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.444 -0.113 19668 5963 1 17 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.392 0.026 19668 5964 1 17 . 1 1 9 9 GLU H H 9 8.206 8.206 7.735 0.471 19668 5965 1 17 . 1 1 10 10 LYS N N 10 121.042 121.042 119.036 2.006 19668 5966 1 17 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.145 0.038 19668 5967 1 17 . 1 1 10 10 LYS C C 10 179.380 179.380 179.141 0.239 19668 5968 1 17 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.188 0.138 19668 5969 1 17 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.140 0.269 19668 5970 1 17 . 1 1 10 10 LYS H H 10 7.931 7.931 7.540 0.391 19668 5971 1 17 . 1 1 11 11 VAL N N 11 118.662 118.662 120.083 -1.421 19668 5972 1 17 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.875 -0.061 19668 5973 1 17 . 1 1 11 11 VAL C C 11 178.845 178.845 178.122 0.723 19668 5974 1 17 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.401 1.587 19668 5975 1 17 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.090 0.564 19668 5976 1 17 . 1 1 11 11 VAL H H 11 8.371 8.371 7.611 0.760 19668 5977 1 17 . 1 1 12 12 LYS N N 12 123.188 123.188 120.065 3.123 19668 5978 1 17 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.935 0.291 19668 5979 1 17 . 1 1 12 12 LYS C C 12 179.098 179.098 178.388 0.710 19668 5980 1 17 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.403 0.080 19668 5981 1 17 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.329 -0.123 19668 5982 1 17 . 1 1 12 12 LYS H H 12 8.276 8.276 7.530 0.746 19668 5983 1 17 . 1 1 13 13 ALA N N 13 121.169 121.169 122.147 -0.978 19668 5984 1 17 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.295 -0.037 19668 5985 1 17 . 1 1 13 13 ALA C C 13 180.169 180.169 179.760 0.409 19668 5986 1 17 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.702 -0.066 19668 5987 1 17 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.432 -0.325 19668 5988 1 17 . 1 1 13 13 ALA H H 13 7.829 7.829 7.432 0.397 19668 5989 1 17 . 1 1 14 14 LEU N N 14 118.104 118.104 118.066 0.038 19668 5990 1 17 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.985 0.171 19668 5991 1 17 . 1 1 14 14 LEU C C 14 177.614 177.614 178.017 -0.403 19668 5992 1 17 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.206 -0.601 19668 5993 1 17 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.986 0.809 19668 5994 1 17 . 1 1 14 14 LEU H H 14 7.781 7.781 7.459 0.322 19668 5995 1 17 . 1 1 15 15 GLU N N 15 120.632 120.632 119.021 1.611 19668 5996 1 17 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.382 -0.015 19668 5997 1 17 . 1 1 15 15 GLU C C 15 178.243 178.243 178.630 -0.387 19668 5998 1 17 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.646 0.940 19668 5999 1 17 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.050 0.779 19668 6000 1 17 . 1 1 15 15 GLU H H 15 7.873 7.873 7.324 0.549 19668 6001 1 17 . 1 1 16 16 GLU N N 16 115.775 115.775 117.013 -1.238 19668 6002 1 17 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.975 -0.016 19668 6003 1 17 . 1 1 16 16 GLU C C 16 179.006 179.006 178.670 0.336 19668 6004 1 17 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.803 0.289 19668 6005 1 17 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.471 -0.118 19668 6006 1 17 . 1 1 16 16 GLU H H 16 7.926 7.926 7.749 0.177 19668 6007 1 17 . 1 1 17 17 LYS N N 17 118.801 118.801 119.576 -0.775 19668 6008 1 17 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.091 0.003 19668 6009 1 17 . 1 1 17 17 LYS C C 17 178.853 178.853 178.577 0.276 19668 6010 1 17 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.859 -0.388 19668 6011 1 17 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.892 0.470 19668 6012 1 17 . 1 1 17 17 LYS H H 17 7.518 7.518 7.521 -0.003 19668 6013 1 17 . 1 1 18 18 VAL N N 18 118.034 118.034 119.778 -1.744 19668 6014 1 17 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.703 -0.191 19668 6015 1 17 . 1 1 18 18 VAL C C 18 178.362 178.362 177.941 0.421 19668 6016 1 17 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.878 0.141 19668 6017 1 17 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.703 -0.054 19668 6018 1 17 . 1 1 18 18 VAL H H 18 8.048 8.048 7.432 0.616 19668 6019 1 17 . 1 1 19 19 LYS N N 19 118.427 118.427 117.640 0.787 19668 6020 1 17 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.091 -0.081 19668 6021 1 17 . 1 1 19 19 LYS C C 19 177.706 177.706 177.636 0.070 19668 6022 1 17 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.284 0.701 19668 6023 1 17 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.823 0.601 19668 6024 1 17 . 1 1 19 19 LYS H H 19 8.008 8.008 7.449 0.559 19668 6025 1 17 . 1 1 20 20 ALA N N 20 119.177 119.177 121.046 -1.869 19668 6026 1 17 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.249 0.067 19668 6027 1 17 . 1 1 20 20 ALA C C 20 178.269 178.269 178.226 0.043 19668 6028 1 17 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.354 -0.723 19668 6029 1 17 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.966 0.167 19668 6030 1 17 . 1 1 20 20 ALA H H 20 7.259 7.259 7.419 -0.160 19668 6031 1 17 . 1 1 21 21 LEU N N 21 118.596 118.596 117.512 1.084 19668 6032 1 17 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.428 -0.167 19668 6033 1 17 . 1 1 21 21 LEU C C 21 177.732 177.732 177.107 0.625 19668 6034 1 17 . 1 1 21 21 LEU CA C 21 55.657 55.657 54.774 0.883 19668 6035 1 17 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.461 0.672 19668 6036 1 17 . 1 1 21 21 LEU H H 21 7.373 7.373 7.374 -0.001 19668 6037 1 17 . 1 1 22 22 GLY N N 22 107.926 107.926 108.280 -0.354 19668 6038 1 17 . 1 1 22 22 GLY C C 22 173.362 173.362 175.000 -1.638 19668 6039 1 17 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.197 0.000 19668 6040 1 17 . 1 1 22 22 GLY H H 22 8.144 8.144 8.437 -0.293 19668 6041 1 17 . 1 1 23 23 GLY N N 23 108.242 108.242 108.704 -0.462 19668 6042 1 17 . 1 1 23 23 GLY C C 23 174.110 174.110 174.419 -0.309 19668 6043 1 17 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.664 0.020 19668 6044 1 17 . 1 1 23 23 GLY H H 23 8.157 8.157 7.929 0.228 19668 6045 1 17 . 1 1 24 24 GLY N N 24 106.969 106.969 107.058 -0.089 19668 6046 1 17 . 1 1 24 24 GLY C C 24 175.172 175.172 175.422 -0.250 19668 6047 1 17 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.419 0.020 19668 6048 1 17 . 1 1 24 24 GLY H H 24 8.466 8.466 8.463 0.003 19668 6049 1 17 . 1 1 25 25 GLY N N 25 108.946 108.946 110.854 -1.908 19668 6050 1 17 . 1 1 25 25 GLY C C 25 176.321 176.321 175.268 1.053 19668 6051 1 17 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.706 1.393 19668 6052 1 17 . 1 1 25 25 GLY H H 25 8.618 8.618 8.276 0.342 19668 6053 1 17 . 1 1 26 26 ARG N N 26 123.559 123.559 122.796 0.763 19668 6054 1 17 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.207 0.072 19668 6055 1 17 . 1 1 26 26 ARG C C 26 178.076 178.076 178.054 0.022 19668 6056 1 17 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.010 -1.095 19668 6057 1 17 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.357 -0.447 19668 6058 1 17 . 1 1 26 26 ARG H H 26 8.789 8.789 8.109 0.680 19668 6059 1 17 . 1 1 27 27 ILE N N 27 118.726 118.726 117.578 1.148 19668 6060 1 17 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.967 -0.181 19668 6061 1 17 . 1 1 27 27 ILE C C 27 177.639 177.639 178.102 -0.463 19668 6062 1 17 . 1 1 27 27 ILE CA C 27 63.624 63.624 62.942 0.682 19668 6063 1 17 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.269 0.686 19668 6064 1 17 . 1 1 27 27 ILE H H 27 7.762 7.762 8.363 -0.601 19668 6065 1 17 . 1 1 28 28 GLU N N 28 119.843 119.843 119.360 0.483 19668 6066 1 17 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.043 -0.030 19668 6067 1 17 . 1 1 28 28 GLU C C 28 179.447 179.447 179.121 0.326 19668 6068 1 17 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.131 -0.548 19668 6069 1 17 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.121 -0.061 19668 6070 1 17 . 1 1 28 28 GLU H H 28 7.867 7.867 8.553 -0.686 19668 6071 1 17 . 1 1 29 29 GLU N N 29 118.447 118.447 119.140 -0.693 19668 6072 1 17 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.052 0.035 19668 6073 1 17 . 1 1 29 29 GLU C C 29 179.310 179.310 179.025 0.285 19668 6074 1 17 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.787 0.493 19668 6075 1 17 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.154 0.182 19668 6076 1 17 . 1 1 29 29 GLU H H 29 7.755 7.755 8.018 -0.263 19668 6077 1 17 . 1 1 30 30 LEU N N 30 121.135 121.135 121.283 -0.148 19668 6078 1 17 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.992 0.104 19668 6079 1 17 . 1 1 30 30 LEU C C 30 178.928 178.928 178.718 0.210 19668 6080 1 17 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.227 -0.122 19668 6081 1 17 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.110 -0.430 19668 6082 1 17 . 1 1 30 30 LEU H H 30 7.785 7.785 7.599 0.186 19668 6083 1 17 . 1 1 31 31 LYS N N 31 119.130 119.130 117.787 1.343 19668 6084 1 17 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.113 -0.243 19668 6085 1 17 . 1 1 31 31 LYS C C 31 179.104 179.104 178.832 0.272 19668 6086 1 17 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.458 1.258 19668 6087 1 17 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.815 0.441 19668 6088 1 17 . 1 1 31 31 LYS H H 31 8.413 8.413 7.596 0.817 19668 6089 1 17 . 1 1 32 32 LYS N N 32 119.200 119.200 119.352 -0.152 19668 6090 1 17 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.004 0.098 19668 6091 1 17 . 1 1 32 32 LYS C C 32 179.420 179.420 179.040 0.380 19668 6092 1 17 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.449 0.008 19668 6093 1 17 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.042 0.224 19668 6094 1 17 . 1 1 32 32 LYS H H 32 7.826 7.826 7.496 0.330 19668 6095 1 17 . 1 1 33 33 LYS N N 33 120.322 120.322 119.013 1.309 19668 6096 1 17 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.069 0.094 19668 6097 1 17 . 1 1 33 33 LYS C C 33 179.174 179.174 178.755 0.419 19668 6098 1 17 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.998 -0.250 19668 6099 1 17 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.361 -0.622 19668 6100 1 17 . 1 1 33 33 LYS H H 33 8.003 8.003 7.486 0.517 19668 6101 1 17 . 1 1 34 34 TYR N N 34 120.223 120.223 119.812 0.411 19668 6102 1 17 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.109 -0.052 19668 6103 1 17 . 1 1 34 34 TYR C C 34 176.356 176.356 178.148 -1.792 19668 6104 1 17 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.548 -0.493 19668 6105 1 17 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.295 -0.268 19668 6106 1 17 . 1 1 34 34 TYR H H 34 8.614 8.614 7.597 1.017 19668 6107 1 17 . 1 1 35 35 GLU N N 35 118.813 118.813 117.487 1.326 19668 6108 1 17 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.970 -0.245 19668 6109 1 17 . 1 1 35 35 GLU C C 35 179.787 179.787 179.047 0.740 19668 6110 1 17 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.060 -0.621 19668 6111 1 17 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.073 0.055 19668 6112 1 17 . 1 1 35 35 GLU H H 35 8.103 8.103 7.931 0.172 19668 6113 1 17 . 1 1 36 36 GLU N N 36 119.670 119.670 119.576 0.094 19668 6114 1 17 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.091 -0.077 19668 6115 1 17 . 1 1 36 36 GLU C C 36 179.295 179.295 179.078 0.217 19668 6116 1 17 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.415 -0.152 19668 6117 1 17 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.280 0.289 19668 6118 1 17 . 1 1 36 36 GLU H H 36 8.028 8.028 7.657 0.371 19668 6119 1 17 . 1 1 37 37 LEU N N 37 121.416 121.416 119.681 1.735 19668 6120 1 17 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.982 0.037 19668 6121 1 17 . 1 1 37 37 LEU C C 37 178.277 178.277 178.777 -0.500 19668 6122 1 17 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.123 -0.283 19668 6123 1 17 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.394 0.235 19668 6124 1 17 . 1 1 37 37 LEU H H 37 8.176 8.176 7.414 0.762 19668 6125 1 17 . 1 1 38 38 LYS N N 38 118.998 118.998 118.852 0.146 19668 6126 1 17 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.953 -0.293 19668 6127 1 17 . 1 1 38 38 LYS C C 38 178.923 178.923 179.162 -0.239 19668 6128 1 17 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.944 0.456 19668 6129 1 17 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.169 -0.107 19668 6130 1 17 . 1 1 38 38 LYS H H 38 8.260 8.260 7.627 0.633 19668 6131 1 17 . 1 1 39 39 LYS N N 39 118.070 118.070 118.444 -0.374 19668 6132 1 17 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.042 0.038 19668 6133 1 17 . 1 1 39 39 LYS C C 39 178.687 178.687 178.856 -0.169 19668 6134 1 17 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.506 -0.570 19668 6135 1 17 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.224 -0.075 19668 6136 1 17 . 1 1 39 39 LYS H H 39 7.380 7.380 7.562 -0.182 19668 6137 1 17 . 1 1 40 40 LYS N N 40 118.894 118.894 120.024 -1.130 19668 6138 1 17 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.047 0.012 19668 6139 1 17 . 1 1 40 40 LYS C C 40 179.758 179.758 179.003 0.755 19668 6140 1 17 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.201 -0.139 19668 6141 1 17 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.271 0.117 19668 6142 1 17 . 1 1 40 40 LYS H H 40 7.919 7.919 7.368 0.551 19668 6143 1 17 . 1 1 41 41 ILE N N 41 118.270 118.270 118.770 -0.500 19668 6144 1 17 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.745 -0.048 19668 6145 1 17 . 1 1 41 41 ILE C C 41 178.211 178.211 178.600 -0.389 19668 6146 1 17 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.916 -0.202 19668 6147 1 17 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.738 0.101 19668 6148 1 17 . 1 1 41 41 ILE H H 41 8.199 8.199 7.572 0.627 19668 6149 1 17 . 1 1 42 42 GLU N N 42 120.117 120.117 118.558 1.559 19668 6150 1 17 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.109 -0.018 19668 6151 1 17 . 1 1 42 42 GLU C C 42 178.736 178.736 177.460 1.276 19668 6152 1 17 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.950 -0.070 19668 6153 1 17 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.496 -0.105 19668 6154 1 17 . 1 1 42 42 GLU H H 42 7.738 7.738 7.691 0.047 19668 6155 1 17 . 1 1 43 43 GLU N N 43 117.194 117.194 116.747 0.447 19668 6156 1 17 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.309 -0.010 19668 6157 1 17 . 1 1 43 43 GLU C C 43 177.658 177.658 176.765 0.893 19668 6158 1 17 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.273 0.520 19668 6159 1 17 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.481 -0.548 19668 6160 1 17 . 1 1 43 43 GLU H H 43 7.698 7.698 7.666 0.032 19668 6161 1 17 . 1 1 44 44 LEU N N 44 120.812 120.812 119.671 1.141 19668 6162 1 17 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.153 0.086 19668 6163 1 17 . 1 1 44 44 LEU C C 44 178.682 178.682 178.501 0.181 19668 6164 1 17 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.280 1.216 19668 6165 1 17 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.536 0.111 19668 6166 1 17 . 1 1 44 44 LEU H H 44 7.593 7.593 7.148 0.445 19668 6167 1 17 . 1 1 45 45 GLY N N 45 108.681 108.681 110.629 -1.948 19668 6168 1 17 . 1 1 45 45 GLY C C 45 174.957 174.957 174.569 0.388 19668 6169 1 17 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.719 0.367 19668 6170 1 17 . 1 1 45 45 GLY H H 45 8.234 8.234 8.745 -0.511 19668 6171 1 17 . 1 1 46 46 GLY N N 46 108.057 108.057 106.748 1.309 19668 6172 1 17 . 1 1 46 46 GLY C C 46 174.777 174.777 173.213 1.564 19668 6173 1 17 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.969 0.395 19668 6174 1 17 . 1 1 46 46 GLY H H 46 8.182 8.182 8.191 -0.009 19668 6175 1 17 . 1 1 47 47 GLY N N 47 108.494 108.494 107.182 1.312 19668 6176 1 17 . 1 1 47 47 GLY C C 47 174.572 174.572 174.912 -0.340 19668 6177 1 17 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.533 0.622 19668 6178 1 17 . 1 1 47 47 GLY H H 47 8.087 8.087 7.664 0.423 19668 6179 1 17 . 1 1 48 48 GLY N N 48 108.285 108.285 110.099 -1.814 19668 6180 1 17 . 1 1 48 48 GLY C C 48 174.495 174.495 174.815 -0.320 19668 6181 1 17 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.974 -0.520 19668 6182 1 17 . 1 1 48 48 GLY H H 48 8.323 8.323 8.566 -0.243 19668 6183 1 17 . 1 1 49 49 GLU N N 49 121.070 121.070 121.395 -0.325 19668 6184 1 17 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.588 -0.171 19668 6185 1 17 . 1 1 49 49 GLU C C 49 177.226 177.226 178.052 -0.826 19668 6186 1 17 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.910 -0.339 19668 6187 1 17 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.007 -0.341 19668 6188 1 17 . 1 1 49 49 GLU H H 49 8.483 8.483 7.864 0.619 19668 6189 1 17 . 1 1 50 50 VAL N N 50 121.794 121.794 118.113 3.681 19668 6190 1 17 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.714 0.067 19668 6191 1 17 . 1 1 50 50 VAL C C 50 176.860 176.860 177.326 -0.466 19668 6192 1 17 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.026 0.054 19668 6193 1 17 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.279 0.974 19668 6194 1 17 . 1 1 50 50 VAL H H 50 8.068 8.068 8.004 0.064 19668 6195 1 17 . 1 1 51 51 LYS N N 51 120.593 120.593 119.149 1.444 19668 6196 1 17 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.118 0.089 19668 6197 1 17 . 1 1 51 51 LYS C C 51 178.667 178.667 178.989 -0.322 19668 6198 1 17 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.413 -0.078 19668 6199 1 17 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.749 0.509 19668 6200 1 17 . 1 1 51 51 LYS H H 51 8.253 8.253 8.378 -0.125 19668 6201 1 17 . 1 1 52 52 LYS N N 52 117.572 117.572 120.128 -2.556 19668 6202 1 17 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.059 0.109 19668 6203 1 17 . 1 1 52 52 LYS C C 52 179.248 179.248 178.880 0.368 19668 6204 1 17 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.359 -0.345 19668 6205 1 17 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.390 -0.210 19668 6206 1 17 . 1 1 52 52 LYS H H 52 7.629 7.629 7.450 0.179 19668 6207 1 17 . 1 1 53 53 VAL N N 53 119.059 119.059 119.267 -0.208 19668 6208 1 17 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.891 -0.099 19668 6209 1 17 . 1 1 53 53 VAL C C 53 177.987 177.987 178.022 -0.035 19668 6210 1 17 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.374 -0.343 19668 6211 1 17 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.910 -0.539 19668 6212 1 17 . 1 1 53 53 VAL H H 53 7.638 7.638 7.593 0.045 19668 6213 1 17 . 1 1 54 54 GLU N N 54 120.388 120.388 118.976 1.412 19668 6214 1 17 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.933 -0.089 19668 6215 1 17 . 1 1 54 54 GLU C C 54 179.624 179.624 178.600 1.024 19668 6216 1 17 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.691 0.550 19668 6217 1 17 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.250 0.568 19668 6218 1 17 . 1 1 54 54 GLU H H 54 8.603 8.603 7.659 0.944 19668 6219 1 17 . 1 1 55 55 GLU N N 55 118.533 118.533 119.490 -0.957 19668 6220 1 17 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.044 0.045 19668 6221 1 17 . 1 1 55 55 GLU C C 55 179.158 179.158 178.734 0.424 19668 6222 1 17 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.360 -0.026 19668 6223 1 17 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.787 -0.450 19668 6224 1 17 . 1 1 55 55 GLU H H 55 7.904 7.904 7.624 0.280 19668 6225 1 17 . 1 1 56 56 GLU N N 56 120.258 120.258 118.810 1.448 19668 6226 1 17 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.023 0.077 19668 6227 1 17 . 1 1 56 56 GLU C C 56 179.867 179.867 179.013 0.854 19668 6228 1 17 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.847 0.816 19668 6229 1 17 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.062 0.988 19668 6230 1 17 . 1 1 56 56 GLU H H 56 7.902 7.902 7.635 0.267 19668 6231 1 17 . 1 1 57 57 VAL N N 57 121.168 121.168 120.455 0.713 19668 6232 1 17 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.533 0.035 19668 6233 1 17 . 1 1 57 57 VAL C C 57 176.994 176.994 177.341 -0.347 19668 6234 1 17 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.462 1.434 19668 6235 1 17 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.594 -0.067 19668 6236 1 17 . 1 1 57 57 VAL H H 57 8.613 8.613 7.464 1.149 19668 6237 1 17 . 1 1 58 58 LYS N N 58 120.234 120.234 118.072 2.162 19668 6238 1 17 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.993 0.209 19668 6239 1 17 . 1 1 58 58 LYS C C 58 179.131 179.131 178.877 0.254 19668 6240 1 17 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.051 0.536 19668 6241 1 17 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.908 0.383 19668 6242 1 17 . 1 1 58 58 LYS H H 58 7.810 7.810 7.516 0.294 19668 6243 1 17 . 1 1 59 59 LYS N N 59 118.301 118.301 118.730 -0.429 19668 6244 1 17 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.035 0.058 19668 6245 1 17 . 1 1 59 59 LYS C C 59 179.281 179.281 178.385 0.896 19668 6246 1 17 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.101 0.327 19668 6247 1 17 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.082 0.297 19668 6248 1 17 . 1 1 59 59 LYS H H 59 7.876 7.876 7.428 0.448 19668 6249 1 17 . 1 1 60 60 LEU N N 60 121.224 121.224 120.427 0.797 19668 6250 1 17 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.988 0.246 19668 6251 1 17 . 1 1 60 60 LEU C C 60 178.636 178.636 178.665 -0.029 19668 6252 1 17 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.778 0.379 19668 6253 1 17 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.250 0.384 19668 6254 1 17 . 1 1 60 60 LEU H H 60 7.893 7.893 7.589 0.304 19668 6255 1 17 . 1 1 61 61 GLU N N 61 118.660 118.660 117.954 0.706 19668 6256 1 17 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.057 -0.258 19668 6257 1 17 . 1 1 61 61 GLU C C 61 179.094 179.094 178.786 0.308 19668 6258 1 17 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.133 1.139 19668 6259 1 17 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.755 1.248 19668 6260 1 17 . 1 1 61 61 GLU H H 61 8.644 8.644 7.782 0.862 19668 6261 1 17 . 1 1 62 62 GLU N N 62 117.555 117.555 119.781 -2.226 19668 6262 1 17 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.007 -0.011 19668 6263 1 17 . 1 1 62 62 GLU C C 62 178.940 178.940 179.077 -0.137 19668 6264 1 17 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.380 -0.212 19668 6265 1 17 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.320 0.227 19668 6266 1 17 . 1 1 62 62 GLU H H 62 7.995 7.995 7.530 0.465 19668 6267 1 17 . 1 1 63 63 GLU N N 63 119.097 119.097 118.200 0.897 19668 6268 1 17 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.120 -0.091 19668 6269 1 17 . 1 1 63 63 GLU C C 63 179.890 179.890 179.099 0.791 19668 6270 1 17 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.823 0.518 19668 6271 1 17 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.073 0.594 19668 6272 1 17 . 1 1 63 63 GLU H H 63 7.983 7.983 7.713 0.270 19668 6273 1 17 . 1 1 64 64 ILE N N 64 118.247 118.247 117.904 0.343 19668 6274 1 17 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.849 -0.129 19668 6275 1 17 . 1 1 64 64 ILE C C 64 177.858 177.858 177.610 0.248 19668 6276 1 17 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.164 0.332 19668 6277 1 17 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.402 0.579 19668 6278 1 17 . 1 1 64 64 ILE H H 64 8.261 8.261 7.262 0.999 19668 6279 1 17 . 1 1 65 65 LYS N N 65 118.693 118.693 118.368 0.325 19668 6280 1 17 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.130 -0.032 19668 6281 1 17 . 1 1 65 65 LYS C C 65 177.244 177.244 177.745 -0.501 19668 6282 1 17 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.623 0.030 19668 6283 1 17 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.370 0.335 19668 6284 1 17 . 1 1 65 65 LYS H H 65 7.661 7.661 7.563 0.098 19668 6285 1 17 . 1 1 66 66 LYS N N 66 116.933 116.933 116.931 0.002 19668 6286 1 17 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.131 0.207 19668 6287 1 17 . 1 1 66 66 LYS C C 66 176.011 176.011 176.703 -0.692 19668 6288 1 17 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.476 -1.017 19668 6289 1 17 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.907 0.224 19668 6290 1 17 . 1 1 66 66 LYS H H 66 7.261 7.261 7.700 -0.439 19668 6291 1 18 . 1 1 2 2 SER HA H 2 4.560 4.560 3.989 0.571 19668 6292 1 18 . 1 1 2 2 SER CA C 2 58.366 58.366 60.352 -1.986 19668 6293 1 18 . 1 1 3 3 ARG N N 3 125.213 125.213 122.268 2.945 19668 6294 1 18 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.119 0.147 19668 6295 1 18 . 1 1 3 3 ARG C C 3 178.381 178.381 178.151 0.230 19668 6296 1 18 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.862 -0.466 19668 6297 1 18 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.740 0.915 19668 6298 1 18 . 1 1 3 3 ARG H H 3 8.874 8.874 8.369 0.505 19668 6299 1 18 . 1 1 4 4 VAL N N 4 119.320 119.320 120.104 -0.784 19668 6300 1 18 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.883 -0.085 19668 6301 1 18 . 1 1 4 4 VAL C C 4 177.004 177.004 177.964 -0.960 19668 6302 1 18 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.205 0.310 19668 6303 1 18 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.120 0.683 19668 6304 1 18 . 1 1 4 4 VAL H H 4 8.112 8.112 7.948 0.164 19668 6305 1 18 . 1 1 5 5 LYS N N 5 122.279 122.279 120.817 1.462 19668 6306 1 18 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.048 0.114 19668 6307 1 18 . 1 1 5 5 LYS C C 5 178.547 178.547 178.385 0.162 19668 6308 1 18 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.804 -0.047 19668 6309 1 18 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.747 0.263 19668 6310 1 18 . 1 1 5 5 LYS H H 5 7.847 7.847 8.185 -0.338 19668 6311 1 18 . 1 1 6 6 ALA N N 6 120.295 120.295 121.525 -1.230 19668 6312 1 18 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.040 0.171 19668 6313 1 18 . 1 1 6 6 ALA C C 6 180.834 180.834 179.235 1.599 19668 6314 1 18 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.059 -0.156 19668 6315 1 18 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.293 -0.161 19668 6316 1 18 . 1 1 6 6 ALA H H 6 7.975 7.975 8.257 -0.282 19668 6317 1 18 . 1 1 7 7 LEU N N 7 119.570 119.570 118.295 1.275 19668 6318 1 18 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.085 0.087 19668 6319 1 18 . 1 1 7 7 LEU C C 7 178.431 178.431 178.601 -0.170 19668 6320 1 18 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.813 -0.134 19668 6321 1 18 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.042 0.993 19668 6322 1 18 . 1 1 7 7 LEU H H 7 7.650 7.650 7.653 -0.003 19668 6323 1 18 . 1 1 8 8 GLU N N 8 119.934 119.934 118.426 1.508 19668 6324 1 18 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.066 -0.207 19668 6325 1 18 . 1 1 8 8 GLU C C 8 179.534 179.534 178.545 0.989 19668 6326 1 18 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.338 0.699 19668 6327 1 18 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.742 0.725 19668 6328 1 18 . 1 1 8 8 GLU H H 8 8.411 8.411 7.833 0.578 19668 6329 1 18 . 1 1 9 9 GLU N N 9 118.234 118.234 118.970 -0.736 19668 6330 1 18 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.078 -0.018 19668 6331 1 18 . 1 1 9 9 GLU C C 9 179.596 179.596 178.931 0.665 19668 6332 1 18 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.428 -0.098 19668 6333 1 18 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.377 0.041 19668 6334 1 18 . 1 1 9 9 GLU H H 9 8.206 8.206 7.740 0.466 19668 6335 1 18 . 1 1 10 10 LYS N N 10 121.042 121.042 118.966 2.076 19668 6336 1 18 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.156 0.027 19668 6337 1 18 . 1 1 10 10 LYS C C 10 179.380 179.380 179.181 0.199 19668 6338 1 18 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.164 0.161 19668 6339 1 18 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.135 0.274 19668 6340 1 18 . 1 1 10 10 LYS H H 10 7.931 7.931 7.549 0.382 19668 6341 1 18 . 1 1 11 11 VAL N N 11 118.662 118.662 119.825 -1.163 19668 6342 1 18 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.923 -0.109 19668 6343 1 18 . 1 1 11 11 VAL C C 11 178.845 178.845 178.312 0.533 19668 6344 1 18 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.398 1.590 19668 6345 1 18 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.156 0.498 19668 6346 1 18 . 1 1 11 11 VAL H H 11 8.371 8.371 7.579 0.792 19668 6347 1 18 . 1 1 12 12 LYS N N 12 123.188 123.188 119.827 3.361 19668 6348 1 18 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.980 0.246 19668 6349 1 18 . 1 1 12 12 LYS C C 12 179.098 179.098 178.417 0.681 19668 6350 1 18 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.140 0.343 19668 6351 1 18 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.192 0.014 19668 6352 1 18 . 1 1 12 12 LYS H H 12 8.276 8.276 7.552 0.724 19668 6353 1 18 . 1 1 13 13 ALA N N 13 121.169 121.169 121.596 -0.427 19668 6354 1 18 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.041 0.217 19668 6355 1 18 . 1 1 13 13 ALA C C 13 180.169 180.169 179.319 0.850 19668 6356 1 18 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.894 -0.258 19668 6357 1 18 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.438 -0.331 19668 6358 1 18 . 1 1 13 13 ALA H H 13 7.829 7.829 7.419 0.410 19668 6359 1 18 . 1 1 14 14 LEU N N 14 118.104 118.104 118.287 -0.183 19668 6360 1 18 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.024 0.132 19668 6361 1 18 . 1 1 14 14 LEU C C 14 177.614 177.614 177.855 -0.241 19668 6362 1 18 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.063 -0.458 19668 6363 1 18 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.937 0.858 19668 6364 1 18 . 1 1 14 14 LEU H H 14 7.781 7.781 7.409 0.372 19668 6365 1 18 . 1 1 15 15 GLU N N 15 120.632 120.632 119.035 1.597 19668 6366 1 18 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.365 0.002 19668 6367 1 18 . 1 1 15 15 GLU C C 15 178.243 178.243 178.663 -0.420 19668 6368 1 18 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.537 1.049 19668 6369 1 18 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.904 0.925 19668 6370 1 18 . 1 1 15 15 GLU H H 15 7.873 7.873 7.283 0.590 19668 6371 1 18 . 1 1 16 16 GLU N N 16 115.775 115.775 117.448 -1.673 19668 6372 1 18 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.994 -0.035 19668 6373 1 18 . 1 1 16 16 GLU C C 16 179.006 179.006 178.754 0.252 19668 6374 1 18 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.020 0.072 19668 6375 1 18 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.532 -0.179 19668 6376 1 18 . 1 1 16 16 GLU H H 16 7.926 7.926 7.659 0.267 19668 6377 1 18 . 1 1 17 17 LYS N N 17 118.801 118.801 119.241 -0.440 19668 6378 1 18 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.060 0.034 19668 6379 1 18 . 1 1 17 17 LYS C C 17 178.853 178.853 178.833 0.020 19668 6380 1 18 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.897 -0.426 19668 6381 1 18 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.846 0.516 19668 6382 1 18 . 1 1 17 17 LYS H H 17 7.518 7.518 7.520 -0.002 19668 6383 1 18 . 1 1 18 18 VAL N N 18 118.034 118.034 119.969 -1.935 19668 6384 1 18 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.680 -0.168 19668 6385 1 18 . 1 1 18 18 VAL C C 18 178.362 178.362 178.471 -0.109 19668 6386 1 18 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.016 0.003 19668 6387 1 18 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.430 0.219 19668 6388 1 18 . 1 1 18 18 VAL H H 18 8.048 8.048 7.439 0.609 19668 6389 1 18 . 1 1 19 19 LYS N N 19 118.427 118.427 118.653 -0.226 19668 6390 1 18 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.057 -0.047 19668 6391 1 18 . 1 1 19 19 LYS C C 19 177.706 177.706 177.925 -0.219 19668 6392 1 18 . 1 1 19 19 LYS CA C 19 58.985 58.985 59.142 -0.157 19668 6393 1 18 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.652 0.772 19668 6394 1 18 . 1 1 19 19 LYS H H 19 8.008 8.008 7.566 0.442 19668 6395 1 18 . 1 1 20 20 ALA N N 20 119.177 119.177 120.443 -1.266 19668 6396 1 18 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.364 -0.048 19668 6397 1 18 . 1 1 20 20 ALA C C 20 178.269 178.269 178.581 -0.312 19668 6398 1 18 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.350 -0.719 19668 6399 1 18 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.409 0.724 19668 6400 1 18 . 1 1 20 20 ALA H H 20 7.259 7.259 7.526 -0.267 19668 6401 1 18 . 1 1 21 21 LEU N N 21 118.596 118.596 115.965 2.631 19668 6402 1 18 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.303 -0.042 19668 6403 1 18 . 1 1 21 21 LEU C C 21 177.732 177.732 177.218 0.514 19668 6404 1 18 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.069 -0.412 19668 6405 1 18 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.514 0.619 19668 6406 1 18 . 1 1 21 21 LEU H H 21 7.373 7.373 7.198 0.175 19668 6407 1 18 . 1 1 22 22 GLY N N 22 107.926 107.926 105.235 2.691 19668 6408 1 18 . 1 1 22 22 GLY C C 22 173.362 173.362 174.040 -0.678 19668 6409 1 18 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.490 0.707 19668 6410 1 18 . 1 1 22 22 GLY H H 22 8.144 8.144 7.331 0.813 19668 6411 1 18 . 1 1 23 23 GLY N N 23 108.242 108.242 108.234 0.008 19668 6412 1 18 . 1 1 23 23 GLY C C 23 174.110 174.110 174.204 -0.094 19668 6413 1 18 . 1 1 23 23 GLY CA C 23 44.684 44.684 46.214 -1.530 19668 6414 1 18 . 1 1 23 23 GLY H H 23 8.157 8.157 7.752 0.405 19668 6415 1 18 . 1 1 24 24 GLY N N 24 106.969 106.969 111.822 -4.853 19668 6416 1 18 . 1 1 24 24 GLY C C 24 175.172 175.172 174.033 1.139 19668 6417 1 18 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.555 -0.116 19668 6418 1 18 . 1 1 24 24 GLY H H 24 8.466 8.466 7.657 0.809 19668 6419 1 18 . 1 1 25 25 GLY N N 25 108.946 108.946 113.168 -4.222 19668 6420 1 18 . 1 1 25 25 GLY C C 25 176.321 176.321 174.780 1.541 19668 6421 1 18 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.066 2.033 19668 6422 1 18 . 1 1 25 25 GLY H H 25 8.618 8.618 7.999 0.619 19668 6423 1 18 . 1 1 26 26 ARG N N 26 123.559 123.559 124.078 -0.519 19668 6424 1 18 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.232 0.047 19668 6425 1 18 . 1 1 26 26 ARG C C 26 178.076 178.076 178.205 -0.129 19668 6426 1 18 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.337 -0.422 19668 6427 1 18 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.259 -0.349 19668 6428 1 18 . 1 1 26 26 ARG H H 26 8.789 8.789 8.525 0.264 19668 6429 1 18 . 1 1 27 27 ILE N N 27 118.726 118.726 118.252 0.474 19668 6430 1 18 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.805 -0.019 19668 6431 1 18 . 1 1 27 27 ILE C C 27 177.639 177.639 177.851 -0.212 19668 6432 1 18 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.562 -0.938 19668 6433 1 18 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.603 -0.648 19668 6434 1 18 . 1 1 27 27 ILE H H 27 7.762 7.762 8.154 -0.392 19668 6435 1 18 . 1 1 28 28 GLU N N 28 119.843 119.843 118.750 1.093 19668 6436 1 18 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.041 -0.028 19668 6437 1 18 . 1 1 28 28 GLU C C 28 179.447 179.447 179.566 -0.119 19668 6438 1 18 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.643 -0.060 19668 6439 1 18 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.085 -0.025 19668 6440 1 18 . 1 1 28 28 GLU H H 28 7.867 7.867 7.772 0.095 19668 6441 1 18 . 1 1 29 29 GLU N N 29 118.447 118.447 119.975 -1.528 19668 6442 1 18 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.117 -0.030 19668 6443 1 18 . 1 1 29 29 GLU C C 29 179.310 179.310 178.764 0.546 19668 6444 1 18 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.749 0.531 19668 6445 1 18 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.086 0.250 19668 6446 1 18 . 1 1 29 29 GLU H H 29 7.755 7.755 7.758 -0.003 19668 6447 1 18 . 1 1 30 30 LEU N N 30 121.135 121.135 121.494 -0.359 19668 6448 1 18 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.989 0.107 19668 6449 1 18 . 1 1 30 30 LEU C C 30 178.928 178.928 178.744 0.184 19668 6450 1 18 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.290 -0.185 19668 6451 1 18 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.141 -0.461 19668 6452 1 18 . 1 1 30 30 LEU H H 30 7.785 7.785 7.608 0.177 19668 6453 1 18 . 1 1 31 31 LYS N N 31 119.130 119.130 117.746 1.384 19668 6454 1 18 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.098 -0.228 19668 6455 1 18 . 1 1 31 31 LYS C C 31 179.104 179.104 178.957 0.147 19668 6456 1 18 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.444 1.272 19668 6457 1 18 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.796 0.461 19668 6458 1 18 . 1 1 31 31 LYS H H 31 8.413 8.413 7.670 0.743 19668 6459 1 18 . 1 1 32 32 LYS N N 32 119.200 119.200 119.309 -0.109 19668 6460 1 18 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.013 0.089 19668 6461 1 18 . 1 1 32 32 LYS C C 32 179.420 179.420 178.841 0.579 19668 6462 1 18 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.585 -0.128 19668 6463 1 18 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.251 0.015 19668 6464 1 18 . 1 1 32 32 LYS H H 32 7.826 7.826 7.540 0.286 19668 6465 1 18 . 1 1 33 33 LYS N N 33 120.322 120.322 119.423 0.899 19668 6466 1 18 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.063 0.100 19668 6467 1 18 . 1 1 33 33 LYS C C 33 179.174 179.174 178.750 0.424 19668 6468 1 18 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.999 -0.251 19668 6469 1 18 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.179 -0.440 19668 6470 1 18 . 1 1 33 33 LYS H H 33 8.003 8.003 7.457 0.546 19668 6471 1 18 . 1 1 34 34 TYR N N 34 120.223 120.223 119.465 0.758 19668 6472 1 18 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.095 -0.039 19668 6473 1 18 . 1 1 34 34 TYR C C 34 176.356 176.356 177.969 -1.613 19668 6474 1 18 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.690 -0.635 19668 6475 1 18 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.366 -0.339 19668 6476 1 18 . 1 1 34 34 TYR H H 34 8.614 8.614 7.573 1.041 19668 6477 1 18 . 1 1 35 35 GLU N N 35 118.813 118.813 117.189 1.624 19668 6478 1 18 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.906 -0.181 19668 6479 1 18 . 1 1 35 35 GLU C C 35 179.787 179.787 178.622 1.165 19668 6480 1 18 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.009 -0.570 19668 6481 1 18 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.022 0.106 19668 6482 1 18 . 1 1 35 35 GLU H H 35 8.103 8.103 7.896 0.207 19668 6483 1 18 . 1 1 36 36 GLU N N 36 119.670 119.670 119.547 0.123 19668 6484 1 18 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.079 -0.065 19668 6485 1 18 . 1 1 36 36 GLU C C 36 179.295 179.295 179.001 0.294 19668 6486 1 18 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.091 0.172 19668 6487 1 18 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.506 0.063 19668 6488 1 18 . 1 1 36 36 GLU H H 36 8.028 8.028 7.674 0.354 19668 6489 1 18 . 1 1 37 37 LEU N N 37 121.416 121.416 119.589 1.827 19668 6490 1 18 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.972 0.047 19668 6491 1 18 . 1 1 37 37 LEU C C 37 178.277 178.277 178.974 -0.697 19668 6492 1 18 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.082 -0.242 19668 6493 1 18 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.435 0.194 19668 6494 1 18 . 1 1 37 37 LEU H H 37 8.176 8.176 7.436 0.740 19668 6495 1 18 . 1 1 38 38 LYS N N 38 118.998 118.998 118.452 0.546 19668 6496 1 18 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.939 -0.279 19668 6497 1 18 . 1 1 38 38 LYS C C 38 178.923 178.923 179.162 -0.239 19668 6498 1 18 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.830 0.570 19668 6499 1 18 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.061 0.001 19668 6500 1 18 . 1 1 38 38 LYS H H 38 8.260 8.260 7.650 0.610 19668 6501 1 18 . 1 1 39 39 LYS N N 39 118.070 118.070 118.280 -0.210 19668 6502 1 18 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.025 0.055 19668 6503 1 18 . 1 1 39 39 LYS C C 39 178.687 178.687 178.883 -0.196 19668 6504 1 18 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.480 -0.544 19668 6505 1 18 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.282 -0.133 19668 6506 1 18 . 1 1 39 39 LYS H H 39 7.380 7.380 7.569 -0.189 19668 6507 1 18 . 1 1 40 40 LYS N N 40 118.894 118.894 119.747 -0.853 19668 6508 1 18 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.003 0.056 19668 6509 1 18 . 1 1 40 40 LYS C C 40 179.758 179.758 178.837 0.921 19668 6510 1 18 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.654 -0.592 19668 6511 1 18 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.132 0.256 19668 6512 1 18 . 1 1 40 40 LYS H H 40 7.919 7.919 7.314 0.605 19668 6513 1 18 . 1 1 41 41 ILE N N 41 118.270 118.270 118.976 -0.706 19668 6514 1 18 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.701 -0.004 19668 6515 1 18 . 1 1 41 41 ILE C C 41 178.211 178.211 177.240 0.971 19668 6516 1 18 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.965 -0.251 19668 6517 1 18 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.682 0.157 19668 6518 1 18 . 1 1 41 41 ILE H H 41 8.199 8.199 7.469 0.730 19668 6519 1 18 . 1 1 42 42 GLU N N 42 120.117 120.117 116.794 3.323 19668 6520 1 18 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.066 0.025 19668 6521 1 18 . 1 1 42 42 GLU C C 42 178.736 178.736 177.440 1.296 19668 6522 1 18 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.570 0.310 19668 6523 1 18 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.799 -0.408 19668 6524 1 18 . 1 1 42 42 GLU H H 42 7.738 7.738 7.482 0.256 19668 6525 1 18 . 1 1 43 43 GLU N N 43 117.194 117.194 116.877 0.317 19668 6526 1 18 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.165 0.134 19668 6527 1 18 . 1 1 43 43 GLU C C 43 177.658 177.658 177.608 0.050 19668 6528 1 18 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.619 -0.826 19668 6529 1 18 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.655 -0.722 19668 6530 1 18 . 1 1 43 43 GLU H H 43 7.698 7.698 7.736 -0.038 19668 6531 1 18 . 1 1 44 44 LEU N N 44 120.812 120.812 118.533 2.279 19668 6532 1 18 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.349 -0.110 19668 6533 1 18 . 1 1 44 44 LEU C C 44 178.682 178.682 177.289 1.393 19668 6534 1 18 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.620 0.876 19668 6535 1 18 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.248 0.399 19668 6536 1 18 . 1 1 44 44 LEU H H 44 7.593 7.593 7.606 -0.013 19668 6537 1 18 . 1 1 45 45 GLY N N 45 108.681 108.681 108.539 0.142 19668 6538 1 18 . 1 1 45 45 GLY C C 45 174.957 174.957 173.858 1.099 19668 6539 1 18 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.545 1.541 19668 6540 1 18 . 1 1 45 45 GLY H H 45 8.234 8.234 8.495 -0.261 19668 6541 1 18 . 1 1 46 46 GLY N N 46 108.057 108.057 108.193 -0.136 19668 6542 1 18 . 1 1 46 46 GLY C C 46 174.777 174.777 173.735 1.042 19668 6543 1 18 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.143 1.221 19668 6544 1 18 . 1 1 46 46 GLY H H 46 8.182 8.182 7.605 0.577 19668 6545 1 18 . 1 1 47 47 GLY N N 47 108.494 108.494 107.332 1.162 19668 6546 1 18 . 1 1 47 47 GLY C C 47 174.572 174.572 174.316 0.256 19668 6547 1 18 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.718 0.437 19668 6548 1 18 . 1 1 47 47 GLY H H 47 8.087 8.087 8.116 -0.029 19668 6549 1 18 . 1 1 48 48 GLY N N 48 108.285 108.285 107.003 1.282 19668 6550 1 18 . 1 1 48 48 GLY C C 48 174.495 174.495 174.310 0.185 19668 6551 1 18 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.017 0.437 19668 6552 1 18 . 1 1 48 48 GLY H H 48 8.323 8.323 8.347 -0.024 19668 6553 1 18 . 1 1 49 49 GLU N N 49 121.070 121.070 119.617 1.453 19668 6554 1 18 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.410 0.007 19668 6555 1 18 . 1 1 49 49 GLU C C 49 177.226 177.226 178.120 -0.894 19668 6556 1 18 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.057 -0.486 19668 6557 1 18 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.269 -0.603 19668 6558 1 18 . 1 1 49 49 GLU H H 49 8.483 8.483 7.816 0.667 19668 6559 1 18 . 1 1 50 50 VAL N N 50 121.794 121.794 118.042 3.752 19668 6560 1 18 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.673 0.108 19668 6561 1 18 . 1 1 50 50 VAL C C 50 176.860 176.860 177.518 -0.658 19668 6562 1 18 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.902 -0.822 19668 6563 1 18 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.368 0.885 19668 6564 1 18 . 1 1 50 50 VAL H H 50 8.068 8.068 7.713 0.355 19668 6565 1 18 . 1 1 51 51 LYS N N 51 120.593 120.593 118.314 2.279 19668 6566 1 18 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.115 0.092 19668 6567 1 18 . 1 1 51 51 LYS C C 51 178.667 178.667 178.495 0.172 19668 6568 1 18 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.252 0.083 19668 6569 1 18 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.778 0.480 19668 6570 1 18 . 1 1 51 51 LYS H H 51 8.253 8.253 8.274 -0.021 19668 6571 1 18 . 1 1 52 52 LYS N N 52 117.572 117.572 120.505 -2.933 19668 6572 1 18 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.071 0.097 19668 6573 1 18 . 1 1 52 52 LYS C C 52 179.248 179.248 178.727 0.521 19668 6574 1 18 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.368 -0.354 19668 6575 1 18 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.559 -0.378 19668 6576 1 18 . 1 1 52 52 LYS H H 52 7.629 7.629 7.726 -0.097 19668 6577 1 18 . 1 1 53 53 VAL N N 53 119.059 119.059 118.936 0.123 19668 6578 1 18 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.691 0.101 19668 6579 1 18 . 1 1 53 53 VAL C C 53 177.987 177.987 177.770 0.217 19668 6580 1 18 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.668 -0.637 19668 6581 1 18 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.453 -0.082 19668 6582 1 18 . 1 1 53 53 VAL H H 53 7.638 7.638 7.475 0.163 19668 6583 1 18 . 1 1 54 54 GLU N N 54 120.388 120.388 119.863 0.525 19668 6584 1 18 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.958 -0.114 19668 6585 1 18 . 1 1 54 54 GLU C C 54 179.624 179.624 179.075 0.549 19668 6586 1 18 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.904 0.337 19668 6587 1 18 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.308 0.510 19668 6588 1 18 . 1 1 54 54 GLU H H 54 8.603 8.603 7.694 0.909 19668 6589 1 18 . 1 1 55 55 GLU N N 55 118.533 118.533 118.971 -0.438 19668 6590 1 18 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.065 0.024 19668 6591 1 18 . 1 1 55 55 GLU C C 55 179.158 179.158 179.027 0.131 19668 6592 1 18 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.469 -0.135 19668 6593 1 18 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.448 -0.111 19668 6594 1 18 . 1 1 55 55 GLU H H 55 7.904 7.904 7.649 0.255 19668 6595 1 18 . 1 1 56 56 GLU N N 56 120.258 120.258 119.335 0.923 19668 6596 1 18 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.022 0.078 19668 6597 1 18 . 1 1 56 56 GLU C C 56 179.867 179.867 179.141 0.726 19668 6598 1 18 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.212 0.451 19668 6599 1 18 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.554 0.496 19668 6600 1 18 . 1 1 56 56 GLU H H 56 7.902 7.902 7.465 0.437 19668 6601 1 18 . 1 1 57 57 VAL N N 57 121.168 121.168 119.082 2.086 19668 6602 1 18 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.612 -0.044 19668 6603 1 18 . 1 1 57 57 VAL C C 57 176.994 176.994 177.120 -0.126 19668 6604 1 18 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.049 1.847 19668 6605 1 18 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.621 -0.094 19668 6606 1 18 . 1 1 57 57 VAL H H 57 8.613 8.613 7.504 1.109 19668 6607 1 18 . 1 1 58 58 LYS N N 58 120.234 120.234 119.320 0.914 19668 6608 1 18 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.998 0.204 19668 6609 1 18 . 1 1 58 58 LYS C C 58 179.131 179.131 178.643 0.488 19668 6610 1 18 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.492 0.095 19668 6611 1 18 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.584 0.707 19668 6612 1 18 . 1 1 58 58 LYS H H 58 7.810 7.810 7.548 0.262 19668 6613 1 18 . 1 1 59 59 LYS N N 59 118.301 118.301 118.938 -0.637 19668 6614 1 18 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.055 0.038 19668 6615 1 18 . 1 1 59 59 LYS C C 59 179.281 179.281 178.407 0.874 19668 6616 1 18 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.018 0.410 19668 6617 1 18 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.057 0.322 19668 6618 1 18 . 1 1 59 59 LYS H H 59 7.876 7.876 7.390 0.486 19668 6619 1 18 . 1 1 60 60 LEU N N 60 121.224 121.224 120.324 0.900 19668 6620 1 18 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.000 0.234 19668 6621 1 18 . 1 1 60 60 LEU C C 60 178.636 178.636 178.689 -0.053 19668 6622 1 18 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.760 0.397 19668 6623 1 18 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.286 0.348 19668 6624 1 18 . 1 1 60 60 LEU H H 60 7.893 7.893 7.604 0.289 19668 6625 1 18 . 1 1 61 61 GLU N N 61 118.660 118.660 118.001 0.659 19668 6626 1 18 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.061 -0.262 19668 6627 1 18 . 1 1 61 61 GLU C C 61 179.094 179.094 178.771 0.323 19668 6628 1 18 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.158 1.114 19668 6629 1 18 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.762 1.241 19668 6630 1 18 . 1 1 61 61 GLU H H 61 8.644 8.644 7.802 0.842 19668 6631 1 18 . 1 1 62 62 GLU N N 62 117.555 117.555 119.477 -1.922 19668 6632 1 18 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.022 -0.026 19668 6633 1 18 . 1 1 62 62 GLU C C 62 178.940 178.940 179.117 -0.177 19668 6634 1 18 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.279 -0.111 19668 6635 1 18 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.150 0.397 19668 6636 1 18 . 1 1 62 62 GLU H H 62 7.995 7.995 7.574 0.421 19668 6637 1 18 . 1 1 63 63 GLU N N 63 119.097 119.097 118.297 0.800 19668 6638 1 18 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.148 -0.119 19668 6639 1 18 . 1 1 63 63 GLU C C 63 179.890 179.890 178.985 0.905 19668 6640 1 18 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.780 0.561 19668 6641 1 18 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.139 0.528 19668 6642 1 18 . 1 1 63 63 GLU H H 63 7.983 7.983 7.713 0.270 19668 6643 1 18 . 1 1 64 64 ILE N N 64 118.247 118.247 119.498 -1.251 19668 6644 1 18 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.851 -0.131 19668 6645 1 18 . 1 1 64 64 ILE C C 64 177.858 177.858 178.012 -0.154 19668 6646 1 18 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.437 0.059 19668 6647 1 18 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.435 0.546 19668 6648 1 18 . 1 1 64 64 ILE H H 64 8.261 8.261 7.223 1.038 19668 6649 1 18 . 1 1 65 65 LYS N N 65 118.693 118.693 118.711 -0.018 19668 6650 1 18 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.215 -0.117 19668 6651 1 18 . 1 1 65 65 LYS C C 65 177.244 177.244 177.694 -0.450 19668 6652 1 18 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.997 0.656 19668 6653 1 18 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.099 0.606 19668 6654 1 18 . 1 1 65 65 LYS H H 65 7.661 7.661 7.601 0.060 19668 6655 1 18 . 1 1 66 66 LYS N N 66 116.933 116.933 117.829 -0.896 19668 6656 1 18 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.145 0.193 19668 6657 1 18 . 1 1 66 66 LYS C C 66 176.011 176.011 177.245 -1.234 19668 6658 1 18 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.556 -1.097 19668 6659 1 18 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.730 0.401 19668 6660 1 18 . 1 1 66 66 LYS H H 66 7.261 7.261 7.496 -0.235 19668 6661 1 19 . 1 1 2 2 SER HA H 2 4.560 4.560 3.990 0.570 19668 6662 1 19 . 1 1 2 2 SER CA C 2 58.366 58.366 60.981 -2.615 19668 6663 1 19 . 1 1 3 3 ARG N N 3 125.213 125.213 120.590 4.623 19668 6664 1 19 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.217 0.049 19668 6665 1 19 . 1 1 3 3 ARG C C 3 178.381 178.381 178.226 0.155 19668 6666 1 19 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.868 -0.472 19668 6667 1 19 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.971 0.684 19668 6668 1 19 . 1 1 3 3 ARG H H 3 8.874 8.874 8.417 0.457 19668 6669 1 19 . 1 1 4 4 VAL N N 4 119.320 119.320 119.384 -0.064 19668 6670 1 19 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.828 -0.030 19668 6671 1 19 . 1 1 4 4 VAL C C 4 177.004 177.004 177.676 -0.672 19668 6672 1 19 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.531 -0.016 19668 6673 1 19 . 1 1 4 4 VAL CB C 4 31.803 31.803 30.807 0.996 19668 6674 1 19 . 1 1 4 4 VAL H H 4 8.112 8.112 7.544 0.568 19668 6675 1 19 . 1 1 5 5 LYS N N 5 122.279 122.279 120.703 1.576 19668 6676 1 19 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.988 0.174 19668 6677 1 19 . 1 1 5 5 LYS C C 5 178.547 178.547 178.106 0.441 19668 6678 1 19 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.844 -0.086 19668 6679 1 19 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.600 0.410 19668 6680 1 19 . 1 1 5 5 LYS H H 5 7.847 7.847 7.908 -0.061 19668 6681 1 19 . 1 1 6 6 ALA N N 6 120.295 120.295 122.295 -2.000 19668 6682 1 19 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.089 0.122 19668 6683 1 19 . 1 1 6 6 ALA C C 6 180.834 180.834 179.721 1.113 19668 6684 1 19 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.145 -0.242 19668 6685 1 19 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.882 0.250 19668 6686 1 19 . 1 1 6 6 ALA H H 6 7.975 7.975 7.648 0.327 19668 6687 1 19 . 1 1 7 7 LEU N N 7 119.570 119.570 118.283 1.287 19668 6688 1 19 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.080 0.092 19668 6689 1 19 . 1 1 7 7 LEU C C 7 178.431 178.431 178.650 -0.219 19668 6690 1 19 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.945 -0.266 19668 6691 1 19 . 1 1 7 7 LEU CB C 7 42.035 42.035 40.973 1.062 19668 6692 1 19 . 1 1 7 7 LEU H H 7 7.650 7.650 7.604 0.046 19668 6693 1 19 . 1 1 8 8 GLU N N 8 119.934 119.934 118.443 1.491 19668 6694 1 19 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.063 -0.204 19668 6695 1 19 . 1 1 8 8 GLU C C 8 179.534 179.534 178.543 0.991 19668 6696 1 19 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.352 0.685 19668 6697 1 19 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.731 0.736 19668 6698 1 19 . 1 1 8 8 GLU H H 8 8.411 8.411 7.850 0.561 19668 6699 1 19 . 1 1 9 9 GLU N N 9 118.234 118.234 119.048 -0.814 19668 6700 1 19 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.073 -0.013 19668 6701 1 19 . 1 1 9 9 GLU C C 9 179.596 179.596 178.939 0.657 19668 6702 1 19 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.451 -0.121 19668 6703 1 19 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.402 0.016 19668 6704 1 19 . 1 1 9 9 GLU H H 9 8.206 8.206 7.739 0.467 19668 6705 1 19 . 1 1 10 10 LYS N N 10 121.042 121.042 119.251 1.791 19668 6706 1 19 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.133 0.050 19668 6707 1 19 . 1 1 10 10 LYS C C 10 179.380 179.380 179.099 0.281 19668 6708 1 19 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.119 0.206 19668 6709 1 19 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.133 0.276 19668 6710 1 19 . 1 1 10 10 LYS H H 10 7.931 7.931 7.554 0.377 19668 6711 1 19 . 1 1 11 11 VAL N N 11 118.662 118.662 120.640 -1.978 19668 6712 1 19 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.840 -0.026 19668 6713 1 19 . 1 1 11 11 VAL C C 11 178.845 178.845 178.303 0.542 19668 6714 1 19 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.834 0.154 19668 6715 1 19 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.733 -0.079 19668 6716 1 19 . 1 1 11 11 VAL H H 11 8.371 8.371 7.595 0.776 19668 6717 1 19 . 1 1 12 12 LYS N N 12 123.188 123.188 119.493 3.695 19668 6718 1 19 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.941 0.285 19668 6719 1 19 . 1 1 12 12 LYS C C 12 179.098 179.098 178.323 0.775 19668 6720 1 19 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.253 0.230 19668 6721 1 19 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.262 -0.056 19668 6722 1 19 . 1 1 12 12 LYS H H 12 8.276 8.276 7.514 0.762 19668 6723 1 19 . 1 1 13 13 ALA N N 13 121.169 121.169 121.643 -0.474 19668 6724 1 19 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.022 0.236 19668 6725 1 19 . 1 1 13 13 ALA C C 13 180.169 180.169 179.324 0.845 19668 6726 1 19 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.946 -0.309 19668 6727 1 19 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.425 -0.318 19668 6728 1 19 . 1 1 13 13 ALA H H 13 7.829 7.829 7.421 0.408 19668 6729 1 19 . 1 1 14 14 LEU N N 14 118.104 118.104 118.323 -0.219 19668 6730 1 19 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.008 0.148 19668 6731 1 19 . 1 1 14 14 LEU C C 14 177.614 177.614 177.867 -0.253 19668 6732 1 19 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.156 -0.551 19668 6733 1 19 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.912 0.883 19668 6734 1 19 . 1 1 14 14 LEU H H 14 7.781 7.781 7.388 0.393 19668 6735 1 19 . 1 1 15 15 GLU N N 15 120.632 120.632 118.935 1.697 19668 6736 1 19 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.392 -0.025 19668 6737 1 19 . 1 1 15 15 GLU C C 15 178.243 178.243 178.677 -0.434 19668 6738 1 19 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.526 1.060 19668 6739 1 19 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.898 0.931 19668 6740 1 19 . 1 1 15 15 GLU H H 15 7.873 7.873 7.251 0.622 19668 6741 1 19 . 1 1 16 16 GLU N N 16 115.775 115.775 117.153 -1.378 19668 6742 1 19 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.025 -0.066 19668 6743 1 19 . 1 1 16 16 GLU C C 16 179.006 179.006 178.717 0.289 19668 6744 1 19 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.145 -0.053 19668 6745 1 19 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.506 -0.153 19668 6746 1 19 . 1 1 16 16 GLU H H 16 7.926 7.926 7.660 0.266 19668 6747 1 19 . 1 1 17 17 LYS N N 17 118.801 118.801 119.085 -0.284 19668 6748 1 19 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.103 -0.009 19668 6749 1 19 . 1 1 17 17 LYS C C 17 178.853 178.853 178.836 0.017 19668 6750 1 19 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.820 -0.349 19668 6751 1 19 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.880 0.482 19668 6752 1 19 . 1 1 17 17 LYS H H 17 7.518 7.518 7.440 0.078 19668 6753 1 19 . 1 1 18 18 VAL N N 18 118.034 118.034 120.107 -2.073 19668 6754 1 19 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.623 -0.111 19668 6755 1 19 . 1 1 18 18 VAL C C 18 178.362 178.362 177.695 0.667 19668 6756 1 19 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.993 0.025 19668 6757 1 19 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.705 -0.056 19668 6758 1 19 . 1 1 18 18 VAL H H 18 8.048 8.048 7.423 0.625 19668 6759 1 19 . 1 1 19 19 LYS N N 19 118.427 118.427 117.221 1.206 19668 6760 1 19 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.090 -0.080 19668 6761 1 19 . 1 1 19 19 LYS C C 19 177.706 177.706 177.476 0.230 19668 6762 1 19 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.544 0.441 19668 6763 1 19 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.884 0.540 19668 6764 1 19 . 1 1 19 19 LYS H H 19 8.008 8.008 7.390 0.618 19668 6765 1 19 . 1 1 20 20 ALA N N 20 119.177 119.177 120.525 -1.348 19668 6766 1 19 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.269 0.047 19668 6767 1 19 . 1 1 20 20 ALA C C 20 178.269 178.269 178.850 -0.581 19668 6768 1 19 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.434 -0.803 19668 6769 1 19 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.047 0.086 19668 6770 1 19 . 1 1 20 20 ALA H H 20 7.259 7.259 7.435 -0.176 19668 6771 1 19 . 1 1 21 21 LEU N N 21 118.596 118.596 115.092 3.504 19668 6772 1 19 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.248 0.013 19668 6773 1 19 . 1 1 21 21 LEU C C 21 177.732 177.732 176.957 0.775 19668 6774 1 19 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.842 -0.185 19668 6775 1 19 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.232 0.901 19668 6776 1 19 . 1 1 21 21 LEU H H 21 7.373 7.373 7.200 0.173 19668 6777 1 19 . 1 1 22 22 GLY N N 22 107.926 107.926 105.056 2.870 19668 6778 1 19 . 1 1 22 22 GLY C C 22 173.362 173.362 172.585 0.777 19668 6779 1 19 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.680 0.517 19668 6780 1 19 . 1 1 22 22 GLY H H 22 8.144 8.144 7.245 0.899 19668 6781 1 19 . 1 1 23 23 GLY N N 23 108.242 108.242 105.648 2.594 19668 6782 1 19 . 1 1 23 23 GLY C C 23 174.110 174.110 173.593 0.517 19668 6783 1 19 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.767 -1.083 19668 6784 1 19 . 1 1 23 23 GLY H H 23 8.157 8.157 8.124 0.033 19668 6785 1 19 . 1 1 24 24 GLY N N 24 106.969 106.969 109.553 -2.584 19668 6786 1 19 . 1 1 24 24 GLY C C 24 175.172 175.172 174.606 0.566 19668 6787 1 19 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.121 -0.682 19668 6788 1 19 . 1 1 24 24 GLY H H 24 8.466 8.466 8.045 0.421 19668 6789 1 19 . 1 1 25 25 GLY N N 25 108.946 108.946 110.840 -1.894 19668 6790 1 19 . 1 1 25 25 GLY C C 25 176.321 176.321 174.905 1.416 19668 6791 1 19 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.209 1.890 19668 6792 1 19 . 1 1 25 25 GLY H H 25 8.618 8.618 7.871 0.747 19668 6793 1 19 . 1 1 26 26 ARG N N 26 123.559 123.559 123.347 0.212 19668 6794 1 19 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.399 -0.120 19668 6795 1 19 . 1 1 26 26 ARG C C 26 178.076 178.076 178.479 -0.403 19668 6796 1 19 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.496 -0.581 19668 6797 1 19 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.779 0.131 19668 6798 1 19 . 1 1 26 26 ARG H H 26 8.789 8.789 8.494 0.295 19668 6799 1 19 . 1 1 27 27 ILE N N 27 118.726 118.726 119.246 -0.520 19668 6800 1 19 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.942 -0.156 19668 6801 1 19 . 1 1 27 27 ILE C C 27 177.639 177.639 178.118 -0.479 19668 6802 1 19 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.606 0.018 19668 6803 1 19 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.334 0.622 19668 6804 1 19 . 1 1 27 27 ILE H H 27 7.762 7.762 8.185 -0.423 19668 6805 1 19 . 1 1 28 28 GLU N N 28 119.843 119.843 119.078 0.765 19668 6806 1 19 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.051 -0.038 19668 6807 1 19 . 1 1 28 28 GLU C C 28 179.447 179.447 179.132 0.315 19668 6808 1 19 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.416 0.167 19668 6809 1 19 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.003 0.057 19668 6810 1 19 . 1 1 28 28 GLU H H 28 7.867 7.867 8.697 -0.830 19668 6811 1 19 . 1 1 29 29 GLU N N 29 118.447 118.447 119.459 -1.012 19668 6812 1 19 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.090 -0.003 19668 6813 1 19 . 1 1 29 29 GLU C C 29 179.310 179.310 178.964 0.346 19668 6814 1 19 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.780 0.500 19668 6815 1 19 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.187 0.149 19668 6816 1 19 . 1 1 29 29 GLU H H 29 7.755 7.755 8.027 -0.272 19668 6817 1 19 . 1 1 30 30 LEU N N 30 121.135 121.135 121.427 -0.292 19668 6818 1 19 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.002 0.094 19668 6819 1 19 . 1 1 30 30 LEU C C 30 178.928 178.928 178.736 0.192 19668 6820 1 19 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.214 -0.109 19668 6821 1 19 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.153 -0.473 19668 6822 1 19 . 1 1 30 30 LEU H H 30 7.785 7.785 7.619 0.166 19668 6823 1 19 . 1 1 31 31 LYS N N 31 119.130 119.130 117.859 1.271 19668 6824 1 19 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.108 -0.238 19668 6825 1 19 . 1 1 31 31 LYS C C 31 179.104 179.104 178.999 0.105 19668 6826 1 19 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.452 1.264 19668 6827 1 19 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.811 0.445 19668 6828 1 19 . 1 1 31 31 LYS H H 31 8.413 8.413 7.645 0.768 19668 6829 1 19 . 1 1 32 32 LYS N N 32 119.200 119.200 119.579 -0.379 19668 6830 1 19 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.993 0.109 19668 6831 1 19 . 1 1 32 32 LYS C C 32 179.420 179.420 178.921 0.499 19668 6832 1 19 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.576 -0.119 19668 6833 1 19 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.173 0.093 19668 6834 1 19 . 1 1 32 32 LYS H H 32 7.826 7.826 7.522 0.304 19668 6835 1 19 . 1 1 33 33 LYS N N 33 120.322 120.322 118.816 1.506 19668 6836 1 19 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.045 0.118 19668 6837 1 19 . 1 1 33 33 LYS C C 33 179.174 179.174 178.963 0.211 19668 6838 1 19 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.099 -0.351 19668 6839 1 19 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.436 -0.697 19668 6840 1 19 . 1 1 33 33 LYS H H 33 8.003 8.003 7.446 0.557 19668 6841 1 19 . 1 1 34 34 TYR N N 34 120.223 120.223 119.565 0.658 19668 6842 1 19 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.100 -0.044 19668 6843 1 19 . 1 1 34 34 TYR C C 34 176.356 176.356 178.053 -1.697 19668 6844 1 19 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.607 -0.552 19668 6845 1 19 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.331 -0.304 19668 6846 1 19 . 1 1 34 34 TYR H H 34 8.614 8.614 7.562 1.052 19668 6847 1 19 . 1 1 35 35 GLU N N 35 118.813 118.813 117.608 1.205 19668 6848 1 19 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.907 -0.182 19668 6849 1 19 . 1 1 35 35 GLU C C 35 179.787 179.787 178.692 1.095 19668 6850 1 19 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.767 -0.328 19668 6851 1 19 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.027 0.101 19668 6852 1 19 . 1 1 35 35 GLU H H 35 8.103 8.103 7.882 0.221 19668 6853 1 19 . 1 1 36 36 GLU N N 36 119.670 119.670 119.587 0.083 19668 6854 1 19 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.074 -0.060 19668 6855 1 19 . 1 1 36 36 GLU C C 36 179.295 179.295 179.024 0.271 19668 6856 1 19 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.151 0.112 19668 6857 1 19 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.503 0.066 19668 6858 1 19 . 1 1 36 36 GLU H H 36 8.028 8.028 7.623 0.405 19668 6859 1 19 . 1 1 37 37 LEU N N 37 121.416 121.416 119.715 1.701 19668 6860 1 19 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.000 0.019 19668 6861 1 19 . 1 1 37 37 LEU C C 37 178.277 178.277 178.923 -0.646 19668 6862 1 19 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.931 -0.091 19668 6863 1 19 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.431 0.198 19668 6864 1 19 . 1 1 37 37 LEU H H 37 8.176 8.176 7.345 0.831 19668 6865 1 19 . 1 1 38 38 LYS N N 38 118.998 118.998 118.192 0.806 19668 6866 1 19 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.945 -0.285 19668 6867 1 19 . 1 1 38 38 LYS C C 38 178.923 178.923 178.924 -0.001 19668 6868 1 19 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.090 0.310 19668 6869 1 19 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.071 -0.009 19668 6870 1 19 . 1 1 38 38 LYS H H 38 8.260 8.260 7.633 0.627 19668 6871 1 19 . 1 1 39 39 LYS N N 39 118.070 118.070 117.955 0.115 19668 6872 1 19 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.073 0.007 19668 6873 1 19 . 1 1 39 39 LYS C C 39 178.687 178.687 179.052 -0.365 19668 6874 1 19 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.834 -0.898 19668 6875 1 19 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.236 -0.087 19668 6876 1 19 . 1 1 39 39 LYS H H 39 7.380 7.380 7.800 -0.420 19668 6877 1 19 . 1 1 40 40 LYS N N 40 118.894 118.894 119.613 -0.719 19668 6878 1 19 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.069 -0.010 19668 6879 1 19 . 1 1 40 40 LYS C C 40 179.758 179.758 179.050 0.708 19668 6880 1 19 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.414 -0.352 19668 6881 1 19 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.197 0.191 19668 6882 1 19 . 1 1 40 40 LYS H H 40 7.919 7.919 7.464 0.455 19668 6883 1 19 . 1 1 41 41 ILE N N 41 118.270 118.270 118.485 -0.215 19668 6884 1 19 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.766 -0.069 19668 6885 1 19 . 1 1 41 41 ILE C C 41 178.211 178.211 176.929 1.282 19668 6886 1 19 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.637 0.077 19668 6887 1 19 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.826 0.013 19668 6888 1 19 . 1 1 41 41 ILE H H 41 8.199 8.199 7.444 0.755 19668 6889 1 19 . 1 1 42 42 GLU N N 42 120.117 120.117 117.156 2.961 19668 6890 1 19 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.038 0.053 19668 6891 1 19 . 1 1 42 42 GLU C C 42 178.736 178.736 177.601 1.135 19668 6892 1 19 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.629 0.251 19668 6893 1 19 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.183 -0.792 19668 6894 1 19 . 1 1 42 42 GLU H H 42 7.738 7.738 7.589 0.149 19668 6895 1 19 . 1 1 43 43 GLU N N 43 117.194 117.194 115.958 1.236 19668 6896 1 19 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.205 0.094 19668 6897 1 19 . 1 1 43 43 GLU C C 43 177.658 177.658 177.411 0.247 19668 6898 1 19 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.966 -0.173 19668 6899 1 19 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.763 0.170 19668 6900 1 19 . 1 1 43 43 GLU H H 43 7.698 7.698 7.539 0.159 19668 6901 1 19 . 1 1 44 44 LEU N N 44 120.812 120.812 122.109 -1.297 19668 6902 1 19 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.136 0.103 19668 6903 1 19 . 1 1 44 44 LEU C C 44 178.682 178.682 176.883 1.799 19668 6904 1 19 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.293 1.203 19668 6905 1 19 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.345 0.302 19668 6906 1 19 . 1 1 44 44 LEU H H 44 7.593 7.593 7.337 0.256 19668 6907 1 19 . 1 1 45 45 GLY N N 45 108.681 108.681 110.940 -2.259 19668 6908 1 19 . 1 1 45 45 GLY C C 45 174.957 174.957 174.889 0.068 19668 6909 1 19 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.420 0.666 19668 6910 1 19 . 1 1 45 45 GLY H H 45 8.234 8.234 8.250 -0.016 19668 6911 1 19 . 1 1 46 46 GLY N N 46 108.057 108.057 110.195 -2.138 19668 6912 1 19 . 1 1 46 46 GLY C C 46 174.777 174.777 173.857 0.920 19668 6913 1 19 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.503 -0.139 19668 6914 1 19 . 1 1 46 46 GLY H H 46 8.182 8.182 8.458 -0.276 19668 6915 1 19 . 1 1 47 47 GLY N N 47 108.494 108.494 105.196 3.298 19668 6916 1 19 . 1 1 47 47 GLY C C 47 174.572 174.572 174.304 0.268 19668 6917 1 19 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.320 0.835 19668 6918 1 19 . 1 1 47 47 GLY H H 47 8.087 8.087 7.672 0.415 19668 6919 1 19 . 1 1 48 48 GLY N N 48 108.285 108.285 108.437 -0.152 19668 6920 1 19 . 1 1 48 48 GLY C C 48 174.495 174.495 175.184 -0.689 19668 6921 1 19 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.063 -0.610 19668 6922 1 19 . 1 1 48 48 GLY H H 48 8.323 8.323 8.462 -0.139 19668 6923 1 19 . 1 1 49 49 GLU N N 49 121.070 121.070 121.694 -0.624 19668 6924 1 19 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.498 -0.081 19668 6925 1 19 . 1 1 49 49 GLU C C 49 177.226 177.226 178.254 -1.028 19668 6926 1 19 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.733 -0.162 19668 6927 1 19 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.772 -0.106 19668 6928 1 19 . 1 1 49 49 GLU H H 49 8.483 8.483 7.865 0.618 19668 6929 1 19 . 1 1 50 50 VAL N N 50 121.794 121.794 115.496 6.298 19668 6930 1 19 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.724 0.057 19668 6931 1 19 . 1 1 50 50 VAL C C 50 176.860 176.860 177.864 -1.004 19668 6932 1 19 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.341 -0.261 19668 6933 1 19 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.185 1.068 19668 6934 1 19 . 1 1 50 50 VAL H H 50 8.068 8.068 7.994 0.074 19668 6935 1 19 . 1 1 51 51 LYS N N 51 120.593 120.593 119.312 1.281 19668 6936 1 19 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.099 0.108 19668 6937 1 19 . 1 1 51 51 LYS C C 51 178.667 178.667 178.832 -0.165 19668 6938 1 19 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.025 0.310 19668 6939 1 19 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.631 0.627 19668 6940 1 19 . 1 1 51 51 LYS H H 51 8.253 8.253 8.272 -0.019 19668 6941 1 19 . 1 1 52 52 LYS N N 52 117.572 117.572 119.584 -2.012 19668 6942 1 19 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.066 0.102 19668 6943 1 19 . 1 1 52 52 LYS C C 52 179.248 179.248 178.864 0.384 19668 6944 1 19 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.263 -0.249 19668 6945 1 19 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.150 0.030 19668 6946 1 19 . 1 1 52 52 LYS H H 52 7.629 7.629 7.387 0.242 19668 6947 1 19 . 1 1 53 53 VAL N N 53 119.059 119.059 118.047 1.012 19668 6948 1 19 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.693 0.099 19668 6949 1 19 . 1 1 53 53 VAL C C 53 177.987 177.987 177.852 0.135 19668 6950 1 19 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.184 -0.153 19668 6951 1 19 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.105 0.266 19668 6952 1 19 . 1 1 53 53 VAL H H 53 7.638 7.638 7.684 -0.046 19668 6953 1 19 . 1 1 54 54 GLU N N 54 120.388 120.388 119.608 0.780 19668 6954 1 19 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.927 -0.083 19668 6955 1 19 . 1 1 54 54 GLU C C 54 179.624 179.624 178.921 0.703 19668 6956 1 19 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.900 0.341 19668 6957 1 19 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.389 0.429 19668 6958 1 19 . 1 1 54 54 GLU H H 54 8.603 8.603 7.586 1.017 19668 6959 1 19 . 1 1 55 55 GLU N N 55 118.533 118.533 118.721 -0.188 19668 6960 1 19 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.036 0.053 19668 6961 1 19 . 1 1 55 55 GLU C C 55 179.158 179.158 178.900 0.258 19668 6962 1 19 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.095 0.239 19668 6963 1 19 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.006 0.331 19668 6964 1 19 . 1 1 55 55 GLU H H 55 7.904 7.904 7.678 0.226 19668 6965 1 19 . 1 1 56 56 GLU N N 56 120.258 120.258 119.874 0.384 19668 6966 1 19 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.022 0.078 19668 6967 1 19 . 1 1 56 56 GLU C C 56 179.867 179.867 179.062 0.805 19668 6968 1 19 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.986 0.677 19668 6969 1 19 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.409 0.641 19668 6970 1 19 . 1 1 56 56 GLU H H 56 7.902 7.902 7.478 0.424 19668 6971 1 19 . 1 1 57 57 VAL N N 57 121.168 121.168 120.219 0.949 19668 6972 1 19 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.573 -0.005 19668 6973 1 19 . 1 1 57 57 VAL C C 57 176.994 176.994 177.423 -0.429 19668 6974 1 19 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.742 2.155 19668 6975 1 19 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.436 0.091 19668 6976 1 19 . 1 1 57 57 VAL H H 57 8.613 8.613 7.514 1.099 19668 6977 1 19 . 1 1 58 58 LYS N N 58 120.234 120.234 118.380 1.854 19668 6978 1 19 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.980 0.222 19668 6979 1 19 . 1 1 58 58 LYS C C 58 179.131 179.131 178.843 0.288 19668 6980 1 19 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.764 -0.177 19668 6981 1 19 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.131 0.160 19668 6982 1 19 . 1 1 58 58 LYS H H 58 7.810 7.810 7.489 0.321 19668 6983 1 19 . 1 1 59 59 LYS N N 59 118.301 118.301 118.747 -0.446 19668 6984 1 19 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.019 0.074 19668 6985 1 19 . 1 1 59 59 LYS C C 59 179.281 179.281 178.486 0.795 19668 6986 1 19 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.101 0.327 19668 6987 1 19 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.054 0.325 19668 6988 1 19 . 1 1 59 59 LYS H H 59 7.876 7.876 7.345 0.531 19668 6989 1 19 . 1 1 60 60 LEU N N 60 121.224 121.224 120.271 0.953 19668 6990 1 19 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.987 0.247 19668 6991 1 19 . 1 1 60 60 LEU C C 60 178.636 178.636 178.684 -0.048 19668 6992 1 19 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.825 0.332 19668 6993 1 19 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.315 0.319 19668 6994 1 19 . 1 1 60 60 LEU H H 60 7.893 7.893 7.552 0.341 19668 6995 1 19 . 1 1 61 61 GLU N N 61 118.660 118.660 117.914 0.746 19668 6996 1 19 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.058 -0.259 19668 6997 1 19 . 1 1 61 61 GLU C C 61 179.094 179.094 178.745 0.349 19668 6998 1 19 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.142 1.131 19668 6999 1 19 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.732 1.271 19668 7000 1 19 . 1 1 61 61 GLU H H 61 8.644 8.644 7.802 0.842 19668 7001 1 19 . 1 1 62 62 GLU N N 62 117.555 117.555 119.491 -1.936 19668 7002 1 19 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.024 -0.027 19668 7003 1 19 . 1 1 62 62 GLU C C 62 178.940 178.940 179.148 -0.208 19668 7004 1 19 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.261 -0.093 19668 7005 1 19 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.172 0.375 19668 7006 1 19 . 1 1 62 62 GLU H H 62 7.995 7.995 7.569 0.426 19668 7007 1 19 . 1 1 63 63 GLU N N 63 119.097 119.097 118.344 0.753 19668 7008 1 19 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.148 -0.119 19668 7009 1 19 . 1 1 63 63 GLU C C 63 179.890 179.890 178.974 0.916 19668 7010 1 19 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.666 0.675 19668 7011 1 19 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.058 0.609 19668 7012 1 19 . 1 1 63 63 GLU H H 63 7.983 7.983 7.712 0.271 19668 7013 1 19 . 1 1 64 64 ILE N N 64 118.247 118.247 119.675 -1.428 19668 7014 1 19 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.817 -0.097 19668 7015 1 19 . 1 1 64 64 ILE C C 64 177.858 177.858 178.408 -0.550 19668 7016 1 19 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.540 -0.044 19668 7017 1 19 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.504 0.477 19668 7018 1 19 . 1 1 64 64 ILE H H 64 8.261 8.261 7.225 1.036 19668 7019 1 19 . 1 1 65 65 LYS N N 65 118.693 118.693 118.950 -0.257 19668 7020 1 19 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.198 -0.100 19668 7021 1 19 . 1 1 65 65 LYS C C 65 177.244 177.244 177.859 -0.615 19668 7022 1 19 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.891 0.762 19668 7023 1 19 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.008 0.697 19668 7024 1 19 . 1 1 65 65 LYS H H 65 7.661 7.661 7.561 0.100 19668 7025 1 19 . 1 1 66 66 LYS N N 66 116.933 116.933 117.667 -0.734 19668 7026 1 19 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.161 0.177 19668 7027 1 19 . 1 1 66 66 LYS C C 66 176.011 176.011 176.978 -0.967 19668 7028 1 19 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.413 -0.954 19668 7029 1 19 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.651 0.480 19668 7030 1 19 . 1 1 66 66 LYS H H 66 7.261 7.261 7.527 -0.266 19668 7031 1 20 . 1 1 2 2 SER HA H 2 4.560 4.560 4.497 0.063 19668 7032 1 20 . 1 1 2 2 SER CA C 2 58.366 58.366 58.787 -0.421 19668 7033 1 20 . 1 1 3 3 ARG N N 3 125.213 125.213 121.653 3.560 19668 7034 1 20 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.340 -0.074 19668 7035 1 20 . 1 1 3 3 ARG C C 3 178.381 178.381 177.945 0.436 19668 7036 1 20 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.294 0.102 19668 7037 1 20 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.371 1.284 19668 7038 1 20 . 1 1 3 3 ARG H H 3 8.874 8.874 8.484 0.390 19668 7039 1 20 . 1 1 4 4 VAL N N 4 119.320 119.320 119.521 -0.201 19668 7040 1 20 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.752 0.046 19668 7041 1 20 . 1 1 4 4 VAL C C 4 177.004 177.004 177.741 -0.737 19668 7042 1 20 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.570 -0.055 19668 7043 1 20 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.477 0.326 19668 7044 1 20 . 1 1 4 4 VAL H H 4 8.112 8.112 8.065 0.047 19668 7045 1 20 . 1 1 5 5 LYS N N 5 122.279 122.279 119.912 2.367 19668 7046 1 20 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.019 0.143 19668 7047 1 20 . 1 1 5 5 LYS C C 5 178.547 178.547 177.986 0.561 19668 7048 1 20 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.817 -0.059 19668 7049 1 20 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.832 0.178 19668 7050 1 20 . 1 1 5 5 LYS H H 5 7.847 7.847 7.737 0.110 19668 7051 1 20 . 1 1 6 6 ALA N N 6 120.295 120.295 121.574 -1.279 19668 7052 1 20 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.038 0.173 19668 7053 1 20 . 1 1 6 6 ALA C C 6 180.834 180.834 179.214 1.620 19668 7054 1 20 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.141 -0.238 19668 7055 1 20 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.011 0.121 19668 7056 1 20 . 1 1 6 6 ALA H H 6 7.975 7.975 7.528 0.447 19668 7057 1 20 . 1 1 7 7 LEU N N 7 119.570 119.570 118.388 1.182 19668 7058 1 20 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.077 0.095 19668 7059 1 20 . 1 1 7 7 LEU C C 7 178.431 178.431 178.543 -0.112 19668 7060 1 20 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.982 -0.303 19668 7061 1 20 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.033 1.002 19668 7062 1 20 . 1 1 7 7 LEU H H 7 7.650 7.650 7.575 0.075 19668 7063 1 20 . 1 1 8 8 GLU N N 8 119.934 119.934 118.474 1.460 19668 7064 1 20 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.061 -0.202 19668 7065 1 20 . 1 1 8 8 GLU C C 8 179.534 179.534 178.572 0.962 19668 7066 1 20 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.339 0.698 19668 7067 1 20 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.728 0.739 19668 7068 1 20 . 1 1 8 8 GLU H H 8 8.411 8.411 7.835 0.576 19668 7069 1 20 . 1 1 9 9 GLU N N 9 118.234 118.234 119.057 -0.823 19668 7070 1 20 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.069 -0.009 19668 7071 1 20 . 1 1 9 9 GLU C C 9 179.596 179.596 178.883 0.713 19668 7072 1 20 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.443 -0.113 19668 7073 1 20 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.414 0.004 19668 7074 1 20 . 1 1 9 9 GLU H H 9 8.206 8.206 7.742 0.464 19668 7075 1 20 . 1 1 10 10 LYS N N 10 121.042 121.042 119.144 1.898 19668 7076 1 20 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.126 0.057 19668 7077 1 20 . 1 1 10 10 LYS C C 10 179.380 179.380 179.057 0.323 19668 7078 1 20 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.141 0.184 19668 7079 1 20 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.114 0.295 19668 7080 1 20 . 1 1 10 10 LYS H H 10 7.931 7.931 7.559 0.371 19668 7081 1 20 . 1 1 11 11 VAL N N 11 118.662 118.662 120.460 -1.798 19668 7082 1 20 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.793 0.021 19668 7083 1 20 . 1 1 11 11 VAL C C 11 178.845 178.845 178.232 0.613 19668 7084 1 20 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.860 0.128 19668 7085 1 20 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.651 0.003 19668 7086 1 20 . 1 1 11 11 VAL H H 11 8.371 8.371 7.593 0.778 19668 7087 1 20 . 1 1 12 12 LYS N N 12 123.188 123.188 119.534 3.654 19668 7088 1 20 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.928 0.298 19668 7089 1 20 . 1 1 12 12 LYS C C 12 179.098 179.098 178.275 0.823 19668 7090 1 20 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.193 0.290 19668 7091 1 20 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.210 -0.004 19668 7092 1 20 . 1 1 12 12 LYS H H 12 8.276 8.276 7.492 0.784 19668 7093 1 20 . 1 1 13 13 ALA N N 13 121.169 121.169 121.764 -0.595 19668 7094 1 20 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.072 0.186 19668 7095 1 20 . 1 1 13 13 ALA C C 13 180.169 180.169 179.809 0.360 19668 7096 1 20 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.768 -0.132 19668 7097 1 20 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.283 -0.176 19668 7098 1 20 . 1 1 13 13 ALA H H 13 7.829 7.829 7.432 0.397 19668 7099 1 20 . 1 1 14 14 LEU N N 14 118.104 118.104 118.156 -0.052 19668 7100 1 20 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.008 0.148 19668 7101 1 20 . 1 1 14 14 LEU C C 14 177.614 177.614 178.002 -0.388 19668 7102 1 20 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.181 -0.576 19668 7103 1 20 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.967 0.828 19668 7104 1 20 . 1 1 14 14 LEU H H 14 7.781 7.781 7.426 0.355 19668 7105 1 20 . 1 1 15 15 GLU N N 15 120.632 120.632 118.226 2.406 19668 7106 1 20 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.407 -0.040 19668 7107 1 20 . 1 1 15 15 GLU C C 15 178.243 178.243 178.251 -0.008 19668 7108 1 20 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.816 0.770 19668 7109 1 20 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.218 0.611 19668 7110 1 20 . 1 1 15 15 GLU H H 15 7.873 7.873 7.466 0.407 19668 7111 1 20 . 1 1 16 16 GLU N N 16 115.775 115.775 116.890 -1.115 19668 7112 1 20 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.998 -0.039 19668 7113 1 20 . 1 1 16 16 GLU C C 16 179.006 179.006 178.481 0.525 19668 7114 1 20 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.093 -0.001 19668 7115 1 20 . 1 1 16 16 GLU CB C 16 29.353 29.353 28.959 0.394 19668 7116 1 20 . 1 1 16 16 GLU H H 16 7.926 7.926 7.857 0.069 19668 7117 1 20 . 1 1 17 17 LYS N N 17 118.801 118.801 118.990 -0.189 19668 7118 1 20 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.091 0.003 19668 7119 1 20 . 1 1 17 17 LYS C C 17 178.853 178.853 178.508 0.345 19668 7120 1 20 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.925 -0.454 19668 7121 1 20 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.893 0.469 19668 7122 1 20 . 1 1 17 17 LYS H H 17 7.518 7.518 7.733 -0.215 19668 7123 1 20 . 1 1 18 18 VAL N N 18 118.034 118.034 119.643 -1.609 19668 7124 1 20 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.688 -0.176 19668 7125 1 20 . 1 1 18 18 VAL C C 18 178.362 178.362 177.595 0.767 19668 7126 1 20 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.397 -0.378 19668 7127 1 20 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.695 -0.045 19668 7128 1 20 . 1 1 18 18 VAL H H 18 8.048 8.048 7.189 0.859 19668 7129 1 20 . 1 1 19 19 LYS N N 19 118.427 118.427 117.840 0.587 19668 7130 1 20 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.213 -0.203 19668 7131 1 20 . 1 1 19 19 LYS C C 19 177.706 177.706 177.346 0.360 19668 7132 1 20 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.447 0.538 19668 7133 1 20 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.979 0.445 19668 7134 1 20 . 1 1 19 19 LYS H H 19 8.008 8.008 7.381 0.627 19668 7135 1 20 . 1 1 20 20 ALA N N 20 119.177 119.177 120.625 -1.448 19668 7136 1 20 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.218 0.098 19668 7137 1 20 . 1 1 20 20 ALA C C 20 178.269 178.269 179.455 -1.186 19668 7138 1 20 . 1 1 20 20 ALA CA C 20 52.631 52.631 54.117 -1.486 19668 7139 1 20 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.706 0.427 19668 7140 1 20 . 1 1 20 20 ALA H H 20 7.259 7.259 7.447 -0.188 19668 7141 1 20 . 1 1 21 21 LEU N N 21 118.596 118.596 113.872 4.724 19668 7142 1 20 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.184 0.077 19668 7143 1 20 . 1 1 21 21 LEU C C 21 177.732 177.732 176.962 0.770 19668 7144 1 20 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.742 -0.085 19668 7145 1 20 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.235 0.898 19668 7146 1 20 . 1 1 21 21 LEU H H 21 7.373 7.373 7.309 0.064 19668 7147 1 20 . 1 1 22 22 GLY N N 22 107.926 107.926 105.014 2.912 19668 7148 1 20 . 1 1 22 22 GLY C C 22 173.362 173.362 172.737 0.625 19668 7149 1 20 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.505 0.692 19668 7150 1 20 . 1 1 22 22 GLY H H 22 8.144 8.144 7.153 0.991 19668 7151 1 20 . 1 1 23 23 GLY N N 23 108.242 108.242 106.527 1.715 19668 7152 1 20 . 1 1 23 23 GLY C C 23 174.110 174.110 172.984 1.126 19668 7153 1 20 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.366 -0.682 19668 7154 1 20 . 1 1 23 23 GLY H H 23 8.157 8.157 8.006 0.151 19668 7155 1 20 . 1 1 24 24 GLY N N 24 106.969 106.969 110.010 -3.041 19668 7156 1 20 . 1 1 24 24 GLY C C 24 175.172 175.172 174.768 0.404 19668 7157 1 20 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.127 -0.688 19668 7158 1 20 . 1 1 24 24 GLY H H 24 8.466 8.466 8.433 0.033 19668 7159 1 20 . 1 1 25 25 GLY N N 25 108.946 108.946 113.882 -4.936 19668 7160 1 20 . 1 1 25 25 GLY C C 25 176.321 176.321 175.492 0.829 19668 7161 1 20 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.406 1.693 19668 7162 1 20 . 1 1 25 25 GLY H H 25 8.618 8.618 8.093 0.525 19668 7163 1 20 . 1 1 26 26 ARG N N 26 123.559 123.559 124.135 -0.576 19668 7164 1 20 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.066 0.213 19668 7165 1 20 . 1 1 26 26 ARG C C 26 178.076 178.076 178.337 -0.261 19668 7166 1 20 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.663 -0.748 19668 7167 1 20 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.091 -0.181 19668 7168 1 20 . 1 1 26 26 ARG H H 26 8.789 8.789 8.184 0.605 19668 7169 1 20 . 1 1 27 27 ILE N N 27 118.726 118.726 119.510 -0.784 19668 7170 1 20 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.785 0.001 19668 7171 1 20 . 1 1 27 27 ILE C C 27 177.639 177.639 178.022 -0.383 19668 7172 1 20 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.682 -1.058 19668 7173 1 20 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.448 -0.493 19668 7174 1 20 . 1 1 27 27 ILE H H 27 7.762 7.762 7.914 -0.152 19668 7175 1 20 . 1 1 28 28 GLU N N 28 119.843 119.843 119.309 0.534 19668 7176 1 20 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.009 0.004 19668 7177 1 20 . 1 1 28 28 GLU C C 28 179.447 179.447 178.980 0.467 19668 7178 1 20 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.138 -0.555 19668 7179 1 20 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.422 -0.361 19668 7180 1 20 . 1 1 28 28 GLU H H 28 7.867 7.867 8.458 -0.591 19668 7181 1 20 . 1 1 29 29 GLU N N 29 118.447 118.447 119.369 -0.922 19668 7182 1 20 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.044 0.043 19668 7183 1 20 . 1 1 29 29 GLU C C 29 179.310 179.310 178.912 0.398 19668 7184 1 20 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.919 0.360 19668 7185 1 20 . 1 1 29 29 GLU CB C 29 29.336 29.336 28.917 0.419 19668 7186 1 20 . 1 1 29 29 GLU H H 29 7.755 7.755 8.545 -0.790 19668 7187 1 20 . 1 1 30 30 LEU N N 30 121.135 121.135 120.722 0.413 19668 7188 1 20 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.993 0.103 19668 7189 1 20 . 1 1 30 30 LEU C C 30 178.928 178.928 178.700 0.228 19668 7190 1 20 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.245 -0.140 19668 7191 1 20 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.069 -0.389 19668 7192 1 20 . 1 1 30 30 LEU H H 30 7.785 7.785 7.582 0.203 19668 7193 1 20 . 1 1 31 31 LYS N N 31 119.130 119.130 117.789 1.341 19668 7194 1 20 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.138 -0.268 19668 7195 1 20 . 1 1 31 31 LYS C C 31 179.104 179.104 179.028 0.076 19668 7196 1 20 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.353 1.363 19668 7197 1 20 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.857 0.399 19668 7198 1 20 . 1 1 31 31 LYS H H 31 8.413 8.413 7.555 0.858 19668 7199 1 20 . 1 1 32 32 LYS N N 32 119.200 119.200 119.405 -0.205 19668 7200 1 20 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.005 0.097 19668 7201 1 20 . 1 1 32 32 LYS C C 32 179.420 179.420 179.043 0.377 19668 7202 1 20 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.439 0.018 19668 7203 1 20 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.142 0.124 19668 7204 1 20 . 1 1 32 32 LYS H H 32 7.826 7.826 7.557 0.269 19668 7205 1 20 . 1 1 33 33 LYS N N 33 120.322 120.322 119.236 1.086 19668 7206 1 20 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.054 0.109 19668 7207 1 20 . 1 1 33 33 LYS C C 33 179.174 179.174 178.909 0.265 19668 7208 1 20 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.043 -0.295 19668 7209 1 20 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.218 -0.479 19668 7210 1 20 . 1 1 33 33 LYS H H 33 8.003 8.003 7.593 0.410 19668 7211 1 20 . 1 1 34 34 TYR N N 34 120.223 120.223 117.626 2.597 19668 7212 1 20 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.171 -0.115 19668 7213 1 20 . 1 1 34 34 TYR C C 34 176.356 176.356 177.766 -1.410 19668 7214 1 20 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.258 -0.203 19668 7215 1 20 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.095 -0.068 19668 7216 1 20 . 1 1 34 34 TYR H H 34 8.614 8.614 7.477 1.137 19668 7217 1 20 . 1 1 35 35 GLU N N 35 118.813 118.813 117.117 1.696 19668 7218 1 20 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.925 -0.200 19668 7219 1 20 . 1 1 35 35 GLU C C 35 179.787 179.787 178.700 1.087 19668 7220 1 20 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.069 -0.630 19668 7221 1 20 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.036 0.092 19668 7222 1 20 . 1 1 35 35 GLU H H 35 8.103 8.103 7.889 0.214 19668 7223 1 20 . 1 1 36 36 GLU N N 36 119.670 119.670 119.685 -0.015 19668 7224 1 20 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.093 -0.079 19668 7225 1 20 . 1 1 36 36 GLU C C 36 179.295 179.295 179.064 0.231 19668 7226 1 20 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.254 0.009 19668 7227 1 20 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.506 0.063 19668 7228 1 20 . 1 1 36 36 GLU H H 36 8.028 8.028 7.600 0.428 19668 7229 1 20 . 1 1 37 37 LEU N N 37 121.416 121.416 119.272 2.144 19668 7230 1 20 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.996 0.023 19668 7231 1 20 . 1 1 37 37 LEU C C 37 178.277 178.277 179.130 -0.853 19668 7232 1 20 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.121 -0.281 19668 7233 1 20 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.436 0.193 19668 7234 1 20 . 1 1 37 37 LEU H H 37 8.176 8.176 7.442 0.734 19668 7235 1 20 . 1 1 38 38 LYS N N 38 118.998 118.998 118.635 0.363 19668 7236 1 20 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.929 -0.269 19668 7237 1 20 . 1 1 38 38 LYS C C 38 178.923 178.923 179.070 -0.147 19668 7238 1 20 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.946 0.454 19668 7239 1 20 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.050 0.012 19668 7240 1 20 . 1 1 38 38 LYS H H 38 8.260 8.260 7.664 0.596 19668 7241 1 20 . 1 1 39 39 LYS N N 39 118.070 118.070 119.397 -1.327 19668 7242 1 20 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.037 0.043 19668 7243 1 20 . 1 1 39 39 LYS C C 39 178.687 178.687 178.815 -0.128 19668 7244 1 20 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.528 -0.592 19668 7245 1 20 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.346 -0.197 19668 7246 1 20 . 1 1 39 39 LYS H H 39 7.380 7.380 7.548 -0.168 19668 7247 1 20 . 1 1 40 40 LYS N N 40 118.894 118.894 119.578 -0.684 19668 7248 1 20 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.046 0.013 19668 7249 1 20 . 1 1 40 40 LYS C C 40 179.758 179.758 178.948 0.810 19668 7250 1 20 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.545 -0.483 19668 7251 1 20 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.365 0.023 19668 7252 1 20 . 1 1 40 40 LYS H H 40 7.919 7.919 7.352 0.567 19668 7253 1 20 . 1 1 41 41 ILE N N 41 118.270 118.270 118.459 -0.189 19668 7254 1 20 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.767 -0.070 19668 7255 1 20 . 1 1 41 41 ILE C C 41 178.211 178.211 176.974 1.237 19668 7256 1 20 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.655 0.059 19668 7257 1 20 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.773 0.066 19668 7258 1 20 . 1 1 41 41 ILE H H 41 8.199 8.199 7.456 0.743 19668 7259 1 20 . 1 1 42 42 GLU N N 42 120.117 120.117 117.316 2.801 19668 7260 1 20 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.080 0.011 19668 7261 1 20 . 1 1 42 42 GLU C C 42 178.736 178.736 177.280 1.456 19668 7262 1 20 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.460 0.420 19668 7263 1 20 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.984 -0.593 19668 7264 1 20 . 1 1 42 42 GLU H H 42 7.738 7.738 7.497 0.241 19668 7265 1 20 . 1 1 43 43 GLU N N 43 117.194 117.194 116.880 0.314 19668 7266 1 20 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.184 0.115 19668 7267 1 20 . 1 1 43 43 GLU C C 43 177.658 177.658 177.377 0.281 19668 7268 1 20 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.696 0.097 19668 7269 1 20 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.151 -0.218 19668 7270 1 20 . 1 1 43 43 GLU H H 43 7.698 7.698 7.567 0.131 19668 7271 1 20 . 1 1 44 44 LEU N N 44 120.812 120.812 121.894 -1.082 19668 7272 1 20 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.092 0.147 19668 7273 1 20 . 1 1 44 44 LEU C C 44 178.682 178.682 177.583 1.099 19668 7274 1 20 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.667 0.829 19668 7275 1 20 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.687 0.960 19668 7276 1 20 . 1 1 44 44 LEU H H 44 7.593 7.593 7.487 0.106 19668 7277 1 20 . 1 1 45 45 GLY N N 45 108.681 108.681 111.403 -2.722 19668 7278 1 20 . 1 1 45 45 GLY C C 45 174.957 174.957 174.059 0.898 19668 7279 1 20 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.315 0.771 19668 7280 1 20 . 1 1 45 45 GLY H H 45 8.234 8.234 8.352 -0.118 19668 7281 1 20 . 1 1 46 46 GLY N N 46 108.057 108.057 106.851 1.206 19668 7282 1 20 . 1 1 46 46 GLY C C 46 174.777 174.777 174.022 0.755 19668 7283 1 20 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.225 1.139 19668 7284 1 20 . 1 1 46 46 GLY H H 46 8.182 8.182 7.712 0.470 19668 7285 1 20 . 1 1 47 47 GLY N N 47 108.494 108.494 109.202 -0.708 19668 7286 1 20 . 1 1 47 47 GLY C C 47 174.572 174.572 174.062 0.510 19668 7287 1 20 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.108 0.047 19668 7288 1 20 . 1 1 47 47 GLY H H 47 8.087 8.087 8.176 -0.089 19668 7289 1 20 . 1 1 48 48 GLY N N 48 108.285 108.285 108.643 -0.358 19668 7290 1 20 . 1 1 48 48 GLY C C 48 174.495 174.495 173.347 1.148 19668 7291 1 20 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.119 0.335 19668 7292 1 20 . 1 1 48 48 GLY H H 48 8.323 8.323 8.523 -0.200 19668 7293 1 20 . 1 1 49 49 GLU N N 49 121.070 121.070 119.707 1.363 19668 7294 1 20 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.478 -0.061 19668 7295 1 20 . 1 1 49 49 GLU C C 49 177.226 177.226 178.008 -0.782 19668 7296 1 20 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.940 -0.369 19668 7297 1 20 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.046 -0.380 19668 7298 1 20 . 1 1 49 49 GLU H H 49 8.483 8.483 8.301 0.182 19668 7299 1 20 . 1 1 50 50 VAL N N 50 121.794 121.794 119.671 2.123 19668 7300 1 20 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.732 0.049 19668 7301 1 20 . 1 1 50 50 VAL C C 50 176.860 176.860 177.149 -0.289 19668 7302 1 20 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.573 -0.493 19668 7303 1 20 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.050 1.203 19668 7304 1 20 . 1 1 50 50 VAL H H 50 8.068 8.068 7.892 0.176 19668 7305 1 20 . 1 1 51 51 LYS N N 51 120.593 120.593 117.940 2.653 19668 7306 1 20 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.419 -0.212 19668 7307 1 20 . 1 1 51 51 LYS C C 51 178.667 178.667 178.771 -0.104 19668 7308 1 20 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.832 0.503 19668 7309 1 20 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.462 0.796 19668 7310 1 20 . 1 1 51 51 LYS H H 51 8.253 8.253 8.373 -0.120 19668 7311 1 20 . 1 1 52 52 LYS N N 52 117.572 117.572 120.233 -2.661 19668 7312 1 20 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.122 0.046 19668 7313 1 20 . 1 1 52 52 LYS C C 52 179.248 179.248 178.984 0.264 19668 7314 1 20 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.005 0.009 19668 7315 1 20 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.214 -0.034 19668 7316 1 20 . 1 1 52 52 LYS H H 52 7.629 7.629 7.242 0.387 19668 7317 1 20 . 1 1 53 53 VAL N N 53 119.059 119.059 119.116 -0.057 19668 7318 1 20 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.602 0.190 19668 7319 1 20 . 1 1 53 53 VAL C C 53 177.987 177.987 177.495 0.492 19668 7320 1 20 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.828 -0.797 19668 7321 1 20 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.817 -0.446 19668 7322 1 20 . 1 1 53 53 VAL H H 53 7.638 7.638 7.602 0.036 19668 7323 1 20 . 1 1 54 54 GLU N N 54 120.388 120.388 119.335 1.053 19668 7324 1 20 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.909 -0.065 19668 7325 1 20 . 1 1 54 54 GLU C C 54 179.624 179.624 178.823 0.801 19668 7326 1 20 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.782 0.459 19668 7327 1 20 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.211 0.607 19668 7328 1 20 . 1 1 54 54 GLU H H 54 8.603 8.603 7.607 0.996 19668 7329 1 20 . 1 1 55 55 GLU N N 55 118.533 118.533 118.902 -0.369 19668 7330 1 20 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.096 -0.007 19668 7331 1 20 . 1 1 55 55 GLU C C 55 179.158 179.158 178.933 0.225 19668 7332 1 20 . 1 1 55 55 GLU CA C 55 59.334 59.334 58.989 0.345 19668 7333 1 20 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.475 -0.138 19668 7334 1 20 . 1 1 55 55 GLU H H 55 7.904 7.904 7.574 0.330 19668 7335 1 20 . 1 1 56 56 GLU N N 56 120.258 120.258 119.520 0.738 19668 7336 1 20 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.028 0.072 19668 7337 1 20 . 1 1 56 56 GLU C C 56 179.867 179.867 179.326 0.541 19668 7338 1 20 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.324 0.339 19668 7339 1 20 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.474 0.576 19668 7340 1 20 . 1 1 56 56 GLU H H 56 7.902 7.902 7.508 0.394 19668 7341 1 20 . 1 1 57 57 VAL N N 57 121.168 121.168 120.129 1.039 19668 7342 1 20 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.638 -0.070 19668 7343 1 20 . 1 1 57 57 VAL C C 57 176.994 176.994 177.381 -0.387 19668 7344 1 20 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.563 2.333 19668 7345 1 20 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.451 0.076 19668 7346 1 20 . 1 1 57 57 VAL H H 57 8.613 8.613 7.553 1.060 19668 7347 1 20 . 1 1 58 58 LYS N N 58 120.234 120.234 119.211 1.023 19668 7348 1 20 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.939 0.263 19668 7349 1 20 . 1 1 58 58 LYS C C 58 179.131 179.131 179.229 -0.098 19668 7350 1 20 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.523 0.064 19668 7351 1 20 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.966 0.325 19668 7352 1 20 . 1 1 58 58 LYS H H 58 7.810 7.810 7.465 0.345 19668 7353 1 20 . 1 1 59 59 LYS N N 59 118.301 118.301 118.360 -0.059 19668 7354 1 20 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.025 0.068 19668 7355 1 20 . 1 1 59 59 LYS C C 59 179.281 179.281 178.530 0.751 19668 7356 1 20 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.113 0.315 19668 7357 1 20 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.106 0.273 19668 7358 1 20 . 1 1 59 59 LYS H H 59 7.876 7.876 7.459 0.417 19668 7359 1 20 . 1 1 60 60 LEU N N 60 121.224 121.224 120.298 0.926 19668 7360 1 20 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.958 0.276 19668 7361 1 20 . 1 1 60 60 LEU C C 60 178.636 178.636 178.655 -0.019 19668 7362 1 20 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.732 0.425 19668 7363 1 20 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.226 0.408 19668 7364 1 20 . 1 1 60 60 LEU H H 60 7.893 7.893 7.678 0.215 19668 7365 1 20 . 1 1 61 61 GLU N N 61 118.660 118.660 117.897 0.763 19668 7366 1 20 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.027 -0.228 19668 7367 1 20 . 1 1 61 61 GLU C C 61 179.094 179.094 178.692 0.402 19668 7368 1 20 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.271 1.001 19668 7369 1 20 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.757 1.246 19668 7370 1 20 . 1 1 61 61 GLU H H 61 8.644 8.644 7.787 0.857 19668 7371 1 20 . 1 1 62 62 GLU N N 62 117.555 117.555 119.392 -1.837 19668 7372 1 20 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.028 -0.032 19668 7373 1 20 . 1 1 62 62 GLU C C 62 178.940 178.940 179.173 -0.233 19668 7374 1 20 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.260 -0.092 19668 7375 1 20 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.221 0.326 19668 7376 1 20 . 1 1 62 62 GLU H H 62 7.995 7.995 7.560 0.435 19668 7377 1 20 . 1 1 63 63 GLU N N 63 119.097 119.097 118.451 0.646 19668 7378 1 20 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.153 -0.124 19668 7379 1 20 . 1 1 63 63 GLU C C 63 179.890 179.890 178.918 0.972 19668 7380 1 20 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.798 0.543 19668 7381 1 20 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.158 0.509 19668 7382 1 20 . 1 1 63 63 GLU H H 63 7.983 7.983 7.593 0.390 19668 7383 1 20 . 1 1 64 64 ILE N N 64 118.247 118.247 119.445 -1.198 19668 7384 1 20 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.767 -0.047 19668 7385 1 20 . 1 1 64 64 ILE C C 64 177.858 177.858 178.577 -0.719 19668 7386 1 20 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.518 -0.022 19668 7387 1 20 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.504 0.477 19668 7388 1 20 . 1 1 64 64 ILE H H 64 8.261 8.261 7.182 1.079 19668 7389 1 20 . 1 1 65 65 LYS N N 65 118.693 118.693 119.404 -0.711 19668 7390 1 20 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.126 -0.028 19668 7391 1 20 . 1 1 65 65 LYS C C 65 177.244 177.244 177.486 -0.242 19668 7392 1 20 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.857 -0.204 19668 7393 1 20 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.136 0.569 19668 7394 1 20 . 1 1 65 65 LYS H H 65 7.661 7.661 7.603 0.058 19668 7395 1 20 . 1 1 66 66 LYS N N 66 116.933 116.933 116.634 0.299 19668 7396 1 20 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.154 0.184 19668 7397 1 20 . 1 1 66 66 LYS C C 66 176.011 176.011 176.816 -0.805 19668 7398 1 20 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.558 -1.099 19668 7399 1 20 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.555 0.576 19668 7400 1 20 . 1 1 66 66 LYS H H 66 7.261 7.261 7.575 -0.314 19668 7401 1 21 . 1 1 2 2 SER HA H 2 4.560 4.560 4.481 0.079 19668 7402 1 21 . 1 1 2 2 SER CA C 2 58.366 58.366 58.388 -0.022 19668 7403 1 21 . 1 1 3 3 ARG N N 3 125.213 125.213 122.694 2.519 19668 7404 1 21 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.379 -0.113 19668 7405 1 21 . 1 1 3 3 ARG C C 3 178.381 178.381 178.089 0.292 19668 7406 1 21 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.467 -0.071 19668 7407 1 21 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.479 1.176 19668 7408 1 21 . 1 1 3 3 ARG H H 3 8.874 8.874 8.460 0.414 19668 7409 1 21 . 1 1 4 4 VAL N N 4 119.320 119.320 120.302 -0.982 19668 7410 1 21 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.815 -0.017 19668 7411 1 21 . 1 1 4 4 VAL C C 4 177.004 177.004 177.699 -0.695 19668 7412 1 21 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.207 -0.692 19668 7413 1 21 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.400 0.403 19668 7414 1 21 . 1 1 4 4 VAL H H 4 8.112 8.112 8.224 -0.112 19668 7415 1 21 . 1 1 5 5 LYS N N 5 122.279 122.279 120.818 1.461 19668 7416 1 21 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.066 0.096 19668 7417 1 21 . 1 1 5 5 LYS C C 5 178.547 178.547 178.146 0.401 19668 7418 1 21 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.840 -0.082 19668 7419 1 21 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.753 0.257 19668 7420 1 21 . 1 1 5 5 LYS H H 5 7.847 7.847 8.347 -0.500 19668 7421 1 21 . 1 1 6 6 ALA N N 6 120.295 120.295 121.707 -1.412 19668 7422 1 21 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.089 0.122 19668 7423 1 21 . 1 1 6 6 ALA C C 6 180.834 180.834 179.450 1.384 19668 7424 1 21 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.835 0.068 19668 7425 1 21 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.151 -0.019 19668 7426 1 21 . 1 1 6 6 ALA H H 6 7.975 7.975 7.479 0.496 19668 7427 1 21 . 1 1 7 7 LEU N N 7 119.570 119.570 118.332 1.238 19668 7428 1 21 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.057 0.115 19668 7429 1 21 . 1 1 7 7 LEU C C 7 178.431 178.431 178.502 -0.071 19668 7430 1 21 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.889 -0.210 19668 7431 1 21 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.097 0.938 19668 7432 1 21 . 1 1 7 7 LEU H H 7 7.650 7.650 7.644 0.006 19668 7433 1 21 . 1 1 8 8 GLU N N 8 119.934 119.934 118.481 1.453 19668 7434 1 21 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.068 -0.209 19668 7435 1 21 . 1 1 8 8 GLU C C 8 179.534 179.534 178.456 1.078 19668 7436 1 21 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.322 0.715 19668 7437 1 21 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.706 0.760 19668 7438 1 21 . 1 1 8 8 GLU H H 8 8.411 8.411 7.885 0.526 19668 7439 1 21 . 1 1 9 9 GLU N N 9 118.234 118.234 119.229 -0.995 19668 7440 1 21 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.051 0.009 19668 7441 1 21 . 1 1 9 9 GLU C C 9 179.596 179.596 178.954 0.642 19668 7442 1 21 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.278 0.052 19668 7443 1 21 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.374 0.044 19668 7444 1 21 . 1 1 9 9 GLU H H 9 8.206 8.206 7.699 0.507 19668 7445 1 21 . 1 1 10 10 LYS N N 10 121.042 121.042 119.007 2.035 19668 7446 1 21 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.146 0.037 19668 7447 1 21 . 1 1 10 10 LYS C C 10 179.380 179.380 179.110 0.270 19668 7448 1 21 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.112 0.213 19668 7449 1 21 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.193 0.216 19668 7450 1 21 . 1 1 10 10 LYS H H 10 7.931 7.931 7.565 0.366 19668 7451 1 21 . 1 1 11 11 VAL N N 11 118.662 118.662 120.105 -1.443 19668 7452 1 21 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.821 -0.007 19668 7453 1 21 . 1 1 11 11 VAL C C 11 178.845 178.845 178.076 0.769 19668 7454 1 21 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.235 0.753 19668 7455 1 21 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.670 -0.016 19668 7456 1 21 . 1 1 11 11 VAL H H 11 8.371 8.371 7.577 0.794 19668 7457 1 21 . 1 1 12 12 LYS N N 12 123.188 123.188 119.595 3.593 19668 7458 1 21 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.943 0.283 19668 7459 1 21 . 1 1 12 12 LYS C C 12 179.098 179.098 178.403 0.695 19668 7460 1 21 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.367 0.116 19668 7461 1 21 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.351 -0.145 19668 7462 1 21 . 1 1 12 12 LYS H H 12 8.276 8.276 7.526 0.750 19668 7463 1 21 . 1 1 13 13 ALA N N 13 121.169 121.169 121.946 -0.777 19668 7464 1 21 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.221 0.037 19668 7465 1 21 . 1 1 13 13 ALA C C 13 180.169 180.169 179.592 0.577 19668 7466 1 21 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.729 -0.093 19668 7467 1 21 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.406 -0.299 19668 7468 1 21 . 1 1 13 13 ALA H H 13 7.829 7.829 7.440 0.389 19668 7469 1 21 . 1 1 14 14 LEU N N 14 118.104 118.104 118.309 -0.205 19668 7470 1 21 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.009 0.147 19668 7471 1 21 . 1 1 14 14 LEU C C 14 177.614 177.614 177.815 -0.201 19668 7472 1 21 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.115 -0.510 19668 7473 1 21 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.898 0.897 19668 7474 1 21 . 1 1 14 14 LEU H H 14 7.781 7.781 7.391 0.390 19668 7475 1 21 . 1 1 15 15 GLU N N 15 120.632 120.632 118.902 1.730 19668 7476 1 21 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.366 0.001 19668 7477 1 21 . 1 1 15 15 GLU C C 15 178.243 178.243 178.679 -0.436 19668 7478 1 21 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.573 1.013 19668 7479 1 21 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.027 0.802 19668 7480 1 21 . 1 1 15 15 GLU H H 15 7.873 7.873 7.309 0.564 19668 7481 1 21 . 1 1 16 16 GLU N N 16 115.775 115.775 117.143 -1.368 19668 7482 1 21 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.994 -0.035 19668 7483 1 21 . 1 1 16 16 GLU C C 16 179.006 179.006 178.691 0.315 19668 7484 1 21 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.806 0.286 19668 7485 1 21 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.397 -0.044 19668 7486 1 21 . 1 1 16 16 GLU H H 16 7.926 7.926 7.696 0.230 19668 7487 1 21 . 1 1 17 17 LYS N N 17 118.801 118.801 119.270 -0.469 19668 7488 1 21 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.055 0.039 19668 7489 1 21 . 1 1 17 17 LYS C C 17 178.853 178.853 178.337 0.516 19668 7490 1 21 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.777 -0.306 19668 7491 1 21 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.898 0.464 19668 7492 1 21 . 1 1 17 17 LYS H H 17 7.518 7.518 7.465 0.053 19668 7493 1 21 . 1 1 18 18 VAL N N 18 118.034 118.034 119.224 -1.190 19668 7494 1 21 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.752 -0.240 19668 7495 1 21 . 1 1 18 18 VAL C C 18 178.362 178.362 178.432 -0.070 19668 7496 1 21 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.151 0.868 19668 7497 1 21 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.410 0.239 19668 7498 1 21 . 1 1 18 18 VAL H H 18 8.048 8.048 7.441 0.607 19668 7499 1 21 . 1 1 19 19 LYS N N 19 118.427 118.427 120.231 -1.804 19668 7500 1 21 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.084 -0.074 19668 7501 1 21 . 1 1 19 19 LYS C C 19 177.706 177.706 178.138 -0.432 19668 7502 1 21 . 1 1 19 19 LYS CA C 19 58.985 58.985 59.148 -0.163 19668 7503 1 21 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.635 0.789 19668 7504 1 21 . 1 1 19 19 LYS H H 19 8.008 8.008 7.625 0.383 19668 7505 1 21 . 1 1 20 20 ALA N N 20 119.177 119.177 120.233 -1.056 19668 7506 1 21 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.288 0.028 19668 7507 1 21 . 1 1 20 20 ALA C C 20 178.269 178.269 178.330 -0.061 19668 7508 1 21 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.922 -0.291 19668 7509 1 21 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.618 0.515 19668 7510 1 21 . 1 1 20 20 ALA H H 20 7.259 7.259 7.445 -0.186 19668 7511 1 21 . 1 1 21 21 LEU N N 21 118.596 118.596 117.430 1.166 19668 7512 1 21 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.071 0.190 19668 7513 1 21 . 1 1 21 21 LEU C C 21 177.732 177.732 177.235 0.497 19668 7514 1 21 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.144 -0.486 19668 7515 1 21 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.367 0.766 19668 7516 1 21 . 1 1 21 21 LEU H H 21 7.373 7.373 7.583 -0.210 19668 7517 1 21 . 1 1 22 22 GLY N N 22 107.926 107.926 106.086 1.840 19668 7518 1 21 . 1 1 22 22 GLY C C 22 173.362 173.362 173.585 -0.223 19668 7519 1 21 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.333 -0.136 19668 7520 1 21 . 1 1 22 22 GLY H H 22 8.144 8.144 7.300 0.844 19668 7521 1 21 . 1 1 23 23 GLY N N 23 108.242 108.242 108.656 -0.414 19668 7522 1 21 . 1 1 23 23 GLY C C 23 174.110 174.110 174.220 -0.110 19668 7523 1 21 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.764 -0.080 19668 7524 1 21 . 1 1 23 23 GLY H H 23 8.157 8.157 8.142 0.015 19668 7525 1 21 . 1 1 24 24 GLY N N 24 106.969 106.969 108.669 -1.700 19668 7526 1 21 . 1 1 24 24 GLY C C 24 175.172 175.172 174.473 0.699 19668 7527 1 21 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.116 -0.677 19668 7528 1 21 . 1 1 24 24 GLY H H 24 8.466 8.466 8.279 0.187 19668 7529 1 21 . 1 1 25 25 GLY N N 25 108.946 108.946 110.266 -1.320 19668 7530 1 21 . 1 1 25 25 GLY C C 25 176.321 176.321 174.969 1.352 19668 7531 1 21 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.782 1.317 19668 7532 1 21 . 1 1 25 25 GLY H H 25 8.618 8.618 7.855 0.763 19668 7533 1 21 . 1 1 26 26 ARG N N 26 123.559 123.559 122.393 1.166 19668 7534 1 21 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.339 -0.060 19668 7535 1 21 . 1 1 26 26 ARG C C 26 178.076 178.076 178.212 -0.136 19668 7536 1 21 . 1 1 26 26 ARG CA C 26 57.915 57.915 57.808 0.107 19668 7537 1 21 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.105 -0.195 19668 7538 1 21 . 1 1 26 26 ARG H H 26 8.789 8.789 8.401 0.388 19668 7539 1 21 . 1 1 27 27 ILE N N 27 118.726 118.726 120.868 -2.142 19668 7540 1 21 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.818 -0.032 19668 7541 1 21 . 1 1 27 27 ILE C C 27 177.639 177.639 178.057 -0.418 19668 7542 1 21 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.427 -0.803 19668 7543 1 21 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.237 -0.282 19668 7544 1 21 . 1 1 27 27 ILE H H 27 7.762 7.762 8.070 -0.308 19668 7545 1 21 . 1 1 28 28 GLU N N 28 119.843 119.843 118.889 0.954 19668 7546 1 21 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.985 0.028 19668 7547 1 21 . 1 1 28 28 GLU C C 28 179.447 179.447 179.235 0.212 19668 7548 1 21 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.129 -0.546 19668 7549 1 21 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.133 -0.073 19668 7550 1 21 . 1 1 28 28 GLU H H 28 7.867 7.867 8.707 -0.840 19668 7551 1 21 . 1 1 29 29 GLU N N 29 118.447 118.447 119.126 -0.679 19668 7552 1 21 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.059 0.028 19668 7553 1 21 . 1 1 29 29 GLU C C 29 179.310 179.310 179.183 0.127 19668 7554 1 21 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.656 0.624 19668 7555 1 21 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.445 -0.109 19668 7556 1 21 . 1 1 29 29 GLU H H 29 7.755 7.755 7.693 0.062 19668 7557 1 21 . 1 1 30 30 LEU N N 30 121.135 121.135 120.057 1.078 19668 7558 1 21 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.009 0.087 19668 7559 1 21 . 1 1 30 30 LEU C C 30 178.928 178.928 178.511 0.417 19668 7560 1 21 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.286 -0.181 19668 7561 1 21 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.074 -0.394 19668 7562 1 21 . 1 1 30 30 LEU H H 30 7.785 7.785 7.614 0.171 19668 7563 1 21 . 1 1 31 31 LYS N N 31 119.130 119.130 117.780 1.350 19668 7564 1 21 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.088 -0.218 19668 7565 1 21 . 1 1 31 31 LYS C C 31 179.104 179.104 178.987 0.117 19668 7566 1 21 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.386 1.330 19668 7567 1 21 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.826 0.430 19668 7568 1 21 . 1 1 31 31 LYS H H 31 8.413 8.413 7.641 0.772 19668 7569 1 21 . 1 1 32 32 LYS N N 32 119.200 119.200 119.709 -0.509 19668 7570 1 21 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.989 0.113 19668 7571 1 21 . 1 1 32 32 LYS C C 32 179.420 179.420 179.044 0.376 19668 7572 1 21 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.493 -0.036 19668 7573 1 21 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.224 0.042 19668 7574 1 21 . 1 1 32 32 LYS H H 32 7.826 7.826 7.553 0.273 19668 7575 1 21 . 1 1 33 33 LYS N N 33 120.322 120.322 119.096 1.226 19668 7576 1 21 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.041 0.122 19668 7577 1 21 . 1 1 33 33 LYS C C 33 179.174 179.174 178.948 0.226 19668 7578 1 21 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.000 -0.252 19668 7579 1 21 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.331 -0.592 19668 7580 1 21 . 1 1 33 33 LYS H H 33 8.003 8.003 7.495 0.508 19668 7581 1 21 . 1 1 34 34 TYR N N 34 120.223 120.223 119.676 0.547 19668 7582 1 21 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.090 -0.034 19668 7583 1 21 . 1 1 34 34 TYR C C 34 176.356 176.356 177.939 -1.583 19668 7584 1 21 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.652 -0.597 19668 7585 1 21 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.371 -0.344 19668 7586 1 21 . 1 1 34 34 TYR H H 34 8.614 8.614 7.592 1.022 19668 7587 1 21 . 1 1 35 35 GLU N N 35 118.813 118.813 117.020 1.793 19668 7588 1 21 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.916 -0.191 19668 7589 1 21 . 1 1 35 35 GLU C C 35 179.787 179.787 178.660 1.127 19668 7590 1 21 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.995 -0.556 19668 7591 1 21 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.002 0.126 19668 7592 1 21 . 1 1 35 35 GLU H H 35 8.103 8.103 7.977 0.126 19668 7593 1 21 . 1 1 36 36 GLU N N 36 119.670 119.670 119.587 0.083 19668 7594 1 21 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.086 -0.072 19668 7595 1 21 . 1 1 36 36 GLU C C 36 179.295 179.295 179.044 0.251 19668 7596 1 21 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.196 0.067 19668 7597 1 21 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.437 0.132 19668 7598 1 21 . 1 1 36 36 GLU H H 36 8.028 8.028 7.668 0.360 19668 7599 1 21 . 1 1 37 37 LEU N N 37 121.416 121.416 119.637 1.779 19668 7600 1 21 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.990 0.029 19668 7601 1 21 . 1 1 37 37 LEU C C 37 178.277 178.277 178.942 -0.665 19668 7602 1 21 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.005 -0.165 19668 7603 1 21 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.372 0.257 19668 7604 1 21 . 1 1 37 37 LEU H H 37 8.176 8.176 7.384 0.792 19668 7605 1 21 . 1 1 38 38 LYS N N 38 118.998 118.998 118.208 0.790 19668 7606 1 21 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.947 -0.287 19668 7607 1 21 . 1 1 38 38 LYS C C 38 178.923 178.923 178.951 -0.028 19668 7608 1 21 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.207 0.193 19668 7609 1 21 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.102 -0.040 19668 7610 1 21 . 1 1 38 38 LYS H H 38 8.260 8.260 7.605 0.655 19668 7611 1 21 . 1 1 39 39 LYS N N 39 118.070 118.070 117.966 0.104 19668 7612 1 21 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.043 0.037 19668 7613 1 21 . 1 1 39 39 LYS C C 39 178.687 178.687 178.971 -0.284 19668 7614 1 21 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.977 -1.041 19668 7615 1 21 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.084 0.065 19668 7616 1 21 . 1 1 39 39 LYS H H 39 7.380 7.380 7.944 -0.564 19668 7617 1 21 . 1 1 40 40 LYS N N 40 118.894 118.894 119.851 -0.957 19668 7618 1 21 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.052 0.007 19668 7619 1 21 . 1 1 40 40 LYS C C 40 179.758 179.758 178.952 0.806 19668 7620 1 21 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.363 -0.301 19668 7621 1 21 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.176 0.212 19668 7622 1 21 . 1 1 40 40 LYS H H 40 7.919 7.919 7.387 0.532 19668 7623 1 21 . 1 1 41 41 ILE N N 41 118.270 118.270 118.106 0.164 19668 7624 1 21 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.696 0.001 19668 7625 1 21 . 1 1 41 41 ILE C C 41 178.211 178.211 177.085 1.126 19668 7626 1 21 . 1 1 41 41 ILE CA C 41 64.714 64.714 65.150 -0.436 19668 7627 1 21 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.906 -0.067 19668 7628 1 21 . 1 1 41 41 ILE H H 41 8.199 8.199 7.471 0.728 19668 7629 1 21 . 1 1 42 42 GLU N N 42 120.117 120.117 117.548 2.569 19668 7630 1 21 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.028 0.063 19668 7631 1 21 . 1 1 42 42 GLU C C 42 178.736 178.736 177.447 1.289 19668 7632 1 21 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.586 0.294 19668 7633 1 21 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.862 -0.471 19668 7634 1 21 . 1 1 42 42 GLU H H 42 7.738 7.738 7.443 0.295 19668 7635 1 21 . 1 1 43 43 GLU N N 43 117.194 117.194 116.706 0.488 19668 7636 1 21 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.176 0.123 19668 7637 1 21 . 1 1 43 43 GLU C C 43 177.658 177.658 177.706 -0.048 19668 7638 1 21 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.730 -0.937 19668 7639 1 21 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.605 -0.672 19668 7640 1 21 . 1 1 43 43 GLU H H 43 7.698 7.698 7.592 0.106 19668 7641 1 21 . 1 1 44 44 LEU N N 44 120.812 120.812 118.272 2.540 19668 7642 1 21 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.378 -0.139 19668 7643 1 21 . 1 1 44 44 LEU C C 44 178.682 178.682 176.785 1.897 19668 7644 1 21 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.397 1.099 19668 7645 1 21 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.556 0.091 19668 7646 1 21 . 1 1 44 44 LEU H H 44 7.593 7.593 7.397 0.196 19668 7647 1 21 . 1 1 45 45 GLY N N 45 108.681 108.681 107.908 0.773 19668 7648 1 21 . 1 1 45 45 GLY C C 45 174.957 174.957 173.717 1.240 19668 7649 1 21 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.398 1.688 19668 7650 1 21 . 1 1 45 45 GLY H H 45 8.234 8.234 8.666 -0.432 19668 7651 1 21 . 1 1 46 46 GLY N N 46 108.057 108.057 108.018 0.039 19668 7652 1 21 . 1 1 46 46 GLY C C 46 174.777 174.777 172.942 1.835 19668 7653 1 21 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.181 0.183 19668 7654 1 21 . 1 1 46 46 GLY H H 46 8.182 8.182 7.678 0.504 19668 7655 1 21 . 1 1 47 47 GLY N N 47 108.494 108.494 106.375 2.119 19668 7656 1 21 . 1 1 47 47 GLY C C 47 174.572 174.572 175.363 -0.791 19668 7657 1 21 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.608 0.547 19668 7658 1 21 . 1 1 47 47 GLY H H 47 8.087 8.087 8.251 -0.164 19668 7659 1 21 . 1 1 48 48 GLY N N 48 108.285 108.285 108.409 -0.124 19668 7660 1 21 . 1 1 48 48 GLY C C 48 174.495 174.495 175.255 -0.760 19668 7661 1 21 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.255 -0.801 19668 7662 1 21 . 1 1 48 48 GLY H H 48 8.323 8.323 8.382 -0.059 19668 7663 1 21 . 1 1 49 49 GLU N N 49 121.070 121.070 121.787 -0.717 19668 7664 1 21 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.484 -0.067 19668 7665 1 21 . 1 1 49 49 GLU C C 49 177.226 177.226 177.765 -0.539 19668 7666 1 21 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.864 -0.293 19668 7667 1 21 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.214 -0.548 19668 7668 1 21 . 1 1 49 49 GLU H H 49 8.483 8.483 7.741 0.742 19668 7669 1 21 . 1 1 50 50 VAL N N 50 121.794 121.794 120.998 0.796 19668 7670 1 21 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.644 0.137 19668 7671 1 21 . 1 1 50 50 VAL C C 50 176.860 176.860 177.316 -0.456 19668 7672 1 21 . 1 1 50 50 VAL CA C 50 65.080 65.080 66.551 -1.471 19668 7673 1 21 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.859 0.394 19668 7674 1 21 . 1 1 50 50 VAL H H 50 8.068 8.068 7.950 0.118 19668 7675 1 21 . 1 1 51 51 LYS N N 51 120.593 120.593 118.007 2.586 19668 7676 1 21 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.457 -0.250 19668 7677 1 21 . 1 1 51 51 LYS C C 51 178.667 178.667 178.988 -0.321 19668 7678 1 21 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.412 -0.077 19668 7679 1 21 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.805 0.452 19668 7680 1 21 . 1 1 51 51 LYS H H 51 8.253 8.253 8.437 -0.184 19668 7681 1 21 . 1 1 52 52 LYS N N 52 117.572 117.572 119.418 -1.846 19668 7682 1 21 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.110 0.058 19668 7683 1 21 . 1 1 52 52 LYS C C 52 179.248 179.248 178.712 0.536 19668 7684 1 21 . 1 1 52 52 LYS CA C 52 59.014 59.014 58.755 0.258 19668 7685 1 21 . 1 1 52 52 LYS CB C 52 32.180 32.180 31.996 0.184 19668 7686 1 21 . 1 1 52 52 LYS H H 52 7.629 7.629 7.476 0.153 19668 7687 1 21 . 1 1 53 53 VAL N N 53 119.059 119.059 119.109 -0.050 19668 7688 1 21 . 1 1 53 53 VAL HA H 53 3.792 3.792 4.095 -0.303 19668 7689 1 21 . 1 1 53 53 VAL C C 53 177.987 177.987 178.496 -0.509 19668 7690 1 21 . 1 1 53 53 VAL CA C 53 66.031 66.031 64.645 1.386 19668 7691 1 21 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.091 0.280 19668 7692 1 21 . 1 1 53 53 VAL H H 53 7.638 7.638 7.735 -0.097 19668 7693 1 21 . 1 1 54 54 GLU N N 54 120.388 120.388 119.574 0.814 19668 7694 1 21 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.959 -0.115 19668 7695 1 21 . 1 1 54 54 GLU C C 54 179.624 179.624 178.968 0.656 19668 7696 1 21 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.808 0.433 19668 7697 1 21 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.195 0.623 19668 7698 1 21 . 1 1 54 54 GLU H H 54 8.603 8.603 7.692 0.911 19668 7699 1 21 . 1 1 55 55 GLU N N 55 118.533 118.533 119.392 -0.859 19668 7700 1 21 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.014 0.075 19668 7701 1 21 . 1 1 55 55 GLU C C 55 179.158 179.158 178.739 0.419 19668 7702 1 21 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.595 -0.261 19668 7703 1 21 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.758 -0.421 19668 7704 1 21 . 1 1 55 55 GLU H H 55 7.904 7.904 7.651 0.253 19668 7705 1 21 . 1 1 56 56 GLU N N 56 120.258 120.258 119.051 1.207 19668 7706 1 21 . 1 1 56 56 GLU HA H 56 4.100 4.100 3.992 0.108 19668 7707 1 21 . 1 1 56 56 GLU C C 56 179.867 179.867 178.876 0.991 19668 7708 1 21 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.946 0.717 19668 7709 1 21 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.264 0.786 19668 7710 1 21 . 1 1 56 56 GLU H H 56 7.902 7.902 7.593 0.309 19668 7711 1 21 . 1 1 57 57 VAL N N 57 121.168 121.168 120.657 0.511 19668 7712 1 21 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.490 0.078 19668 7713 1 21 . 1 1 57 57 VAL C C 57 176.994 176.994 177.402 -0.408 19668 7714 1 21 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.409 1.487 19668 7715 1 21 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.557 -0.030 19668 7716 1 21 . 1 1 57 57 VAL H H 57 8.613 8.613 7.482 1.131 19668 7717 1 21 . 1 1 58 58 LYS N N 58 120.234 120.234 118.282 1.952 19668 7718 1 21 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.962 0.240 19668 7719 1 21 . 1 1 58 58 LYS C C 58 179.131 179.131 178.741 0.390 19668 7720 1 21 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.378 0.209 19668 7721 1 21 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.110 0.181 19668 7722 1 21 . 1 1 58 58 LYS H H 58 7.810 7.810 7.515 0.295 19668 7723 1 21 . 1 1 59 59 LYS N N 59 118.301 118.301 118.601 -0.300 19668 7724 1 21 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.034 0.059 19668 7725 1 21 . 1 1 59 59 LYS C C 59 179.281 179.281 178.489 0.792 19668 7726 1 21 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.117 0.312 19668 7727 1 21 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.096 0.284 19668 7728 1 21 . 1 1 59 59 LYS H H 59 7.876 7.876 7.467 0.409 19668 7729 1 21 . 1 1 60 60 LEU N N 60 121.224 121.224 120.350 0.874 19668 7730 1 21 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.022 0.212 19668 7731 1 21 . 1 1 60 60 LEU C C 60 178.636 178.636 178.706 -0.070 19668 7732 1 21 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.838 0.319 19668 7733 1 21 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.332 0.302 19668 7734 1 21 . 1 1 60 60 LEU H H 60 7.893 7.893 7.547 0.346 19668 7735 1 21 . 1 1 61 61 GLU N N 61 118.660 118.660 117.882 0.778 19668 7736 1 21 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.079 -0.280 19668 7737 1 21 . 1 1 61 61 GLU C C 61 179.094 179.094 178.744 0.350 19668 7738 1 21 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.009 1.263 19668 7739 1 21 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.531 1.472 19668 7740 1 21 . 1 1 61 61 GLU H H 61 8.644 8.644 7.825 0.819 19668 7741 1 21 . 1 1 62 62 GLU N N 62 117.555 117.555 119.602 -2.047 19668 7742 1 21 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.040 -0.044 19668 7743 1 21 . 1 1 62 62 GLU C C 62 178.940 178.940 179.149 -0.209 19668 7744 1 21 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.270 -0.102 19668 7745 1 21 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.257 0.290 19668 7746 1 21 . 1 1 62 62 GLU H H 62 7.995 7.995 7.570 0.425 19668 7747 1 21 . 1 1 63 63 GLU N N 63 119.097 119.097 118.411 0.686 19668 7748 1 21 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.153 -0.124 19668 7749 1 21 . 1 1 63 63 GLU C C 63 179.890 179.890 179.012 0.878 19668 7750 1 21 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.764 0.577 19668 7751 1 21 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.088 0.579 19668 7752 1 21 . 1 1 63 63 GLU H H 63 7.983 7.983 7.729 0.254 19668 7753 1 21 . 1 1 64 64 ILE N N 64 118.247 118.247 119.149 -0.902 19668 7754 1 21 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.768 -0.048 19668 7755 1 21 . 1 1 64 64 ILE C C 64 177.858 177.858 178.544 -0.686 19668 7756 1 21 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.465 0.031 19668 7757 1 21 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.537 0.444 19668 7758 1 21 . 1 1 64 64 ILE H H 64 8.261 8.261 7.213 1.048 19668 7759 1 21 . 1 1 65 65 LYS N N 65 118.693 118.693 119.075 -0.382 19668 7760 1 21 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.149 -0.051 19668 7761 1 21 . 1 1 65 65 LYS C C 65 177.244 177.244 177.846 -0.602 19668 7762 1 21 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.830 -0.176 19668 7763 1 21 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.062 0.643 19668 7764 1 21 . 1 1 65 65 LYS H H 65 7.661 7.661 7.698 -0.037 19668 7765 1 21 . 1 1 66 66 LYS N N 66 116.933 116.933 117.186 -0.253 19668 7766 1 21 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.164 0.174 19668 7767 1 21 . 1 1 66 66 LYS C C 66 176.011 176.011 176.506 -0.495 19668 7768 1 21 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.836 -1.377 19668 7769 1 21 . 1 1 66 66 LYS CB C 66 33.131 33.131 33.031 0.100 19668 7770 1 21 . 1 1 66 66 LYS H H 66 7.261 7.261 7.680 -0.419 19668 7771 1 22 . 1 1 2 2 SER HA H 2 4.560 4.560 4.603 -0.043 19668 7772 1 22 . 1 1 2 2 SER CA C 2 58.366 58.366 59.684 -1.318 19668 7773 1 22 . 1 1 3 3 ARG N N 3 125.213 125.213 118.055 7.158 19668 7774 1 22 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.383 -0.117 19668 7775 1 22 . 1 1 3 3 ARG C C 3 178.381 178.381 177.119 1.262 19668 7776 1 22 . 1 1 3 3 ARG CA C 3 58.396 58.396 56.999 1.397 19668 7777 1 22 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.888 0.767 19668 7778 1 22 . 1 1 3 3 ARG H H 3 8.874 8.874 7.906 0.968 19668 7779 1 22 . 1 1 4 4 VAL N N 4 119.320 119.320 121.146 -1.826 19668 7780 1 22 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.903 -0.105 19668 7781 1 22 . 1 1 4 4 VAL C C 4 177.004 177.004 177.548 -0.544 19668 7782 1 22 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.069 0.446 19668 7783 1 22 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.044 0.759 19668 7784 1 22 . 1 1 4 4 VAL H H 4 8.112 8.112 7.888 0.224 19668 7785 1 22 . 1 1 5 5 LYS N N 5 122.279 122.279 120.878 1.401 19668 7786 1 22 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.010 0.152 19668 7787 1 22 . 1 1 5 5 LYS C C 5 178.547 178.547 178.223 0.324 19668 7788 1 22 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.948 -0.190 19668 7789 1 22 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.691 0.319 19668 7790 1 22 . 1 1 5 5 LYS H H 5 7.847 7.847 7.497 0.350 19668 7791 1 22 . 1 1 6 6 ALA N N 6 120.295 120.295 120.739 -0.444 19668 7792 1 22 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.052 0.159 19668 7793 1 22 . 1 1 6 6 ALA C C 6 180.834 180.834 179.236 1.598 19668 7794 1 22 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.871 0.032 19668 7795 1 22 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.036 0.096 19668 7796 1 22 . 1 1 6 6 ALA H H 6 7.975 7.975 8.189 -0.214 19668 7797 1 22 . 1 1 7 7 LEU N N 7 119.570 119.570 118.294 1.276 19668 7798 1 22 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.044 0.128 19668 7799 1 22 . 1 1 7 7 LEU C C 7 178.431 178.431 178.618 -0.187 19668 7800 1 22 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.901 -0.222 19668 7801 1 22 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.195 0.840 19668 7802 1 22 . 1 1 7 7 LEU H H 7 7.650 7.650 7.664 -0.014 19668 7803 1 22 . 1 1 8 8 GLU N N 8 119.934 119.934 118.383 1.551 19668 7804 1 22 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.061 -0.202 19668 7805 1 22 . 1 1 8 8 GLU C C 8 179.534 179.534 178.543 0.991 19668 7806 1 22 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.369 0.668 19668 7807 1 22 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.745 0.722 19668 7808 1 22 . 1 1 8 8 GLU H H 8 8.411 8.411 7.836 0.575 19668 7809 1 22 . 1 1 9 9 GLU N N 9 118.234 118.234 118.896 -0.662 19668 7810 1 22 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.088 -0.028 19668 7811 1 22 . 1 1 9 9 GLU C C 9 179.596 179.596 178.950 0.646 19668 7812 1 22 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.285 0.045 19668 7813 1 22 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.270 0.148 19668 7814 1 22 . 1 1 9 9 GLU H H 9 8.206 8.206 7.732 0.474 19668 7815 1 22 . 1 1 10 10 LYS N N 10 121.042 121.042 119.034 2.008 19668 7816 1 22 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.164 0.019 19668 7817 1 22 . 1 1 10 10 LYS C C 10 179.380 179.380 179.154 0.226 19668 7818 1 22 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.121 0.204 19668 7819 1 22 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.131 0.278 19668 7820 1 22 . 1 1 10 10 LYS H H 10 7.931 7.931 7.558 0.373 19668 7821 1 22 . 1 1 11 11 VAL N N 11 118.662 118.662 120.062 -1.400 19668 7822 1 22 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.854 -0.040 19668 7823 1 22 . 1 1 11 11 VAL C C 11 178.845 178.845 178.092 0.753 19668 7824 1 22 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.220 0.768 19668 7825 1 22 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.671 -0.017 19668 7826 1 22 . 1 1 11 11 VAL H H 11 8.371 8.371 7.575 0.796 19668 7827 1 22 . 1 1 12 12 LYS N N 12 123.188 123.188 119.853 3.335 19668 7828 1 22 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.998 0.228 19668 7829 1 22 . 1 1 12 12 LYS C C 12 179.098 179.098 178.303 0.795 19668 7830 1 22 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.305 0.178 19668 7831 1 22 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.381 -0.175 19668 7832 1 22 . 1 1 12 12 LYS H H 12 8.276 8.276 7.562 0.714 19668 7833 1 22 . 1 1 13 13 ALA N N 13 121.169 121.169 121.641 -0.472 19668 7834 1 22 . 1 1 13 13 ALA HA H 13 4.258 4.258 3.995 0.263 19668 7835 1 22 . 1 1 13 13 ALA C C 13 180.169 180.169 179.325 0.844 19668 7836 1 22 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.937 -0.300 19668 7837 1 22 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.445 -0.338 19668 7838 1 22 . 1 1 13 13 ALA H H 13 7.829 7.829 7.443 0.386 19668 7839 1 22 . 1 1 14 14 LEU N N 14 118.104 118.104 118.223 -0.119 19668 7840 1 22 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.994 0.162 19668 7841 1 22 . 1 1 14 14 LEU C C 14 177.614 177.614 177.853 -0.239 19668 7842 1 22 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.137 -0.532 19668 7843 1 22 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.919 0.876 19668 7844 1 22 . 1 1 14 14 LEU H H 14 7.781 7.781 7.408 0.373 19668 7845 1 22 . 1 1 15 15 GLU N N 15 120.632 120.632 118.744 1.888 19668 7846 1 22 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.389 -0.022 19668 7847 1 22 . 1 1 15 15 GLU C C 15 178.243 178.243 178.512 -0.269 19668 7848 1 22 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.611 0.975 19668 7849 1 22 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.252 0.577 19668 7850 1 22 . 1 1 15 15 GLU H H 15 7.873 7.873 7.341 0.532 19668 7851 1 22 . 1 1 16 16 GLU N N 16 115.775 115.775 117.093 -1.318 19668 7852 1 22 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.996 -0.037 19668 7853 1 22 . 1 1 16 16 GLU C C 16 179.006 179.006 178.555 0.451 19668 7854 1 22 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.236 -0.145 19668 7855 1 22 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.025 0.328 19668 7856 1 22 . 1 1 16 16 GLU H H 16 7.926 7.926 7.814 0.112 19668 7857 1 22 . 1 1 17 17 LYS N N 17 118.801 118.801 119.166 -0.365 19668 7858 1 22 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.073 0.021 19668 7859 1 22 . 1 1 17 17 LYS C C 17 178.853 178.853 178.190 0.663 19668 7860 1 22 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.566 -0.094 19668 7861 1 22 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.928 0.434 19668 7862 1 22 . 1 1 17 17 LYS H H 17 7.518 7.518 7.490 0.028 19668 7863 1 22 . 1 1 18 18 VAL N N 18 118.034 118.034 119.063 -1.029 19668 7864 1 22 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.719 -0.207 19668 7865 1 22 . 1 1 18 18 VAL C C 18 178.362 178.362 178.395 -0.033 19668 7866 1 22 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.693 0.326 19668 7867 1 22 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.785 -0.136 19668 7868 1 22 . 1 1 18 18 VAL H H 18 8.048 8.048 7.396 0.652 19668 7869 1 22 . 1 1 19 19 LYS N N 19 118.427 118.427 119.635 -1.208 19668 7870 1 22 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.056 -0.046 19668 7871 1 22 . 1 1 19 19 LYS C C 19 177.706 177.706 178.015 -0.309 19668 7872 1 22 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.976 0.009 19668 7873 1 22 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.655 0.769 19668 7874 1 22 . 1 1 19 19 LYS H H 19 8.008 8.008 7.547 0.461 19668 7875 1 22 . 1 1 20 20 ALA N N 20 119.177 119.177 120.610 -1.433 19668 7876 1 22 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.277 0.039 19668 7877 1 22 . 1 1 20 20 ALA C C 20 178.269 178.269 178.477 -0.208 19668 7878 1 22 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.404 -0.773 19668 7879 1 22 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.257 0.876 19668 7880 1 22 . 1 1 20 20 ALA H H 20 7.259 7.259 7.408 -0.149 19668 7881 1 22 . 1 1 21 21 LEU N N 21 118.596 118.596 118.503 0.093 19668 7882 1 22 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.152 0.109 19668 7883 1 22 . 1 1 21 21 LEU C C 21 177.732 177.732 177.114 0.618 19668 7884 1 22 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.880 -0.223 19668 7885 1 22 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.746 0.387 19668 7886 1 22 . 1 1 21 21 LEU H H 21 7.373 7.373 7.381 -0.008 19668 7887 1 22 . 1 1 22 22 GLY N N 22 107.926 107.926 105.445 2.481 19668 7888 1 22 . 1 1 22 22 GLY C C 22 173.362 173.362 174.207 -0.845 19668 7889 1 22 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.360 0.837 19668 7890 1 22 . 1 1 22 22 GLY H H 22 8.144 8.144 7.426 0.718 19668 7891 1 22 . 1 1 23 23 GLY N N 23 108.242 108.242 107.782 0.460 19668 7892 1 22 . 1 1 23 23 GLY C C 23 174.110 174.110 174.772 -0.662 19668 7893 1 22 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.788 -1.104 19668 7894 1 22 . 1 1 23 23 GLY H H 23 8.157 8.157 8.104 0.053 19668 7895 1 22 . 1 1 24 24 GLY N N 24 106.969 106.969 110.568 -3.599 19668 7896 1 22 . 1 1 24 24 GLY C C 24 175.172 175.172 174.365 0.807 19668 7897 1 22 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.919 -0.480 19668 7898 1 22 . 1 1 24 24 GLY H H 24 8.466 8.466 8.202 0.264 19668 7899 1 22 . 1 1 25 25 GLY N N 25 108.946 108.946 109.394 -0.448 19668 7900 1 22 . 1 1 25 25 GLY C C 25 176.321 176.321 174.723 1.598 19668 7901 1 22 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.483 1.616 19668 7902 1 22 . 1 1 25 25 GLY H H 25 8.618 8.618 7.857 0.761 19668 7903 1 22 . 1 1 26 26 ARG N N 26 123.559 123.559 124.237 -0.678 19668 7904 1 22 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.387 -0.108 19668 7905 1 22 . 1 1 26 26 ARG C C 26 178.076 178.076 178.332 -0.256 19668 7906 1 22 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.220 -0.305 19668 7907 1 22 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.212 -0.301 19668 7908 1 22 . 1 1 26 26 ARG H H 26 8.789 8.789 8.470 0.319 19668 7909 1 22 . 1 1 27 27 ILE N N 27 118.726 118.726 118.408 0.318 19668 7910 1 22 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.813 -0.027 19668 7911 1 22 . 1 1 27 27 ILE C C 27 177.639 177.639 178.058 -0.419 19668 7912 1 22 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.877 -1.253 19668 7913 1 22 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.364 -0.409 19668 7914 1 22 . 1 1 27 27 ILE H H 27 7.762 7.762 8.442 -0.680 19668 7915 1 22 . 1 1 28 28 GLU N N 28 119.843 119.843 118.957 0.886 19668 7916 1 22 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.996 0.017 19668 7917 1 22 . 1 1 28 28 GLU C C 28 179.447 179.447 178.889 0.558 19668 7918 1 22 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.887 -0.304 19668 7919 1 22 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.107 -0.047 19668 7920 1 22 . 1 1 28 28 GLU H H 28 7.867 7.867 8.585 -0.718 19668 7921 1 22 . 1 1 29 29 GLU N N 29 118.447 118.447 119.028 -0.581 19668 7922 1 22 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.112 -0.025 19668 7923 1 22 . 1 1 29 29 GLU C C 29 179.310 179.310 178.915 0.395 19668 7924 1 22 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.671 0.609 19668 7925 1 22 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.223 0.113 19668 7926 1 22 . 1 1 29 29 GLU H H 29 7.755 7.755 7.780 -0.025 19668 7927 1 22 . 1 1 30 30 LEU N N 30 121.135 121.135 121.574 -0.439 19668 7928 1 22 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.993 0.103 19668 7929 1 22 . 1 1 30 30 LEU C C 30 178.928 178.928 178.750 0.178 19668 7930 1 22 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.299 -0.194 19668 7931 1 22 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.142 -0.461 19668 7932 1 22 . 1 1 30 30 LEU H H 30 7.785 7.785 7.623 0.162 19668 7933 1 22 . 1 1 31 31 LYS N N 31 119.130 119.130 117.711 1.419 19668 7934 1 22 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.081 -0.211 19668 7935 1 22 . 1 1 31 31 LYS C C 31 179.104 179.104 178.941 0.163 19668 7936 1 22 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.450 1.266 19668 7937 1 22 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.799 0.457 19668 7938 1 22 . 1 1 31 31 LYS H H 31 8.413 8.413 7.665 0.748 19668 7939 1 22 . 1 1 32 32 LYS N N 32 119.200 119.200 119.378 -0.178 19668 7940 1 22 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.020 0.082 19668 7941 1 22 . 1 1 32 32 LYS C C 32 179.420 179.420 178.997 0.423 19668 7942 1 22 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.396 0.061 19668 7943 1 22 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.269 -0.003 19668 7944 1 22 . 1 1 32 32 LYS H H 32 7.826 7.826 7.523 0.303 19668 7945 1 22 . 1 1 33 33 LYS N N 33 120.322 120.322 119.312 1.010 19668 7946 1 22 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.067 0.096 19668 7947 1 22 . 1 1 33 33 LYS C C 33 179.174 179.174 178.736 0.438 19668 7948 1 22 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.750 -0.002 19668 7949 1 22 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.137 -0.398 19668 7950 1 22 . 1 1 33 33 LYS H H 33 8.003 8.003 7.484 0.519 19668 7951 1 22 . 1 1 34 34 TYR N N 34 120.223 120.223 119.322 0.901 19668 7952 1 22 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.083 -0.027 19668 7953 1 22 . 1 1 34 34 TYR C C 34 176.356 176.356 177.923 -1.567 19668 7954 1 22 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.795 -0.740 19668 7955 1 22 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.405 -0.378 19668 7956 1 22 . 1 1 34 34 TYR H H 34 8.614 8.614 7.576 1.038 19668 7957 1 22 . 1 1 35 35 GLU N N 35 118.813 118.813 117.355 1.458 19668 7958 1 22 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.897 -0.172 19668 7959 1 22 . 1 1 35 35 GLU C C 35 179.787 179.787 178.541 1.246 19668 7960 1 22 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.635 -0.196 19668 7961 1 22 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.001 0.127 19668 7962 1 22 . 1 1 35 35 GLU H H 35 8.103 8.103 7.899 0.204 19668 7963 1 22 . 1 1 36 36 GLU N N 36 119.670 119.670 119.639 0.031 19668 7964 1 22 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.071 -0.057 19668 7965 1 22 . 1 1 36 36 GLU C C 36 179.295 179.295 178.881 0.414 19668 7966 1 22 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.169 0.094 19668 7967 1 22 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.578 -0.009 19668 7968 1 22 . 1 1 36 36 GLU H H 36 8.028 8.028 7.660 0.368 19668 7969 1 22 . 1 1 37 37 LEU N N 37 121.416 121.416 120.492 0.924 19668 7970 1 22 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.995 0.024 19668 7971 1 22 . 1 1 37 37 LEU C C 37 178.277 178.277 179.061 -0.784 19668 7972 1 22 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.827 0.013 19668 7973 1 22 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.247 0.382 19668 7974 1 22 . 1 1 37 37 LEU H H 37 8.176 8.176 7.342 0.834 19668 7975 1 22 . 1 1 38 38 LYS N N 38 118.998 118.998 118.686 0.312 19668 7976 1 22 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.961 -0.301 19668 7977 1 22 . 1 1 38 38 LYS C C 38 178.923 178.923 179.258 -0.335 19668 7978 1 22 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.619 0.781 19668 7979 1 22 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.103 -0.041 19668 7980 1 22 . 1 1 38 38 LYS H H 38 8.260 8.260 7.612 0.648 19668 7981 1 22 . 1 1 39 39 LYS N N 39 118.070 118.070 118.025 0.045 19668 7982 1 22 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.075 0.005 19668 7983 1 22 . 1 1 39 39 LYS C C 39 178.687 178.687 179.048 -0.361 19668 7984 1 22 . 1 1 39 39 LYS CA C 39 58.936 58.936 58.362 0.574 19668 7985 1 22 . 1 1 39 39 LYS CB C 39 32.149 32.149 31.762 0.387 19668 7986 1 22 . 1 1 39 39 LYS H H 39 7.380 7.380 7.510 -0.130 19668 7987 1 22 . 1 1 40 40 LYS N N 40 118.894 118.894 120.226 -1.332 19668 7988 1 22 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.075 -0.016 19668 7989 1 22 . 1 1 40 40 LYS C C 40 179.758 179.758 179.178 0.580 19668 7990 1 22 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.406 -0.344 19668 7991 1 22 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.381 0.007 19668 7992 1 22 . 1 1 40 40 LYS H H 40 7.919 7.919 7.349 0.570 19668 7993 1 22 . 1 1 41 41 ILE N N 41 118.270 118.270 118.877 -0.607 19668 7994 1 22 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.736 -0.039 19668 7995 1 22 . 1 1 41 41 ILE C C 41 178.211 178.211 177.061 1.150 19668 7996 1 22 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.841 -0.127 19668 7997 1 22 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.729 0.110 19668 7998 1 22 . 1 1 41 41 ILE H H 41 8.199 8.199 7.479 0.720 19668 7999 1 22 . 1 1 42 42 GLU N N 42 120.117 120.117 116.728 3.389 19668 8000 1 22 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.082 0.009 19668 8001 1 22 . 1 1 42 42 GLU C C 42 178.736 178.736 177.702 1.034 19668 8002 1 22 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.563 0.317 19668 8003 1 22 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.783 -0.392 19668 8004 1 22 . 1 1 42 42 GLU H H 42 7.738 7.738 7.542 0.196 19668 8005 1 22 . 1 1 43 43 GLU N N 43 117.194 117.194 116.886 0.308 19668 8006 1 22 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.189 0.110 19668 8007 1 22 . 1 1 43 43 GLU C C 43 177.658 177.658 177.538 0.120 19668 8008 1 22 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.663 0.131 19668 8009 1 22 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.136 -0.202 19668 8010 1 22 . 1 1 43 43 GLU H H 43 7.698 7.698 7.569 0.129 19668 8011 1 22 . 1 1 44 44 LEU N N 44 120.812 120.812 120.614 0.198 19668 8012 1 22 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.036 0.203 19668 8013 1 22 . 1 1 44 44 LEU C C 44 178.682 178.682 177.246 1.436 19668 8014 1 22 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.169 1.327 19668 8015 1 22 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.576 0.071 19668 8016 1 22 . 1 1 44 44 LEU H H 44 7.593 7.593 7.458 0.135 19668 8017 1 22 . 1 1 45 45 GLY N N 45 108.681 108.681 110.341 -1.660 19668 8018 1 22 . 1 1 45 45 GLY C C 45 174.957 174.957 173.862 1.095 19668 8019 1 22 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.316 0.770 19668 8020 1 22 . 1 1 45 45 GLY H H 45 8.234 8.234 8.670 -0.436 19668 8021 1 22 . 1 1 46 46 GLY N N 46 108.057 108.057 107.433 0.624 19668 8022 1 22 . 1 1 46 46 GLY C C 46 174.777 174.777 173.329 1.448 19668 8023 1 22 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.419 -0.055 19668 8024 1 22 . 1 1 46 46 GLY H H 46 8.182 8.182 7.686 0.496 19668 8025 1 22 . 1 1 47 47 GLY N N 47 108.494 108.494 108.149 0.345 19668 8026 1 22 . 1 1 47 47 GLY C C 47 174.572 174.572 174.220 0.352 19668 8027 1 22 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.966 0.189 19668 8028 1 22 . 1 1 47 47 GLY H H 47 8.087 8.087 8.025 0.062 19668 8029 1 22 . 1 1 48 48 GLY N N 48 108.285 108.285 106.533 1.752 19668 8030 1 22 . 1 1 48 48 GLY C C 48 174.495 174.495 173.887 0.608 19668 8031 1 22 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.365 0.089 19668 8032 1 22 . 1 1 48 48 GLY H H 48 8.323 8.323 8.372 -0.049 19668 8033 1 22 . 1 1 49 49 GLU N N 49 121.070 121.070 121.143 -0.073 19668 8034 1 22 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.445 -0.028 19668 8035 1 22 . 1 1 49 49 GLU C C 49 177.226 177.226 178.136 -0.910 19668 8036 1 22 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.616 -0.045 19668 8037 1 22 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.022 -0.356 19668 8038 1 22 . 1 1 49 49 GLU H H 49 8.483 8.483 7.796 0.687 19668 8039 1 22 . 1 1 50 50 VAL N N 50 121.794 121.794 118.935 2.859 19668 8040 1 22 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.738 0.043 19668 8041 1 22 . 1 1 50 50 VAL C C 50 176.860 176.860 177.301 -0.441 19668 8042 1 22 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.980 -0.900 19668 8043 1 22 . 1 1 50 50 VAL CB C 50 32.253 32.253 30.761 1.492 19668 8044 1 22 . 1 1 50 50 VAL H H 50 8.068 8.068 7.706 0.362 19668 8045 1 22 . 1 1 51 51 LYS N N 51 120.593 120.593 118.592 2.001 19668 8046 1 22 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.078 0.129 19668 8047 1 22 . 1 1 51 51 LYS C C 51 178.667 178.667 178.944 -0.277 19668 8048 1 22 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.620 0.715 19668 8049 1 22 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.309 0.949 19668 8050 1 22 . 1 1 51 51 LYS H H 51 8.253 8.253 8.358 -0.105 19668 8051 1 22 . 1 1 52 52 LYS N N 52 117.572 117.572 119.140 -1.568 19668 8052 1 22 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.094 0.074 19668 8053 1 22 . 1 1 52 52 LYS C C 52 179.248 179.248 178.830 0.418 19668 8054 1 22 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.325 -0.311 19668 8055 1 22 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.457 -0.277 19668 8056 1 22 . 1 1 52 52 LYS H H 52 7.629 7.629 7.722 -0.093 19668 8057 1 22 . 1 1 53 53 VAL N N 53 119.059 119.059 118.842 0.217 19668 8058 1 22 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.643 0.149 19668 8059 1 22 . 1 1 53 53 VAL C C 53 177.987 177.987 177.571 0.416 19668 8060 1 22 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.522 -0.491 19668 8061 1 22 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.717 -0.346 19668 8062 1 22 . 1 1 53 53 VAL H H 53 7.638 7.638 7.257 0.381 19668 8063 1 22 . 1 1 54 54 GLU N N 54 120.388 120.388 119.028 1.360 19668 8064 1 22 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.903 -0.059 19668 8065 1 22 . 1 1 54 54 GLU C C 54 179.624 179.624 178.676 0.948 19668 8066 1 22 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.643 0.598 19668 8067 1 22 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.066 0.752 19668 8068 1 22 . 1 1 54 54 GLU H H 54 8.603 8.603 7.675 0.928 19668 8069 1 22 . 1 1 55 55 GLU N N 55 118.533 118.533 119.438 -0.905 19668 8070 1 22 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.053 0.036 19668 8071 1 22 . 1 1 55 55 GLU C C 55 179.158 179.158 178.803 0.355 19668 8072 1 22 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.128 0.206 19668 8073 1 22 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.589 -0.252 19668 8074 1 22 . 1 1 55 55 GLU H H 55 7.904 7.904 7.555 0.349 19668 8075 1 22 . 1 1 56 56 GLU N N 56 120.258 120.258 119.507 0.751 19668 8076 1 22 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.033 0.067 19668 8077 1 22 . 1 1 56 56 GLU C C 56 179.867 179.867 179.314 0.553 19668 8078 1 22 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.179 0.483 19668 8079 1 22 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.422 0.628 19668 8080 1 22 . 1 1 56 56 GLU H H 56 7.902 7.902 7.457 0.445 19668 8081 1 22 . 1 1 57 57 VAL N N 57 121.168 121.168 119.007 2.161 19668 8082 1 22 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.587 -0.019 19668 8083 1 22 . 1 1 57 57 VAL C C 57 176.994 176.994 177.240 -0.246 19668 8084 1 22 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.691 2.205 19668 8085 1 22 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.503 0.024 19668 8086 1 22 . 1 1 57 57 VAL H H 57 8.613 8.613 7.481 1.132 19668 8087 1 22 . 1 1 58 58 LYS N N 58 120.234 120.234 118.811 1.423 19668 8088 1 22 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.972 0.230 19668 8089 1 22 . 1 1 58 58 LYS C C 58 179.131 179.131 178.243 0.888 19668 8090 1 22 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.649 -0.062 19668 8091 1 22 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.505 0.786 19668 8092 1 22 . 1 1 58 58 LYS H H 58 7.810 7.810 7.604 0.206 19668 8093 1 22 . 1 1 59 59 LYS N N 59 118.301 118.301 118.922 -0.621 19668 8094 1 22 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.065 0.028 19668 8095 1 22 . 1 1 59 59 LYS C C 59 179.281 179.281 178.376 0.905 19668 8096 1 22 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.092 0.336 19668 8097 1 22 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.941 0.439 19668 8098 1 22 . 1 1 59 59 LYS H H 59 7.876 7.876 7.395 0.481 19668 8099 1 22 . 1 1 60 60 LEU N N 60 121.224 121.224 120.177 1.047 19668 8100 1 22 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.014 0.220 19668 8101 1 22 . 1 1 60 60 LEU C C 60 178.636 178.636 178.791 -0.155 19668 8102 1 22 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.789 0.368 19668 8103 1 22 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.300 0.334 19668 8104 1 22 . 1 1 60 60 LEU H H 60 7.893 7.893 7.574 0.319 19668 8105 1 22 . 1 1 61 61 GLU N N 61 118.660 118.660 118.209 0.451 19668 8106 1 22 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.077 -0.278 19668 8107 1 22 . 1 1 61 61 GLU C C 61 179.094 179.094 178.740 0.354 19668 8108 1 22 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.027 1.245 19668 8109 1 22 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.520 1.484 19668 8110 1 22 . 1 1 61 61 GLU H H 61 8.644 8.644 7.828 0.816 19668 8111 1 22 . 1 1 62 62 GLU N N 62 117.555 117.555 119.769 -2.214 19668 8112 1 22 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.996 0.000 19668 8113 1 22 . 1 1 62 62 GLU C C 62 178.940 178.940 179.051 -0.111 19668 8114 1 22 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.453 -0.285 19668 8115 1 22 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.349 0.198 19668 8116 1 22 . 1 1 62 62 GLU H H 62 7.995 7.995 7.532 0.463 19668 8117 1 22 . 1 1 63 63 GLU N N 63 119.097 119.097 118.110 0.987 19668 8118 1 22 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.140 -0.111 19668 8119 1 22 . 1 1 63 63 GLU C C 63 179.890 179.890 179.054 0.836 19668 8120 1 22 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.656 0.685 19668 8121 1 22 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.023 0.644 19668 8122 1 22 . 1 1 63 63 GLU H H 63 7.983 7.983 7.742 0.241 19668 8123 1 22 . 1 1 64 64 ILE N N 64 118.247 118.247 118.390 -0.143 19668 8124 1 22 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.867 -0.147 19668 8125 1 22 . 1 1 64 64 ILE C C 64 177.858 177.858 177.573 0.285 19668 8126 1 22 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.353 0.143 19668 8127 1 22 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.387 0.594 19668 8128 1 22 . 1 1 64 64 ILE H H 64 8.261 8.261 7.285 0.976 19668 8129 1 22 . 1 1 65 65 LYS N N 65 118.693 118.693 119.039 -0.346 19668 8130 1 22 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.184 -0.086 19668 8131 1 22 . 1 1 65 65 LYS C C 65 177.244 177.244 177.604 -0.360 19668 8132 1 22 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.150 0.503 19668 8133 1 22 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.059 0.646 19668 8134 1 22 . 1 1 65 65 LYS H H 65 7.661 7.661 7.538 0.123 19668 8135 1 22 . 1 1 66 66 LYS N N 66 116.933 116.933 117.143 -0.210 19668 8136 1 22 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.139 0.199 19668 8137 1 22 . 1 1 66 66 LYS C C 66 176.011 176.011 177.600 -1.589 19668 8138 1 22 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.261 -0.802 19668 8139 1 22 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.367 0.764 19668 8140 1 22 . 1 1 66 66 LYS H H 66 7.261 7.261 7.571 -0.310 19668 8141 1 23 . 1 1 2 2 SER HA H 2 4.560 4.560 4.510 0.050 19668 8142 1 23 . 1 1 2 2 SER CA C 2 58.366 58.366 59.574 -1.208 19668 8143 1 23 . 1 1 3 3 ARG N N 3 125.213 125.213 122.308 2.905 19668 8144 1 23 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.081 0.185 19668 8145 1 23 . 1 1 3 3 ARG C C 3 178.381 178.381 178.291 0.090 19668 8146 1 23 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.665 -0.269 19668 8147 1 23 . 1 1 3 3 ARG CB C 3 30.655 30.655 28.873 1.782 19668 8148 1 23 . 1 1 3 3 ARG H H 3 8.874 8.874 8.498 0.376 19668 8149 1 23 . 1 1 4 4 VAL N N 4 119.320 119.320 119.509 -0.189 19668 8150 1 23 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.705 0.093 19668 8151 1 23 . 1 1 4 4 VAL C C 4 177.004 177.004 177.489 -0.485 19668 8152 1 23 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.121 -0.606 19668 8153 1 23 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.551 0.252 19668 8154 1 23 . 1 1 4 4 VAL H H 4 8.112 8.112 7.911 0.201 19668 8155 1 23 . 1 1 5 5 LYS N N 5 122.279 122.279 120.521 1.758 19668 8156 1 23 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.946 0.216 19668 8157 1 23 . 1 1 5 5 LYS C C 5 178.547 178.547 178.418 0.129 19668 8158 1 23 . 1 1 5 5 LYS CA C 5 58.758 58.758 59.362 -0.604 19668 8159 1 23 . 1 1 5 5 LYS CB C 5 32.010 32.010 32.004 0.006 19668 8160 1 23 . 1 1 5 5 LYS H H 5 7.847 7.847 7.369 0.478 19668 8161 1 23 . 1 1 6 6 ALA N N 6 120.295 120.295 122.113 -1.818 19668 8162 1 23 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.096 0.115 19668 8163 1 23 . 1 1 6 6 ALA C C 6 180.834 180.834 179.714 1.120 19668 8164 1 23 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.900 0.003 19668 8165 1 23 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.103 0.029 19668 8166 1 23 . 1 1 6 6 ALA H H 6 7.975 7.975 8.254 -0.279 19668 8167 1 23 . 1 1 7 7 LEU N N 7 119.570 119.570 118.457 1.113 19668 8168 1 23 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.058 0.114 19668 8169 1 23 . 1 1 7 7 LEU C C 7 178.431 178.431 178.504 -0.073 19668 8170 1 23 . 1 1 7 7 LEU CA C 7 57.679 57.679 58.010 -0.331 19668 8171 1 23 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.151 0.884 19668 8172 1 23 . 1 1 7 7 LEU H H 7 7.650 7.650 7.651 -0.001 19668 8173 1 23 . 1 1 8 8 GLU N N 8 119.934 119.934 118.226 1.708 19668 8174 1 23 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.056 -0.197 19668 8175 1 23 . 1 1 8 8 GLU C C 8 179.534 179.534 178.442 1.092 19668 8176 1 23 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.447 0.591 19668 8177 1 23 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.771 0.696 19668 8178 1 23 . 1 1 8 8 GLU H H 8 8.411 8.411 7.793 0.618 19668 8179 1 23 . 1 1 9 9 GLU N N 9 118.234 118.234 118.823 -0.589 19668 8180 1 23 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.089 -0.029 19668 8181 1 23 . 1 1 9 9 GLU C C 9 179.596 179.596 178.994 0.602 19668 8182 1 23 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.164 0.166 19668 8183 1 23 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.117 0.301 19668 8184 1 23 . 1 1 9 9 GLU H H 9 8.206 8.206 7.781 0.425 19668 8185 1 23 . 1 1 10 10 LYS N N 10 121.042 121.042 119.163 1.879 19668 8186 1 23 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.162 0.021 19668 8187 1 23 . 1 1 10 10 LYS C C 10 179.380 179.380 179.118 0.262 19668 8188 1 23 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.114 0.212 19668 8189 1 23 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.098 0.311 19668 8190 1 23 . 1 1 10 10 LYS H H 10 7.931 7.931 7.557 0.374 19668 8191 1 23 . 1 1 11 11 VAL N N 11 118.662 118.662 120.095 -1.433 19668 8192 1 23 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.829 -0.015 19668 8193 1 23 . 1 1 11 11 VAL C C 11 178.845 178.845 178.194 0.651 19668 8194 1 23 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.183 0.805 19668 8195 1 23 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.696 -0.042 19668 8196 1 23 . 1 1 11 11 VAL H H 11 8.371 8.371 7.568 0.803 19668 8197 1 23 . 1 1 12 12 LYS N N 12 123.188 123.188 119.557 3.631 19668 8198 1 23 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.994 0.232 19668 8199 1 23 . 1 1 12 12 LYS C C 12 179.098 179.098 178.306 0.792 19668 8200 1 23 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.127 0.356 19668 8201 1 23 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.205 0.001 19668 8202 1 23 . 1 1 12 12 LYS H H 12 8.276 8.276 7.536 0.740 19668 8203 1 23 . 1 1 13 13 ALA N N 13 121.169 121.169 121.697 -0.528 19668 8204 1 23 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.040 0.218 19668 8205 1 23 . 1 1 13 13 ALA C C 13 180.169 180.169 179.364 0.805 19668 8206 1 23 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.920 -0.284 19668 8207 1 23 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.436 -0.329 19668 8208 1 23 . 1 1 13 13 ALA H H 13 7.829 7.829 7.424 0.405 19668 8209 1 23 . 1 1 14 14 LEU N N 14 118.104 118.104 118.263 -0.159 19668 8210 1 23 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.032 0.124 19668 8211 1 23 . 1 1 14 14 LEU C C 14 177.614 177.614 177.896 -0.282 19668 8212 1 23 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.092 -0.487 19668 8213 1 23 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.955 0.840 19668 8214 1 23 . 1 1 14 14 LEU H H 14 7.781 7.781 7.423 0.358 19668 8215 1 23 . 1 1 15 15 GLU N N 15 120.632 120.632 119.114 1.518 19668 8216 1 23 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.389 -0.022 19668 8217 1 23 . 1 1 15 15 GLU C C 15 178.243 178.243 178.614 -0.371 19668 8218 1 23 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.531 1.055 19668 8219 1 23 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.905 0.923 19668 8220 1 23 . 1 1 15 15 GLU H H 15 7.873 7.873 7.314 0.559 19668 8221 1 23 . 1 1 16 16 GLU N N 16 115.775 115.775 117.297 -1.522 19668 8222 1 23 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.992 -0.033 19668 8223 1 23 . 1 1 16 16 GLU C C 16 179.006 179.006 178.800 0.206 19668 8224 1 23 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.139 -0.047 19668 8225 1 23 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.478 -0.125 19668 8226 1 23 . 1 1 16 16 GLU H H 16 7.926 7.926 7.669 0.257 19668 8227 1 23 . 1 1 17 17 LYS N N 17 118.801 118.801 118.747 0.054 19668 8228 1 23 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.097 -0.003 19668 8229 1 23 . 1 1 17 17 LYS C C 17 178.853 178.853 178.626 0.227 19668 8230 1 23 . 1 1 17 17 LYS CA C 17 58.471 58.471 59.175 -0.704 19668 8231 1 23 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.832 0.530 19668 8232 1 23 . 1 1 17 17 LYS H H 17 7.518 7.518 7.607 -0.089 19668 8233 1 23 . 1 1 18 18 VAL N N 18 118.034 118.034 119.715 -1.681 19668 8234 1 23 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.660 -0.148 19668 8235 1 23 . 1 1 18 18 VAL C C 18 178.362 178.362 177.699 0.663 19668 8236 1 23 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.207 -0.188 19668 8237 1 23 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.305 0.344 19668 8238 1 23 . 1 1 18 18 VAL H H 18 8.048 8.048 7.127 0.921 19668 8239 1 23 . 1 1 19 19 LYS N N 19 118.427 118.427 118.620 -0.193 19668 8240 1 23 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.101 -0.091 19668 8241 1 23 . 1 1 19 19 LYS C C 19 177.706 177.706 177.788 -0.082 19668 8242 1 23 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.837 0.148 19668 8243 1 23 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.805 0.619 19668 8244 1 23 . 1 1 19 19 LYS H H 19 8.008 8.008 7.456 0.552 19668 8245 1 23 . 1 1 20 20 ALA N N 20 119.177 119.177 121.269 -2.092 19668 8246 1 23 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.340 -0.024 19668 8247 1 23 . 1 1 20 20 ALA C C 20 178.269 178.269 178.812 -0.543 19668 8248 1 23 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.469 -0.838 19668 8249 1 23 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.643 0.490 19668 8250 1 23 . 1 1 20 20 ALA H H 20 7.259 7.259 7.567 -0.308 19668 8251 1 23 . 1 1 21 21 LEU N N 21 118.596 118.596 115.227 3.369 19668 8252 1 23 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.236 0.025 19668 8253 1 23 . 1 1 21 21 LEU C C 21 177.732 177.732 177.291 0.441 19668 8254 1 23 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.951 -0.294 19668 8255 1 23 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.304 0.829 19668 8256 1 23 . 1 1 21 21 LEU H H 21 7.373 7.373 7.273 0.100 19668 8257 1 23 . 1 1 22 22 GLY N N 22 107.926 107.926 104.782 3.144 19668 8258 1 23 . 1 1 22 22 GLY C C 22 173.362 173.362 172.362 1.000 19668 8259 1 23 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.519 0.678 19668 8260 1 23 . 1 1 22 22 GLY H H 22 8.144 8.144 7.307 0.837 19668 8261 1 23 . 1 1 23 23 GLY N N 23 108.242 108.242 106.401 1.841 19668 8262 1 23 . 1 1 23 23 GLY C C 23 174.110 174.110 172.942 1.168 19668 8263 1 23 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.915 -0.231 19668 8264 1 23 . 1 1 23 23 GLY H H 23 8.157 8.157 7.965 0.192 19668 8265 1 23 . 1 1 24 24 GLY N N 24 106.969 106.969 109.972 -3.003 19668 8266 1 23 . 1 1 24 24 GLY C C 24 175.172 175.172 174.784 0.388 19668 8267 1 23 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.402 -0.963 19668 8268 1 23 . 1 1 24 24 GLY H H 24 8.466 8.466 8.007 0.459 19668 8269 1 23 . 1 1 25 25 GLY N N 25 108.946 108.946 107.539 1.407 19668 8270 1 23 . 1 1 25 25 GLY C C 25 176.321 176.321 175.847 0.474 19668 8271 1 23 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.080 1.019 19668 8272 1 23 . 1 1 25 25 GLY H H 25 8.618 8.618 8.345 0.273 19668 8273 1 23 . 1 1 26 26 ARG N N 26 123.559 123.559 121.131 2.428 19668 8274 1 23 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.609 -0.330 19668 8275 1 23 . 1 1 26 26 ARG C C 26 178.076 178.076 178.325 -0.249 19668 8276 1 23 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.529 -0.614 19668 8277 1 23 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.205 -0.295 19668 8278 1 23 . 1 1 26 26 ARG H H 26 8.789 8.789 8.369 0.420 19668 8279 1 23 . 1 1 27 27 ILE N N 27 118.726 118.726 118.615 0.111 19668 8280 1 23 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.847 -0.061 19668 8281 1 23 . 1 1 27 27 ILE C C 27 177.639 177.639 177.787 -0.148 19668 8282 1 23 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.104 0.520 19668 8283 1 23 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.848 0.107 19668 8284 1 23 . 1 1 27 27 ILE H H 27 7.762 7.762 8.110 -0.348 19668 8285 1 23 . 1 1 28 28 GLU N N 28 119.843 119.843 118.598 1.245 19668 8286 1 23 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.990 0.023 19668 8287 1 23 . 1 1 28 28 GLU C C 28 179.447 179.447 178.957 0.490 19668 8288 1 23 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.811 -0.228 19668 8289 1 23 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.589 -0.529 19668 8290 1 23 . 1 1 28 28 GLU H H 28 7.867 7.867 7.706 0.161 19668 8291 1 23 . 1 1 29 29 GLU N N 29 118.447 118.447 119.293 -0.846 19668 8292 1 23 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.097 -0.010 19668 8293 1 23 . 1 1 29 29 GLU C C 29 179.310 179.310 178.884 0.426 19668 8294 1 23 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.700 0.580 19668 8295 1 23 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.153 0.183 19668 8296 1 23 . 1 1 29 29 GLU H H 29 7.755 7.755 7.662 0.093 19668 8297 1 23 . 1 1 30 30 LEU N N 30 121.135 121.135 121.542 -0.407 19668 8298 1 23 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.017 0.079 19668 8299 1 23 . 1 1 30 30 LEU C C 30 178.928 178.928 178.724 0.204 19668 8300 1 23 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.168 -0.063 19668 8301 1 23 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.155 -0.475 19668 8302 1 23 . 1 1 30 30 LEU H H 30 7.785 7.785 7.655 0.130 19668 8303 1 23 . 1 1 31 31 LYS N N 31 119.130 119.130 117.945 1.185 19668 8304 1 23 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.085 -0.215 19668 8305 1 23 . 1 1 31 31 LYS C C 31 179.104 179.104 178.972 0.132 19668 8306 1 23 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.476 1.240 19668 8307 1 23 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.803 0.453 19668 8308 1 23 . 1 1 31 31 LYS H H 31 8.413 8.413 7.604 0.809 19668 8309 1 23 . 1 1 32 32 LYS N N 32 119.200 119.200 119.363 -0.163 19668 8310 1 23 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.024 0.078 19668 8311 1 23 . 1 1 32 32 LYS C C 32 179.420 179.420 178.879 0.541 19668 8312 1 23 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.454 0.003 19668 8313 1 23 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.254 0.012 19668 8314 1 23 . 1 1 32 32 LYS H H 32 7.826 7.826 7.536 0.290 19668 8315 1 23 . 1 1 33 33 LYS N N 33 120.322 120.322 119.174 1.148 19668 8316 1 23 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.023 0.140 19668 8317 1 23 . 1 1 33 33 LYS C C 33 179.174 179.174 178.927 0.247 19668 8318 1 23 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.111 -0.363 19668 8319 1 23 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.395 -0.656 19668 8320 1 23 . 1 1 33 33 LYS H H 33 8.003 8.003 7.508 0.495 19668 8321 1 23 . 1 1 34 34 TYR N N 34 120.223 120.223 119.468 0.755 19668 8322 1 23 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.086 -0.030 19668 8323 1 23 . 1 1 34 34 TYR C C 34 176.356 176.356 177.994 -1.638 19668 8324 1 23 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.759 -0.704 19668 8325 1 23 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.394 -0.367 19668 8326 1 23 . 1 1 34 34 TYR H H 34 8.614 8.614 7.595 1.019 19668 8327 1 23 . 1 1 35 35 GLU N N 35 118.813 118.813 117.142 1.671 19668 8328 1 23 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.914 -0.189 19668 8329 1 23 . 1 1 35 35 GLU C C 35 179.787 179.787 178.719 1.068 19668 8330 1 23 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.701 -0.262 19668 8331 1 23 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.120 0.007 19668 8332 1 23 . 1 1 35 35 GLU H H 35 8.103 8.103 7.900 0.203 19668 8333 1 23 . 1 1 36 36 GLU N N 36 119.670 119.670 119.719 -0.049 19668 8334 1 23 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.108 -0.094 19668 8335 1 23 . 1 1 36 36 GLU C C 36 179.295 179.295 178.883 0.412 19668 8336 1 23 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.233 0.030 19668 8337 1 23 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.395 0.174 19668 8338 1 23 . 1 1 36 36 GLU H H 36 8.028 8.028 7.706 0.322 19668 8339 1 23 . 1 1 37 37 LEU N N 37 121.416 121.416 118.890 2.526 19668 8340 1 23 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.908 0.111 19668 8341 1 23 . 1 1 37 37 LEU C C 37 178.277 178.277 178.978 -0.701 19668 8342 1 23 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.601 0.239 19668 8343 1 23 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.688 -0.059 19668 8344 1 23 . 1 1 37 37 LEU H H 37 8.176 8.176 7.387 0.789 19668 8345 1 23 . 1 1 38 38 LYS N N 38 118.998 118.998 118.644 0.354 19668 8346 1 23 . 1 1 38 38 LYS HA H 38 3.660 3.660 4.016 -0.356 19668 8347 1 23 . 1 1 38 38 LYS C C 38 178.923 178.923 178.750 0.173 19668 8348 1 23 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.899 0.501 19668 8349 1 23 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.082 -0.020 19668 8350 1 23 . 1 1 38 38 LYS H H 38 8.260 8.260 7.500 0.760 19668 8351 1 23 . 1 1 39 39 LYS N N 39 118.070 118.070 118.904 -0.834 19668 8352 1 23 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.008 0.072 19668 8353 1 23 . 1 1 39 39 LYS C C 39 178.687 178.687 178.870 -0.183 19668 8354 1 23 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.407 -0.471 19668 8355 1 23 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.019 0.130 19668 8356 1 23 . 1 1 39 39 LYS H H 39 7.380 7.380 7.601 -0.221 19668 8357 1 23 . 1 1 40 40 LYS N N 40 118.894 118.894 118.813 0.081 19668 8358 1 23 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.095 -0.036 19668 8359 1 23 . 1 1 40 40 LYS C C 40 179.758 179.758 178.863 0.895 19668 8360 1 23 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.311 -0.249 19668 8361 1 23 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.326 0.062 19668 8362 1 23 . 1 1 40 40 LYS H H 40 7.919 7.919 7.513 0.406 19668 8363 1 23 . 1 1 41 41 ILE N N 41 118.270 118.270 118.604 -0.334 19668 8364 1 23 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.758 -0.061 19668 8365 1 23 . 1 1 41 41 ILE C C 41 178.211 178.211 176.997 1.214 19668 8366 1 23 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.329 0.385 19668 8367 1 23 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.807 0.032 19668 8368 1 23 . 1 1 41 41 ILE H H 41 8.199 8.199 7.375 0.824 19668 8369 1 23 . 1 1 42 42 GLU N N 42 120.117 120.117 117.749 2.368 19668 8370 1 23 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.030 0.061 19668 8371 1 23 . 1 1 42 42 GLU C C 42 178.736 178.736 177.732 1.004 19668 8372 1 23 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.762 0.118 19668 8373 1 23 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.918 -0.527 19668 8374 1 23 . 1 1 42 42 GLU H H 42 7.738 7.738 7.478 0.260 19668 8375 1 23 . 1 1 43 43 GLU N N 43 117.194 117.194 116.392 0.802 19668 8376 1 23 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.173 0.126 19668 8377 1 23 . 1 1 43 43 GLU C C 43 177.658 177.658 177.537 0.121 19668 8378 1 23 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.554 -0.761 19668 8379 1 23 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.456 -0.523 19668 8380 1 23 . 1 1 43 43 GLU H H 43 7.698 7.698 7.538 0.160 19668 8381 1 23 . 1 1 44 44 LEU N N 44 120.812 120.812 117.701 3.111 19668 8382 1 23 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.306 -0.067 19668 8383 1 23 . 1 1 44 44 LEU C C 44 178.682 178.682 177.082 1.600 19668 8384 1 23 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.340 1.156 19668 8385 1 23 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.526 0.121 19668 8386 1 23 . 1 1 44 44 LEU H H 44 7.593 7.593 7.451 0.142 19668 8387 1 23 . 1 1 45 45 GLY N N 45 108.681 108.681 106.932 1.749 19668 8388 1 23 . 1 1 45 45 GLY C C 45 174.957 174.957 173.849 1.108 19668 8389 1 23 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.067 1.019 19668 8390 1 23 . 1 1 45 45 GLY H H 45 8.234 8.234 8.641 -0.407 19668 8391 1 23 . 1 1 46 46 GLY N N 46 108.057 108.057 106.237 1.820 19668 8392 1 23 . 1 1 46 46 GLY C C 46 174.777 174.777 173.633 1.144 19668 8393 1 23 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.746 0.618 19668 8394 1 23 . 1 1 46 46 GLY H H 46 8.182 8.182 7.467 0.715 19668 8395 1 23 . 1 1 47 47 GLY N N 47 108.494 108.494 108.666 -0.172 19668 8396 1 23 . 1 1 47 47 GLY C C 47 174.572 174.572 174.686 -0.114 19668 8397 1 23 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.504 -0.349 19668 8398 1 23 . 1 1 47 47 GLY H H 47 8.087 8.087 8.317 -0.230 19668 8399 1 23 . 1 1 48 48 GLY N N 48 108.285 108.285 111.097 -2.812 19668 8400 1 23 . 1 1 48 48 GLY C C 48 174.495 174.495 173.895 0.600 19668 8401 1 23 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.377 0.077 19668 8402 1 23 . 1 1 48 48 GLY H H 48 8.323 8.323 8.317 0.006 19668 8403 1 23 . 1 1 49 49 GLU N N 49 121.070 121.070 120.379 0.691 19668 8404 1 23 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.423 -0.006 19668 8405 1 23 . 1 1 49 49 GLU C C 49 177.226 177.226 178.120 -0.894 19668 8406 1 23 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.326 -0.755 19668 8407 1 23 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.002 -0.335 19668 8408 1 23 . 1 1 49 49 GLU H H 49 8.483 8.483 8.078 0.405 19668 8409 1 23 . 1 1 50 50 VAL N N 50 121.794 121.794 117.149 4.645 19668 8410 1 23 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.754 0.027 19668 8411 1 23 . 1 1 50 50 VAL C C 50 176.860 176.860 177.488 -0.628 19668 8412 1 23 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.307 -0.227 19668 8413 1 23 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.323 0.930 19668 8414 1 23 . 1 1 50 50 VAL H H 50 8.068 8.068 7.938 0.130 19668 8415 1 23 . 1 1 51 51 LYS N N 51 120.593 120.593 119.919 0.674 19668 8416 1 23 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.476 -0.269 19668 8417 1 23 . 1 1 51 51 LYS C C 51 178.667 178.667 178.961 -0.294 19668 8418 1 23 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.243 0.092 19668 8419 1 23 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.806 0.452 19668 8420 1 23 . 1 1 51 51 LYS H H 51 8.253 8.253 8.416 -0.163 19668 8421 1 23 . 1 1 52 52 LYS N N 52 117.572 117.572 120.133 -2.561 19668 8422 1 23 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.056 0.112 19668 8423 1 23 . 1 1 52 52 LYS C C 52 179.248 179.248 179.013 0.235 19668 8424 1 23 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.330 -0.316 19668 8425 1 23 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.478 -0.298 19668 8426 1 23 . 1 1 52 52 LYS H H 52 7.629 7.629 7.722 -0.093 19668 8427 1 23 . 1 1 53 53 VAL N N 53 119.059 119.059 119.192 -0.133 19668 8428 1 23 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.620 0.172 19668 8429 1 23 . 1 1 53 53 VAL C C 53 177.987 177.987 177.591 0.396 19668 8430 1 23 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.741 -0.710 19668 8431 1 23 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.748 -0.377 19668 8432 1 23 . 1 1 53 53 VAL H H 53 7.638 7.638 7.511 0.127 19668 8433 1 23 . 1 1 54 54 GLU N N 54 120.388 120.388 119.447 0.941 19668 8434 1 23 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.911 -0.067 19668 8435 1 23 . 1 1 54 54 GLU C C 54 179.624 179.624 178.824 0.800 19668 8436 1 23 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.877 0.364 19668 8437 1 23 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.274 0.544 19668 8438 1 23 . 1 1 54 54 GLU H H 54 8.603 8.603 7.622 0.981 19668 8439 1 23 . 1 1 55 55 GLU N N 55 118.533 118.533 118.818 -0.285 19668 8440 1 23 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.080 0.009 19668 8441 1 23 . 1 1 55 55 GLU C C 55 179.158 179.158 178.932 0.226 19668 8442 1 23 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.242 0.092 19668 8443 1 23 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.575 -0.238 19668 8444 1 23 . 1 1 55 55 GLU H H 55 7.904 7.904 7.567 0.337 19668 8445 1 23 . 1 1 56 56 GLU N N 56 120.258 120.258 119.596 0.662 19668 8446 1 23 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.029 0.071 19668 8447 1 23 . 1 1 56 56 GLU C C 56 179.867 179.867 179.270 0.597 19668 8448 1 23 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.283 0.380 19668 8449 1 23 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.461 0.589 19668 8450 1 23 . 1 1 56 56 GLU H H 56 7.902 7.902 7.496 0.406 19668 8451 1 23 . 1 1 57 57 VAL N N 57 121.168 121.168 119.971 1.197 19668 8452 1 23 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.568 -0.000 19668 8453 1 23 . 1 1 57 57 VAL C C 57 176.994 176.994 177.235 -0.241 19668 8454 1 23 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.300 1.596 19668 8455 1 23 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.550 -0.023 19668 8456 1 23 . 1 1 57 57 VAL H H 57 8.613 8.613 7.513 1.100 19668 8457 1 23 . 1 1 58 58 LYS N N 58 120.234 120.234 119.209 1.025 19668 8458 1 23 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.973 0.229 19668 8459 1 23 . 1 1 58 58 LYS C C 58 179.131 179.131 179.221 -0.090 19668 8460 1 23 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.139 0.449 19668 8461 1 23 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.810 0.481 19668 8462 1 23 . 1 1 58 58 LYS H H 58 7.810 7.810 7.458 0.352 19668 8463 1 23 . 1 1 59 59 LYS N N 59 118.301 118.301 118.493 -0.192 19668 8464 1 23 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.047 0.046 19668 8465 1 23 . 1 1 59 59 LYS C C 59 179.281 179.281 178.522 0.759 19668 8466 1 23 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.170 0.258 19668 8467 1 23 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.123 0.256 19668 8468 1 23 . 1 1 59 59 LYS H H 59 7.876 7.876 7.436 0.440 19668 8469 1 23 . 1 1 60 60 LEU N N 60 121.224 121.224 120.148 1.076 19668 8470 1 23 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.003 0.232 19668 8471 1 23 . 1 1 60 60 LEU C C 60 178.636 178.636 178.798 -0.162 19668 8472 1 23 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.829 0.328 19668 8473 1 23 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.321 0.313 19668 8474 1 23 . 1 1 60 60 LEU H H 60 7.893 7.893 7.650 0.243 19668 8475 1 23 . 1 1 61 61 GLU N N 61 118.660 118.660 118.072 0.588 19668 8476 1 23 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.079 -0.280 19668 8477 1 23 . 1 1 61 61 GLU C C 61 179.094 179.094 178.762 0.332 19668 8478 1 23 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.015 1.257 19668 8479 1 23 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.655 1.348 19668 8480 1 23 . 1 1 61 61 GLU H H 61 8.644 8.644 7.817 0.827 19668 8481 1 23 . 1 1 62 62 GLU N N 62 117.555 117.555 119.605 -2.050 19668 8482 1 23 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.005 -0.009 19668 8483 1 23 . 1 1 62 62 GLU C C 62 178.940 178.940 179.095 -0.155 19668 8484 1 23 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.347 -0.180 19668 8485 1 23 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.141 0.406 19668 8486 1 23 . 1 1 62 62 GLU H H 62 7.995 7.995 7.573 0.422 19668 8487 1 23 . 1 1 63 63 GLU N N 63 119.097 119.097 118.224 0.873 19668 8488 1 23 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.135 -0.106 19668 8489 1 23 . 1 1 63 63 GLU C C 63 179.890 179.890 179.026 0.864 19668 8490 1 23 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.809 0.532 19668 8491 1 23 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.113 0.555 19668 8492 1 23 . 1 1 63 63 GLU H H 63 7.983 7.983 7.719 0.264 19668 8493 1 23 . 1 1 64 64 ILE N N 64 118.247 118.247 118.741 -0.494 19668 8494 1 23 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.851 -0.131 19668 8495 1 23 . 1 1 64 64 ILE C C 64 177.858 177.858 177.515 0.343 19668 8496 1 23 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.127 0.369 19668 8497 1 23 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.440 0.541 19668 8498 1 23 . 1 1 64 64 ILE H H 64 8.261 8.261 7.305 0.956 19668 8499 1 23 . 1 1 65 65 LYS N N 65 118.693 118.693 119.708 -1.015 19668 8500 1 23 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.175 -0.077 19668 8501 1 23 . 1 1 65 65 LYS C C 65 177.244 177.244 177.638 -0.394 19668 8502 1 23 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.914 0.738 19668 8503 1 23 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.297 0.408 19668 8504 1 23 . 1 1 65 65 LYS H H 65 7.661 7.661 7.593 0.068 19668 8505 1 23 . 1 1 66 66 LYS N N 66 116.933 116.933 117.130 -0.197 19668 8506 1 23 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.121 0.217 19668 8507 1 23 . 1 1 66 66 LYS C C 66 176.011 176.011 177.422 -1.411 19668 8508 1 23 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.849 -1.391 19668 8509 1 23 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.837 0.294 19668 8510 1 23 . 1 1 66 66 LYS H H 66 7.261 7.261 7.533 -0.272 19668 8511 1 24 . 1 1 2 2 SER HA H 2 4.560 4.560 4.665 -0.105 19668 8512 1 24 . 1 1 2 2 SER CA C 2 58.366 58.366 59.020 -0.654 19668 8513 1 24 . 1 1 3 3 ARG N N 3 125.213 125.213 123.440 1.773 19668 8514 1 24 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.186 0.080 19668 8515 1 24 . 1 1 3 3 ARG C C 3 178.381 178.381 178.285 0.096 19668 8516 1 24 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.452 -0.056 19668 8517 1 24 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.339 1.316 19668 8518 1 24 . 1 1 3 3 ARG H H 3 8.874 8.874 8.413 0.461 19668 8519 1 24 . 1 1 4 4 VAL N N 4 119.320 119.320 119.743 -0.423 19668 8520 1 24 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.774 0.024 19668 8521 1 24 . 1 1 4 4 VAL C C 4 177.004 177.004 177.589 -0.585 19668 8522 1 24 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.811 -0.296 19668 8523 1 24 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.129 0.674 19668 8524 1 24 . 1 1 4 4 VAL H H 4 8.112 8.112 8.114 -0.002 19668 8525 1 24 . 1 1 5 5 LYS N N 5 122.279 122.279 120.252 2.027 19668 8526 1 24 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.921 0.241 19668 8527 1 24 . 1 1 5 5 LYS C C 5 178.547 178.547 178.080 0.467 19668 8528 1 24 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.877 -0.119 19668 8529 1 24 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.205 0.805 19668 8530 1 24 . 1 1 5 5 LYS H H 5 7.847 7.847 8.054 -0.207 19668 8531 1 24 . 1 1 6 6 ALA N N 6 120.295 120.295 121.559 -1.264 19668 8532 1 24 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.039 0.172 19668 8533 1 24 . 1 1 6 6 ALA C C 6 180.834 180.834 179.260 1.574 19668 8534 1 24 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.038 -0.135 19668 8535 1 24 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.246 -0.114 19668 8536 1 24 . 1 1 6 6 ALA H H 6 7.975 7.975 7.807 0.168 19668 8537 1 24 . 1 1 7 7 LEU N N 7 119.570 119.570 118.326 1.244 19668 8538 1 24 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.060 0.112 19668 8539 1 24 . 1 1 7 7 LEU C C 7 178.431 178.431 178.536 -0.105 19668 8540 1 24 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.897 -0.218 19668 8541 1 24 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.071 0.964 19668 8542 1 24 . 1 1 7 7 LEU H H 7 7.650 7.650 7.647 0.003 19668 8543 1 24 . 1 1 8 8 GLU N N 8 119.934 119.934 118.400 1.534 19668 8544 1 24 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.059 -0.200 19668 8545 1 24 . 1 1 8 8 GLU C C 8 179.534 179.534 178.587 0.947 19668 8546 1 24 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.373 0.664 19668 8547 1 24 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.717 0.750 19668 8548 1 24 . 1 1 8 8 GLU H H 8 8.411 8.411 7.832 0.579 19668 8549 1 24 . 1 1 9 9 GLU N N 9 118.234 118.234 118.976 -0.742 19668 8550 1 24 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.095 -0.035 19668 8551 1 24 . 1 1 9 9 GLU C C 9 179.596 179.596 178.950 0.646 19668 8552 1 24 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.159 0.171 19668 8553 1 24 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.260 0.158 19668 8554 1 24 . 1 1 9 9 GLU H H 9 8.206 8.206 7.735 0.471 19668 8555 1 24 . 1 1 10 10 LYS N N 10 121.042 121.042 119.038 2.004 19668 8556 1 24 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.163 0.020 19668 8557 1 24 . 1 1 10 10 LYS C C 10 179.380 179.380 179.140 0.240 19668 8558 1 24 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.134 0.191 19668 8559 1 24 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.129 0.280 19668 8560 1 24 . 1 1 10 10 LYS H H 10 7.931 7.931 7.554 0.377 19668 8561 1 24 . 1 1 11 11 VAL N N 11 118.662 118.662 120.101 -1.439 19668 8562 1 24 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.847 -0.033 19668 8563 1 24 . 1 1 11 11 VAL C C 11 178.845 178.845 178.078 0.767 19668 8564 1 24 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.316 0.672 19668 8565 1 24 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.659 -0.005 19668 8566 1 24 . 1 1 11 11 VAL H H 11 8.371 8.371 7.598 0.773 19668 8567 1 24 . 1 1 12 12 LYS N N 12 123.188 123.188 119.669 3.519 19668 8568 1 24 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.951 0.275 19668 8569 1 24 . 1 1 12 12 LYS C C 12 179.098 179.098 178.388 0.710 19668 8570 1 24 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.360 0.123 19668 8571 1 24 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.336 -0.129 19668 8572 1 24 . 1 1 12 12 LYS H H 12 8.276 8.276 7.542 0.734 19668 8573 1 24 . 1 1 13 13 ALA N N 13 121.169 121.169 121.602 -0.433 19668 8574 1 24 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.057 0.201 19668 8575 1 24 . 1 1 13 13 ALA C C 13 180.169 180.169 179.667 0.502 19668 8576 1 24 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.819 -0.183 19668 8577 1 24 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.188 -0.081 19668 8578 1 24 . 1 1 13 13 ALA H H 13 7.829 7.829 7.474 0.355 19668 8579 1 24 . 1 1 14 14 LEU N N 14 118.104 118.104 118.287 -0.183 19668 8580 1 24 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.990 0.166 19668 8581 1 24 . 1 1 14 14 LEU C C 14 177.614 177.614 177.810 -0.196 19668 8582 1 24 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.178 -0.573 19668 8583 1 24 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.878 0.917 19668 8584 1 24 . 1 1 14 14 LEU H H 14 7.781 7.781 7.376 0.405 19668 8585 1 24 . 1 1 15 15 GLU N N 15 120.632 120.632 118.827 1.805 19668 8586 1 24 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.388 -0.021 19668 8587 1 24 . 1 1 15 15 GLU C C 15 178.243 178.243 178.634 -0.391 19668 8588 1 24 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.516 1.070 19668 8589 1 24 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.984 0.845 19668 8590 1 24 . 1 1 15 15 GLU H H 15 7.873 7.873 7.244 0.629 19668 8591 1 24 . 1 1 16 16 GLU N N 16 115.775 115.775 117.068 -1.293 19668 8592 1 24 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.007 -0.048 19668 8593 1 24 . 1 1 16 16 GLU C C 16 179.006 179.006 178.707 0.299 19668 8594 1 24 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.105 -0.013 19668 8595 1 24 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.382 -0.029 19668 8596 1 24 . 1 1 16 16 GLU H H 16 7.926 7.926 7.697 0.229 19668 8597 1 24 . 1 1 17 17 LYS N N 17 118.801 118.801 118.806 -0.005 19668 8598 1 24 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.081 0.013 19668 8599 1 24 . 1 1 17 17 LYS C C 17 178.853 178.853 178.345 0.508 19668 8600 1 24 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.654 -0.183 19668 8601 1 24 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.801 0.561 19668 8602 1 24 . 1 1 17 17 LYS H H 17 7.518 7.518 7.346 0.172 19668 8603 1 24 . 1 1 18 18 VAL N N 18 118.034 118.034 119.149 -1.115 19668 8604 1 24 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.721 -0.209 19668 8605 1 24 . 1 1 18 18 VAL C C 18 178.362 178.362 178.397 -0.035 19668 8606 1 24 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.734 0.285 19668 8607 1 24 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.772 -0.123 19668 8608 1 24 . 1 1 18 18 VAL H H 18 8.048 8.048 7.400 0.648 19668 8609 1 24 . 1 1 19 19 LYS N N 19 118.427 118.427 119.147 -0.720 19668 8610 1 24 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.135 -0.125 19668 8611 1 24 . 1 1 19 19 LYS C C 19 177.706 177.706 177.868 -0.162 19668 8612 1 24 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.785 0.200 19668 8613 1 24 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.688 0.736 19668 8614 1 24 . 1 1 19 19 LYS H H 19 8.008 8.008 7.568 0.440 19668 8615 1 24 . 1 1 20 20 ALA N N 20 119.177 119.177 119.928 -0.751 19668 8616 1 24 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.291 0.025 19668 8617 1 24 . 1 1 20 20 ALA C C 20 178.269 178.269 178.304 -0.035 19668 8618 1 24 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.889 -0.258 19668 8619 1 24 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.730 0.403 19668 8620 1 24 . 1 1 20 20 ALA H H 20 7.259 7.259 7.434 -0.175 19668 8621 1 24 . 1 1 21 21 LEU N N 21 118.596 118.596 117.625 0.971 19668 8622 1 24 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.071 0.190 19668 8623 1 24 . 1 1 21 21 LEU C C 21 177.732 177.732 177.306 0.426 19668 8624 1 24 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.259 -0.602 19668 8625 1 24 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.409 0.724 19668 8626 1 24 . 1 1 21 21 LEU H H 21 7.373 7.373 7.550 -0.177 19668 8627 1 24 . 1 1 22 22 GLY N N 22 107.926 107.926 105.912 2.014 19668 8628 1 24 . 1 1 22 22 GLY C C 22 173.362 173.362 173.676 -0.314 19668 8629 1 24 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.768 0.429 19668 8630 1 24 . 1 1 22 22 GLY H H 22 8.144 8.144 7.464 0.680 19668 8631 1 24 . 1 1 23 23 GLY N N 23 108.242 108.242 108.050 0.192 19668 8632 1 24 . 1 1 23 23 GLY C C 23 174.110 174.110 173.816 0.294 19668 8633 1 24 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.657 0.027 19668 8634 1 24 . 1 1 23 23 GLY H H 23 8.157 8.157 7.844 0.313 19668 8635 1 24 . 1 1 24 24 GLY N N 24 106.969 106.969 107.133 -0.164 19668 8636 1 24 . 1 1 24 24 GLY C C 24 175.172 175.172 175.068 0.104 19668 8637 1 24 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.339 0.100 19668 8638 1 24 . 1 1 24 24 GLY H H 24 8.466 8.466 8.263 0.203 19668 8639 1 24 . 1 1 25 25 GLY N N 25 108.946 108.946 109.753 -0.807 19668 8640 1 24 . 1 1 25 25 GLY C C 25 176.321 176.321 175.392 0.929 19668 8641 1 24 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.320 1.779 19668 8642 1 24 . 1 1 25 25 GLY H H 25 8.618 8.618 7.902 0.716 19668 8643 1 24 . 1 1 26 26 ARG N N 26 123.559 123.559 122.853 0.706 19668 8644 1 24 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.342 -0.063 19668 8645 1 24 . 1 1 26 26 ARG C C 26 178.076 178.076 178.327 -0.251 19668 8646 1 24 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.356 -0.441 19668 8647 1 24 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.671 0.239 19668 8648 1 24 . 1 1 26 26 ARG H H 26 8.789 8.789 8.497 0.292 19668 8649 1 24 . 1 1 27 27 ILE N N 27 118.726 118.726 119.172 -0.446 19668 8650 1 24 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.861 -0.075 19668 8651 1 24 . 1 1 27 27 ILE C C 27 177.639 177.639 178.097 -0.458 19668 8652 1 24 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.552 -0.928 19668 8653 1 24 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.056 -0.101 19668 8654 1 24 . 1 1 27 27 ILE H H 27 7.762 7.762 8.063 -0.301 19668 8655 1 24 . 1 1 28 28 GLU N N 28 119.843 119.843 118.924 0.919 19668 8656 1 24 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.042 -0.029 19668 8657 1 24 . 1 1 28 28 GLU C C 28 179.447 179.447 179.203 0.244 19668 8658 1 24 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.929 -0.346 19668 8659 1 24 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.927 0.133 19668 8660 1 24 . 1 1 28 28 GLU H H 28 7.867 7.867 8.554 -0.687 19668 8661 1 24 . 1 1 29 29 GLU N N 29 118.447 118.447 119.101 -0.654 19668 8662 1 24 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.068 0.019 19668 8663 1 24 . 1 1 29 29 GLU C C 29 179.310 179.310 178.996 0.314 19668 8664 1 24 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.720 0.560 19668 8665 1 24 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.162 0.174 19668 8666 1 24 . 1 1 29 29 GLU H H 29 7.755 7.755 7.902 -0.147 19668 8667 1 24 . 1 1 30 30 LEU N N 30 121.135 121.135 121.325 -0.190 19668 8668 1 24 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.996 0.100 19668 8669 1 24 . 1 1 30 30 LEU C C 30 178.928 178.928 178.725 0.203 19668 8670 1 24 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.252 -0.147 19668 8671 1 24 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.141 -0.461 19668 8672 1 24 . 1 1 30 30 LEU H H 30 7.785 7.785 7.586 0.199 19668 8673 1 24 . 1 1 31 31 LYS N N 31 119.130 119.130 117.763 1.367 19668 8674 1 24 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.095 -0.225 19668 8675 1 24 . 1 1 31 31 LYS C C 31 179.104 179.104 179.046 0.058 19668 8676 1 24 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.441 1.275 19668 8677 1 24 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.869 0.387 19668 8678 1 24 . 1 1 31 31 LYS H H 31 8.413 8.413 7.624 0.789 19668 8679 1 24 . 1 1 32 32 LYS N N 32 119.200 119.200 119.169 0.031 19668 8680 1 24 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.999 0.103 19668 8681 1 24 . 1 1 32 32 LYS C C 32 179.420 179.420 178.955 0.465 19668 8682 1 24 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.473 -0.016 19668 8683 1 24 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.136 0.130 19668 8684 1 24 . 1 1 32 32 LYS H H 32 7.826 7.826 7.514 0.312 19668 8685 1 24 . 1 1 33 33 LYS N N 33 120.322 120.322 119.195 1.127 19668 8686 1 24 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.036 0.127 19668 8687 1 24 . 1 1 33 33 LYS C C 33 179.174 179.174 178.655 0.519 19668 8688 1 24 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.007 -0.259 19668 8689 1 24 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.211 -0.472 19668 8690 1 24 . 1 1 33 33 LYS H H 33 8.003 8.003 7.510 0.493 19668 8691 1 24 . 1 1 34 34 TYR N N 34 120.223 120.223 119.511 0.712 19668 8692 1 24 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.101 -0.045 19668 8693 1 24 . 1 1 34 34 TYR C C 34 176.356 176.356 177.990 -1.634 19668 8694 1 24 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.607 -0.552 19668 8695 1 24 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.343 -0.316 19668 8696 1 24 . 1 1 34 34 TYR H H 34 8.614 8.614 7.555 1.059 19668 8697 1 24 . 1 1 35 35 GLU N N 35 118.813 118.813 116.896 1.917 19668 8698 1 24 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.932 -0.207 19668 8699 1 24 . 1 1 35 35 GLU C C 35 179.787 179.787 178.823 0.964 19668 8700 1 24 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.963 -0.524 19668 8701 1 24 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.032 0.096 19668 8702 1 24 . 1 1 35 35 GLU H H 35 8.103 8.103 7.832 0.271 19668 8703 1 24 . 1 1 36 36 GLU N N 36 119.670 119.670 119.498 0.172 19668 8704 1 24 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.105 -0.091 19668 8705 1 24 . 1 1 36 36 GLU C C 36 179.295 179.295 178.965 0.330 19668 8706 1 24 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.051 0.212 19668 8707 1 24 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.173 0.396 19668 8708 1 24 . 1 1 36 36 GLU H H 36 8.028 8.028 7.771 0.257 19668 8709 1 24 . 1 1 37 37 LEU N N 37 121.416 121.416 119.218 2.198 19668 8710 1 24 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.989 0.030 19668 8711 1 24 . 1 1 37 37 LEU C C 37 178.277 178.277 179.043 -0.766 19668 8712 1 24 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.119 -0.279 19668 8713 1 24 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.362 0.267 19668 8714 1 24 . 1 1 37 37 LEU H H 37 8.176 8.176 7.428 0.748 19668 8715 1 24 . 1 1 38 38 LYS N N 38 118.998 118.998 118.537 0.461 19668 8716 1 24 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.950 -0.290 19668 8717 1 24 . 1 1 38 38 LYS C C 38 178.923 178.923 178.769 0.154 19668 8718 1 24 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.126 0.274 19668 8719 1 24 . 1 1 38 38 LYS CB C 38 32.062 32.062 31.985 0.077 19668 8720 1 24 . 1 1 38 38 LYS H H 38 8.260 8.260 7.640 0.620 19668 8721 1 24 . 1 1 39 39 LYS N N 39 118.070 118.070 118.356 -0.286 19668 8722 1 24 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.043 0.037 19668 8723 1 24 . 1 1 39 39 LYS C C 39 178.687 178.687 179.019 -0.332 19668 8724 1 24 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.756 -0.820 19668 8725 1 24 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.118 0.031 19668 8726 1 24 . 1 1 39 39 LYS H H 39 7.380 7.380 7.777 -0.397 19668 8727 1 24 . 1 1 40 40 LYS N N 40 118.894 118.894 120.418 -1.524 19668 8728 1 24 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.048 0.011 19668 8729 1 24 . 1 1 40 40 LYS C C 40 179.758 179.758 178.913 0.845 19668 8730 1 24 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.544 -0.482 19668 8731 1 24 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.368 0.020 19668 8732 1 24 . 1 1 40 40 LYS H H 40 7.919 7.919 7.336 0.583 19668 8733 1 24 . 1 1 41 41 ILE N N 41 118.270 118.270 118.645 -0.375 19668 8734 1 24 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.733 -0.036 19668 8735 1 24 . 1 1 41 41 ILE C C 41 178.211 178.211 177.042 1.169 19668 8736 1 24 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.866 -0.152 19668 8737 1 24 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.772 0.067 19668 8738 1 24 . 1 1 41 41 ILE H H 41 8.199 8.199 7.477 0.722 19668 8739 1 24 . 1 1 42 42 GLU N N 42 120.117 120.117 117.387 2.730 19668 8740 1 24 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.049 0.042 19668 8741 1 24 . 1 1 42 42 GLU C C 42 178.736 178.736 177.514 1.222 19668 8742 1 24 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.634 0.246 19668 8743 1 24 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.927 -0.536 19668 8744 1 24 . 1 1 42 42 GLU H H 42 7.738 7.738 7.493 0.245 19668 8745 1 24 . 1 1 43 43 GLU N N 43 117.194 117.194 116.741 0.453 19668 8746 1 24 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.197 0.102 19668 8747 1 24 . 1 1 43 43 GLU C C 43 177.658 177.658 177.128 0.530 19668 8748 1 24 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.799 -0.006 19668 8749 1 24 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.349 -0.416 19668 8750 1 24 . 1 1 43 43 GLU H H 43 7.698 7.698 7.489 0.209 19668 8751 1 24 . 1 1 44 44 LEU N N 44 120.812 120.812 120.780 0.032 19668 8752 1 24 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.055 0.184 19668 8753 1 24 . 1 1 44 44 LEU C C 44 178.682 178.682 177.227 1.455 19668 8754 1 24 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.222 1.274 19668 8755 1 24 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.481 0.166 19668 8756 1 24 . 1 1 44 44 LEU H H 44 7.593 7.593 7.516 0.077 19668 8757 1 24 . 1 1 45 45 GLY N N 45 108.681 108.681 110.722 -2.041 19668 8758 1 24 . 1 1 45 45 GLY C C 45 174.957 174.957 173.579 1.378 19668 8759 1 24 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.082 1.004 19668 8760 1 24 . 1 1 45 45 GLY H H 45 8.234 8.234 8.439 -0.205 19668 8761 1 24 . 1 1 46 46 GLY N N 46 108.057 108.057 107.003 1.054 19668 8762 1 24 . 1 1 46 46 GLY C C 46 174.777 174.777 173.603 1.174 19668 8763 1 24 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.216 0.148 19668 8764 1 24 . 1 1 46 46 GLY H H 46 8.182 8.182 7.763 0.419 19668 8765 1 24 . 1 1 47 47 GLY N N 47 108.494 108.494 109.556 -1.062 19668 8766 1 24 . 1 1 47 47 GLY C C 47 174.572 174.572 174.377 0.195 19668 8767 1 24 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.551 -0.396 19668 8768 1 24 . 1 1 47 47 GLY H H 47 8.087 8.087 8.007 0.080 19668 8769 1 24 . 1 1 48 48 GLY N N 48 108.285 108.285 107.392 0.893 19668 8770 1 24 . 1 1 48 48 GLY C C 48 174.495 174.495 173.929 0.566 19668 8771 1 24 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.020 0.434 19668 8772 1 24 . 1 1 48 48 GLY H H 48 8.323 8.323 8.314 0.009 19668 8773 1 24 . 1 1 49 49 GLU N N 49 121.070 121.070 119.477 1.593 19668 8774 1 24 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.507 -0.090 19668 8775 1 24 . 1 1 49 49 GLU C C 49 177.226 177.226 177.938 -0.712 19668 8776 1 24 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.801 -0.230 19668 8777 1 24 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.176 -0.510 19668 8778 1 24 . 1 1 49 49 GLU H H 49 8.483 8.483 8.178 0.305 19668 8779 1 24 . 1 1 50 50 VAL N N 50 121.794 121.794 117.116 4.678 19668 8780 1 24 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.585 0.196 19668 8781 1 24 . 1 1 50 50 VAL C C 50 176.860 176.860 177.296 -0.436 19668 8782 1 24 . 1 1 50 50 VAL CA C 50 65.080 65.080 66.302 -1.222 19668 8783 1 24 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.566 0.687 19668 8784 1 24 . 1 1 50 50 VAL H H 50 8.068 8.068 7.791 0.277 19668 8785 1 24 . 1 1 51 51 LYS N N 51 120.593 120.593 117.791 2.802 19668 8786 1 24 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.450 -0.243 19668 8787 1 24 . 1 1 51 51 LYS C C 51 178.667 178.667 178.585 0.082 19668 8788 1 24 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.107 0.228 19668 8789 1 24 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.737 0.521 19668 8790 1 24 . 1 1 51 51 LYS H H 51 8.253 8.253 8.265 -0.012 19668 8791 1 24 . 1 1 52 52 LYS N N 52 117.572 117.572 119.605 -2.033 19668 8792 1 24 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.117 0.051 19668 8793 1 24 . 1 1 52 52 LYS C C 52 179.248 179.248 178.637 0.611 19668 8794 1 24 . 1 1 52 52 LYS CA C 52 59.014 59.014 58.779 0.235 19668 8795 1 24 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.068 0.112 19668 8796 1 24 . 1 1 52 52 LYS H H 52 7.629 7.629 7.706 -0.077 19668 8797 1 24 . 1 1 53 53 VAL N N 53 119.059 119.059 119.051 0.008 19668 8798 1 24 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.989 -0.197 19668 8799 1 24 . 1 1 53 53 VAL C C 53 177.987 177.987 178.428 -0.441 19668 8800 1 24 . 1 1 53 53 VAL CA C 53 66.031 66.031 65.189 0.841 19668 8801 1 24 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.236 0.135 19668 8802 1 24 . 1 1 53 53 VAL H H 53 7.638 7.638 7.457 0.181 19668 8803 1 24 . 1 1 54 54 GLU N N 54 120.388 120.388 119.202 1.186 19668 8804 1 24 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.943 -0.099 19668 8805 1 24 . 1 1 54 54 GLU C C 54 179.624 179.624 178.677 0.947 19668 8806 1 24 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.749 0.492 19668 8807 1 24 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.135 0.683 19668 8808 1 24 . 1 1 54 54 GLU H H 54 8.603 8.603 7.657 0.946 19668 8809 1 24 . 1 1 55 55 GLU N N 55 118.533 118.533 119.626 -1.093 19668 8810 1 24 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.034 0.055 19668 8811 1 24 . 1 1 55 55 GLU C C 55 179.158 179.158 178.728 0.430 19668 8812 1 24 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.217 0.117 19668 8813 1 24 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.774 -0.438 19668 8814 1 24 . 1 1 55 55 GLU H H 55 7.904 7.904 7.649 0.255 19668 8815 1 24 . 1 1 56 56 GLU N N 56 120.258 120.258 118.591 1.667 19668 8816 1 24 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.029 0.071 19668 8817 1 24 . 1 1 56 56 GLU C C 56 179.867 179.867 178.932 0.935 19668 8818 1 24 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.778 0.885 19668 8819 1 24 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.202 0.848 19668 8820 1 24 . 1 1 56 56 GLU H H 56 7.902 7.902 7.639 0.263 19668 8821 1 24 . 1 1 57 57 VAL N N 57 121.168 121.168 120.978 0.190 19668 8822 1 24 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.481 0.087 19668 8823 1 24 . 1 1 57 57 VAL C C 57 176.994 176.994 177.220 -0.226 19668 8824 1 24 . 1 1 57 57 VAL CA C 57 66.896 66.896 66.002 0.894 19668 8825 1 24 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.780 -0.253 19668 8826 1 24 . 1 1 57 57 VAL H H 57 8.613 8.613 7.468 1.145 19668 8827 1 24 . 1 1 58 58 LYS N N 58 120.234 120.234 118.169 2.065 19668 8828 1 24 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.994 0.208 19668 8829 1 24 . 1 1 58 58 LYS C C 58 179.131 179.131 178.829 0.302 19668 8830 1 24 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.348 0.239 19668 8831 1 24 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.043 0.248 19668 8832 1 24 . 1 1 58 58 LYS H H 58 7.810 7.810 7.624 0.186 19668 8833 1 24 . 1 1 59 59 LYS N N 59 118.301 118.301 118.787 -0.486 19668 8834 1 24 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.052 0.041 19668 8835 1 24 . 1 1 59 59 LYS C C 59 179.281 179.281 178.473 0.808 19668 8836 1 24 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.140 0.288 19668 8837 1 24 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.090 0.289 19668 8838 1 24 . 1 1 59 59 LYS H H 59 7.876 7.876 7.399 0.477 19668 8839 1 24 . 1 1 60 60 LEU N N 60 121.224 121.224 120.234 0.990 19668 8840 1 24 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.008 0.226 19668 8841 1 24 . 1 1 60 60 LEU C C 60 178.636 178.636 178.767 -0.131 19668 8842 1 24 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.844 0.313 19668 8843 1 24 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.322 0.312 19668 8844 1 24 . 1 1 60 60 LEU H H 60 7.893 7.893 7.533 0.360 19668 8845 1 24 . 1 1 61 61 GLU N N 61 118.660 118.660 118.080 0.580 19668 8846 1 24 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.075 -0.276 19668 8847 1 24 . 1 1 61 61 GLU C C 61 179.094 179.094 178.717 0.377 19668 8848 1 24 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.209 1.063 19668 8849 1 24 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.724 1.279 19668 8850 1 24 . 1 1 61 61 GLU H H 61 8.644 8.644 7.822 0.822 19668 8851 1 24 . 1 1 62 62 GLU N N 62 117.555 117.555 119.769 -2.214 19668 8852 1 24 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.000 -0.004 19668 8853 1 24 . 1 1 62 62 GLU C C 62 178.940 178.940 179.092 -0.152 19668 8854 1 24 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.451 -0.283 19668 8855 1 24 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.265 0.282 19668 8856 1 24 . 1 1 62 62 GLU H H 62 7.995 7.995 7.547 0.448 19668 8857 1 24 . 1 1 63 63 GLU N N 63 119.097 119.097 118.251 0.846 19668 8858 1 24 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.152 -0.123 19668 8859 1 24 . 1 1 63 63 GLU C C 63 179.890 179.890 179.013 0.877 19668 8860 1 24 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.745 0.596 19668 8861 1 24 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.097 0.570 19668 8862 1 24 . 1 1 63 63 GLU H H 63 7.983 7.983 7.742 0.241 19668 8863 1 24 . 1 1 64 64 ILE N N 64 118.247 118.247 119.764 -1.517 19668 8864 1 24 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.778 -0.058 19668 8865 1 24 . 1 1 64 64 ILE C C 64 177.858 177.858 178.509 -0.651 19668 8866 1 24 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.537 -0.041 19668 8867 1 24 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.530 0.451 19668 8868 1 24 . 1 1 64 64 ILE H H 64 8.261 8.261 7.252 1.009 19668 8869 1 24 . 1 1 65 65 LYS N N 65 118.693 118.693 119.091 -0.398 19668 8870 1 24 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.103 -0.005 19668 8871 1 24 . 1 1 65 65 LYS C C 65 177.244 177.244 178.127 -0.883 19668 8872 1 24 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.855 -0.202 19668 8873 1 24 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.440 0.266 19668 8874 1 24 . 1 1 65 65 LYS H H 65 7.661 7.661 7.586 0.075 19668 8875 1 24 . 1 1 66 66 LYS N N 66 116.933 116.933 116.226 0.707 19668 8876 1 24 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.073 0.265 19668 8877 1 24 . 1 1 66 66 LYS C C 66 176.011 176.011 177.131 -1.120 19668 8878 1 24 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.958 -1.499 19668 8879 1 24 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.889 0.242 19668 8880 1 24 . 1 1 66 66 LYS H H 66 7.261 7.261 7.674 -0.413 19668 8881 1 25 . 1 1 2 2 SER HA H 2 4.560 4.560 4.450 0.110 19668 8882 1 25 . 1 1 2 2 SER CA C 2 58.366 58.366 59.009 -0.643 19668 8883 1 25 . 1 1 3 3 ARG N N 3 125.213 125.213 119.768 5.445 19668 8884 1 25 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.442 -0.176 19668 8885 1 25 . 1 1 3 3 ARG C C 3 178.381 178.381 177.256 1.125 19668 8886 1 25 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.063 1.333 19668 8887 1 25 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.730 0.925 19668 8888 1 25 . 1 1 3 3 ARG H H 3 8.874 8.874 7.967 0.907 19668 8889 1 25 . 1 1 4 4 VAL N N 4 119.320 119.320 120.097 -0.777 19668 8890 1 25 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.807 -0.009 19668 8891 1 25 . 1 1 4 4 VAL C C 4 177.004 177.004 177.613 -0.609 19668 8892 1 25 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.258 0.257 19668 8893 1 25 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.500 0.303 19668 8894 1 25 . 1 1 4 4 VAL H H 4 8.112 8.112 8.143 -0.031 19668 8895 1 25 . 1 1 5 5 LYS N N 5 122.279 122.279 120.686 1.593 19668 8896 1 25 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.971 0.191 19668 8897 1 25 . 1 1 5 5 LYS C C 5 178.547 178.547 178.219 0.328 19668 8898 1 25 . 1 1 5 5 LYS CA C 5 58.758 58.758 59.014 -0.256 19668 8899 1 25 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.709 0.301 19668 8900 1 25 . 1 1 5 5 LYS H H 5 7.847 7.847 7.541 0.306 19668 8901 1 25 . 1 1 6 6 ALA N N 6 120.295 120.295 121.568 -1.273 19668 8902 1 25 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.106 0.105 19668 8903 1 25 . 1 1 6 6 ALA C C 6 180.834 180.834 179.787 1.047 19668 8904 1 25 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.986 -0.083 19668 8905 1 25 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.758 0.374 19668 8906 1 25 . 1 1 6 6 ALA H H 6 7.975 7.975 8.351 -0.376 19668 8907 1 25 . 1 1 7 7 LEU N N 7 119.570 119.570 118.392 1.178 19668 8908 1 25 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.075 0.097 19668 8909 1 25 . 1 1 7 7 LEU C C 7 178.431 178.431 178.506 -0.075 19668 8910 1 25 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.909 -0.230 19668 8911 1 25 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.056 0.979 19668 8912 1 25 . 1 1 7 7 LEU H H 7 7.650 7.650 7.568 0.082 19668 8913 1 25 . 1 1 8 8 GLU N N 8 119.934 119.934 118.446 1.488 19668 8914 1 25 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.074 -0.215 19668 8915 1 25 . 1 1 8 8 GLU C C 8 179.534 179.534 178.554 0.980 19668 8916 1 25 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.295 0.742 19668 8917 1 25 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.790 0.677 19668 8918 1 25 . 1 1 8 8 GLU H H 8 8.411 8.411 7.876 0.535 19668 8919 1 25 . 1 1 9 9 GLU N N 9 118.234 118.234 119.219 -0.985 19668 8920 1 25 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.063 -0.003 19668 8921 1 25 . 1 1 9 9 GLU C C 9 179.596 179.596 178.889 0.707 19668 8922 1 25 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.368 -0.038 19668 8923 1 25 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.438 -0.020 19668 8924 1 25 . 1 1 9 9 GLU H H 9 8.206 8.206 7.692 0.514 19668 8925 1 25 . 1 1 10 10 LYS N N 10 121.042 121.042 119.079 1.963 19668 8926 1 25 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.133 0.050 19668 8927 1 25 . 1 1 10 10 LYS C C 10 179.380 179.380 179.073 0.307 19668 8928 1 25 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.119 0.206 19668 8929 1 25 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.130 0.279 19668 8930 1 25 . 1 1 10 10 LYS H H 10 7.931 7.931 7.562 0.369 19668 8931 1 25 . 1 1 11 11 VAL N N 11 118.662 118.662 120.335 -1.673 19668 8932 1 25 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.827 -0.013 19668 8933 1 25 . 1 1 11 11 VAL C C 11 178.845 178.845 178.144 0.701 19668 8934 1 25 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.716 0.272 19668 8935 1 25 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.674 -0.020 19668 8936 1 25 . 1 1 11 11 VAL H H 11 8.371 8.371 7.543 0.828 19668 8937 1 25 . 1 1 12 12 LYS N N 12 123.188 123.188 119.805 3.383 19668 8938 1 25 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.958 0.268 19668 8939 1 25 . 1 1 12 12 LYS C C 12 179.098 179.098 178.230 0.868 19668 8940 1 25 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.317 0.166 19668 8941 1 25 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.380 -0.174 19668 8942 1 25 . 1 1 12 12 LYS H H 12 8.276 8.276 7.532 0.744 19668 8943 1 25 . 1 1 13 13 ALA N N 13 121.169 121.169 121.493 -0.324 19668 8944 1 25 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.069 0.189 19668 8945 1 25 . 1 1 13 13 ALA C C 13 180.169 180.169 179.680 0.489 19668 8946 1 25 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.776 -0.140 19668 8947 1 25 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.229 -0.122 19668 8948 1 25 . 1 1 13 13 ALA H H 13 7.829 7.829 7.462 0.367 19668 8949 1 25 . 1 1 14 14 LEU N N 14 118.104 118.104 118.402 -0.298 19668 8950 1 25 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.960 0.196 19668 8951 1 25 . 1 1 14 14 LEU C C 14 177.614 177.614 177.914 -0.300 19668 8952 1 25 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.116 -0.511 19668 8953 1 25 . 1 1 14 14 LEU CB C 14 42.795 42.795 42.004 0.791 19668 8954 1 25 . 1 1 14 14 LEU H H 14 7.781 7.781 7.432 0.349 19668 8955 1 25 . 1 1 15 15 GLU N N 15 120.632 120.632 118.217 2.415 19668 8956 1 25 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.395 -0.028 19668 8957 1 25 . 1 1 15 15 GLU C C 15 178.243 178.243 178.221 0.022 19668 8958 1 25 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.801 0.785 19668 8959 1 25 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.233 0.596 19668 8960 1 25 . 1 1 15 15 GLU H H 15 7.873 7.873 7.501 0.372 19668 8961 1 25 . 1 1 16 16 GLU N N 16 115.775 115.775 116.962 -1.187 19668 8962 1 25 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.993 -0.034 19668 8963 1 25 . 1 1 16 16 GLU C C 16 179.006 179.006 178.492 0.514 19668 8964 1 25 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.143 -0.051 19668 8965 1 25 . 1 1 16 16 GLU CB C 16 29.353 29.353 28.953 0.401 19668 8966 1 25 . 1 1 16 16 GLU H H 16 7.926 7.926 7.859 0.067 19668 8967 1 25 . 1 1 17 17 LYS N N 17 118.801 118.801 119.265 -0.464 19668 8968 1 25 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.069 0.025 19668 8969 1 25 . 1 1 17 17 LYS C C 17 178.853 178.853 178.689 0.164 19668 8970 1 25 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.655 -0.184 19668 8971 1 25 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.953 0.409 19668 8972 1 25 . 1 1 17 17 LYS H H 17 7.518 7.518 7.487 0.031 19668 8973 1 25 . 1 1 18 18 VAL N N 18 118.034 118.034 120.318 -2.284 19668 8974 1 25 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.613 -0.101 19668 8975 1 25 . 1 1 18 18 VAL C C 18 178.362 178.362 177.594 0.768 19668 8976 1 25 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.374 -0.355 19668 8977 1 25 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.475 0.174 19668 8978 1 25 . 1 1 18 18 VAL H H 18 8.048 8.048 7.430 0.618 19668 8979 1 25 . 1 1 19 19 LYS N N 19 118.427 118.427 117.855 0.572 19668 8980 1 25 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.089 -0.079 19668 8981 1 25 . 1 1 19 19 LYS C C 19 177.706 177.706 177.357 0.349 19668 8982 1 25 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.636 0.349 19668 8983 1 25 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.953 0.471 19668 8984 1 25 . 1 1 19 19 LYS H H 19 8.008 8.008 7.410 0.598 19668 8985 1 25 . 1 1 20 20 ALA N N 20 119.177 119.177 120.052 -0.875 19668 8986 1 25 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.319 -0.003 19668 8987 1 25 . 1 1 20 20 ALA C C 20 178.269 178.269 179.089 -0.820 19668 8988 1 25 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.574 -0.943 19668 8989 1 25 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.929 0.204 19668 8990 1 25 . 1 1 20 20 ALA H H 20 7.259 7.259 7.521 -0.262 19668 8991 1 25 . 1 1 21 21 LEU N N 21 118.596 118.596 115.878 2.718 19668 8992 1 25 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.218 0.043 19668 8993 1 25 . 1 1 21 21 LEU C C 21 177.732 177.732 177.416 0.316 19668 8994 1 25 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.257 -0.600 19668 8995 1 25 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.420 0.713 19668 8996 1 25 . 1 1 21 21 LEU H H 21 7.373 7.373 7.226 0.147 19668 8997 1 25 . 1 1 22 22 GLY N N 22 107.926 107.926 104.502 3.424 19668 8998 1 25 . 1 1 22 22 GLY C C 22 173.362 173.362 172.337 1.025 19668 8999 1 25 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.112 0.085 19668 9000 1 25 . 1 1 22 22 GLY H H 22 8.144 8.144 7.469 0.675 19668 9001 1 25 . 1 1 23 23 GLY N N 23 108.242 108.242 105.259 2.983 19668 9002 1 25 . 1 1 23 23 GLY C C 23 174.110 174.110 172.972 1.138 19668 9003 1 25 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.186 -0.502 19668 9004 1 25 . 1 1 23 23 GLY H H 23 8.157 8.157 7.988 0.169 19668 9005 1 25 . 1 1 24 24 GLY N N 24 106.969 106.969 108.961 -1.992 19668 9006 1 25 . 1 1 24 24 GLY C C 24 175.172 175.172 174.812 0.360 19668 9007 1 25 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.127 -0.688 19668 9008 1 25 . 1 1 24 24 GLY H H 24 8.466 8.466 8.343 0.123 19668 9009 1 25 . 1 1 25 25 GLY N N 25 108.946 108.946 110.506 -1.560 19668 9010 1 25 . 1 1 25 25 GLY C C 25 176.321 176.321 174.610 1.711 19668 9011 1 25 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.159 1.940 19668 9012 1 25 . 1 1 25 25 GLY H H 25 8.618 8.618 7.873 0.745 19668 9013 1 25 . 1 1 26 26 ARG N N 26 123.559 123.559 123.247 0.312 19668 9014 1 25 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.180 0.099 19668 9015 1 25 . 1 1 26 26 ARG C C 26 178.076 178.076 178.140 -0.064 19668 9016 1 25 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.968 -1.053 19668 9017 1 25 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.199 -0.289 19668 9018 1 25 . 1 1 26 26 ARG H H 26 8.789 8.789 8.487 0.302 19668 9019 1 25 . 1 1 27 27 ILE N N 27 118.726 118.726 118.665 0.061 19668 9020 1 25 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.928 -0.142 19668 9021 1 25 . 1 1 27 27 ILE C C 27 177.639 177.639 178.079 -0.440 19668 9022 1 25 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.461 0.163 19668 9023 1 25 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.374 0.581 19668 9024 1 25 . 1 1 27 27 ILE H H 27 7.762 7.762 8.103 -0.341 19668 9025 1 25 . 1 1 28 28 GLU N N 28 119.843 119.843 119.385 0.458 19668 9026 1 25 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.965 0.048 19668 9027 1 25 . 1 1 28 28 GLU C C 28 179.447 179.447 178.921 0.526 19668 9028 1 25 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.123 -0.540 19668 9029 1 25 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.418 -0.358 19668 9030 1 25 . 1 1 28 28 GLU H H 28 7.867 7.867 8.547 -0.680 19668 9031 1 25 . 1 1 29 29 GLU N N 29 118.447 118.447 119.151 -0.704 19668 9032 1 25 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.062 0.025 19668 9033 1 25 . 1 1 29 29 GLU C C 29 179.310 179.310 178.882 0.428 19668 9034 1 25 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.868 0.412 19668 9035 1 25 . 1 1 29 29 GLU CB C 29 29.336 29.336 28.953 0.383 19668 9036 1 25 . 1 1 29 29 GLU H H 29 7.755 7.755 8.223 -0.468 19668 9037 1 25 . 1 1 30 30 LEU N N 30 121.135 121.135 120.911 0.224 19668 9038 1 25 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.002 0.094 19668 9039 1 25 . 1 1 30 30 LEU C C 30 178.928 178.928 178.737 0.191 19668 9040 1 25 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.297 -0.192 19668 9041 1 25 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.088 -0.408 19668 9042 1 25 . 1 1 30 30 LEU H H 30 7.785 7.785 7.585 0.200 19668 9043 1 25 . 1 1 31 31 LYS N N 31 119.130 119.130 117.746 1.384 19668 9044 1 25 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.081 -0.211 19668 9045 1 25 . 1 1 31 31 LYS C C 31 179.104 179.104 179.025 0.079 19668 9046 1 25 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.370 1.346 19668 9047 1 25 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.828 0.428 19668 9048 1 25 . 1 1 31 31 LYS H H 31 8.413 8.413 7.621 0.792 19668 9049 1 25 . 1 1 32 32 LYS N N 32 119.200 119.200 119.715 -0.515 19668 9050 1 25 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.992 0.110 19668 9051 1 25 . 1 1 32 32 LYS C C 32 179.420 179.420 178.970 0.450 19668 9052 1 25 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.496 -0.039 19668 9053 1 25 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.186 0.080 19668 9054 1 25 . 1 1 32 32 LYS H H 32 7.826 7.826 7.554 0.272 19668 9055 1 25 . 1 1 33 33 LYS N N 33 120.322 120.322 119.304 1.018 19668 9056 1 25 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.039 0.124 19668 9057 1 25 . 1 1 33 33 LYS C C 33 179.174 179.174 178.899 0.275 19668 9058 1 25 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.444 -0.696 19668 9059 1 25 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.414 -0.675 19668 9060 1 25 . 1 1 33 33 LYS H H 33 8.003 8.003 7.574 0.429 19668 9061 1 25 . 1 1 34 34 TYR N N 34 120.223 120.223 117.797 2.426 19668 9062 1 25 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.153 -0.097 19668 9063 1 25 . 1 1 34 34 TYR C C 34 176.356 176.356 177.711 -1.355 19668 9064 1 25 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.505 -0.450 19668 9065 1 25 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.089 -0.062 19668 9066 1 25 . 1 1 34 34 TYR H H 34 8.614 8.614 7.497 1.117 19668 9067 1 25 . 1 1 35 35 GLU N N 35 118.813 118.813 116.662 2.151 19668 9068 1 25 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.952 -0.227 19668 9069 1 25 . 1 1 35 35 GLU C C 35 179.787 179.787 178.734 1.053 19668 9070 1 25 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.306 0.133 19668 9071 1 25 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.726 0.403 19668 9072 1 25 . 1 1 35 35 GLU H H 35 8.103 8.103 7.899 0.204 19668 9073 1 25 . 1 1 36 36 GLU N N 36 119.670 119.670 119.424 0.246 19668 9074 1 25 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.082 -0.068 19668 9075 1 25 . 1 1 36 36 GLU C C 36 179.295 179.295 178.977 0.318 19668 9076 1 25 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.168 0.095 19668 9077 1 25 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.596 -0.027 19668 9078 1 25 . 1 1 36 36 GLU H H 36 8.028 8.028 7.664 0.364 19668 9079 1 25 . 1 1 37 37 LEU N N 37 121.416 121.416 120.156 1.260 19668 9080 1 25 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.982 0.037 19668 9081 1 25 . 1 1 37 37 LEU C C 37 178.277 178.277 179.095 -0.818 19668 9082 1 25 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.999 -0.159 19668 9083 1 25 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.286 0.343 19668 9084 1 25 . 1 1 37 37 LEU H H 37 8.176 8.176 7.398 0.778 19668 9085 1 25 . 1 1 38 38 LYS N N 38 118.998 118.998 118.991 0.007 19668 9086 1 25 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.919 -0.259 19668 9087 1 25 . 1 1 38 38 LYS C C 38 178.923 178.923 179.137 -0.214 19668 9088 1 25 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.039 0.360 19668 9089 1 25 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.149 -0.087 19668 9090 1 25 . 1 1 38 38 LYS H H 38 8.260 8.260 7.611 0.649 19668 9091 1 25 . 1 1 39 39 LYS N N 39 118.070 118.070 118.286 -0.216 19668 9092 1 25 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.026 0.054 19668 9093 1 25 . 1 1 39 39 LYS C C 39 178.687 178.687 179.031 -0.344 19668 9094 1 25 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.646 -0.710 19668 9095 1 25 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.061 0.088 19668 9096 1 25 . 1 1 39 39 LYS H H 39 7.380 7.380 7.601 -0.221 19668 9097 1 25 . 1 1 40 40 LYS N N 40 118.894 118.894 119.605 -0.711 19668 9098 1 25 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.059 0.000 19668 9099 1 25 . 1 1 40 40 LYS C C 40 179.758 179.758 178.888 0.870 19668 9100 1 25 . 1 1 40 40 LYS CA C 40 59.062 59.062 58.986 0.076 19668 9101 1 25 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.018 0.370 19668 9102 1 25 . 1 1 40 40 LYS H H 40 7.919 7.919 7.284 0.635 19668 9103 1 25 . 1 1 41 41 ILE N N 41 118.270 118.270 119.407 -1.137 19668 9104 1 25 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.746 -0.049 19668 9105 1 25 . 1 1 41 41 ILE C C 41 178.211 178.211 177.032 1.179 19668 9106 1 25 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.857 -0.143 19668 9107 1 25 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.702 0.137 19668 9108 1 25 . 1 1 41 41 ILE H H 41 8.199 8.199 7.545 0.654 19668 9109 1 25 . 1 1 42 42 GLU N N 42 120.117 120.117 116.682 3.435 19668 9110 1 25 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.054 0.037 19668 9111 1 25 . 1 1 42 42 GLU C C 42 178.736 178.736 177.644 1.092 19668 9112 1 25 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.685 0.195 19668 9113 1 25 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.791 -0.400 19668 9114 1 25 . 1 1 42 42 GLU H H 42 7.738 7.738 7.504 0.234 19668 9115 1 25 . 1 1 43 43 GLU N N 43 117.194 117.194 116.869 0.325 19668 9116 1 25 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.200 0.099 19668 9117 1 25 . 1 1 43 43 GLU C C 43 177.658 177.658 177.766 -0.108 19668 9118 1 25 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.186 -0.393 19668 9119 1 25 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.542 -0.609 19668 9120 1 25 . 1 1 43 43 GLU H H 43 7.698 7.698 7.723 -0.025 19668 9121 1 25 . 1 1 44 44 LEU N N 44 120.812 120.812 119.030 1.782 19668 9122 1 25 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.159 0.080 19668 9123 1 25 . 1 1 44 44 LEU C C 44 178.682 178.682 176.649 2.033 19668 9124 1 25 . 1 1 44 44 LEU CA C 44 56.496 56.496 56.046 0.450 19668 9125 1 25 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.238 0.409 19668 9126 1 25 . 1 1 44 44 LEU H H 44 7.593 7.593 7.654 -0.061 19668 9127 1 25 . 1 1 45 45 GLY N N 45 108.681 108.681 110.154 -1.473 19668 9128 1 25 . 1 1 45 45 GLY C C 45 174.957 174.957 173.883 1.074 19668 9129 1 25 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.199 1.887 19668 9130 1 25 . 1 1 45 45 GLY H H 45 8.234 8.234 8.288 -0.054 19668 9131 1 25 . 1 1 46 46 GLY N N 46 108.057 108.057 107.052 1.005 19668 9132 1 25 . 1 1 46 46 GLY C C 46 174.777 174.777 173.657 1.120 19668 9133 1 25 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.070 0.294 19668 9134 1 25 . 1 1 46 46 GLY H H 46 8.182 8.182 8.273 -0.091 19668 9135 1 25 . 1 1 47 47 GLY N N 47 108.494 108.494 110.411 -1.917 19668 9136 1 25 . 1 1 47 47 GLY C C 47 174.572 174.572 173.498 1.074 19668 9137 1 25 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.444 -0.289 19668 9138 1 25 . 1 1 47 47 GLY H H 47 8.087 8.087 7.709 0.378 19668 9139 1 25 . 1 1 48 48 GLY N N 48 108.285 108.285 106.438 1.847 19668 9140 1 25 . 1 1 48 48 GLY C C 48 174.495 174.495 175.526 -1.031 19668 9141 1 25 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.181 0.273 19668 9142 1 25 . 1 1 48 48 GLY H H 48 8.323 8.323 8.438 -0.115 19668 9143 1 25 . 1 1 49 49 GLU N N 49 121.070 121.070 120.667 0.403 19668 9144 1 25 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.189 0.228 19668 9145 1 25 . 1 1 49 49 GLU C C 49 177.226 177.226 177.949 -0.723 19668 9146 1 25 . 1 1 49 49 GLU CA C 49 56.571 56.571 58.258 -1.688 19668 9147 1 25 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.575 0.091 19668 9148 1 25 . 1 1 49 49 GLU H H 49 8.483 8.483 8.138 0.345 19668 9149 1 25 . 1 1 50 50 VAL N N 50 121.794 121.794 116.913 4.881 19668 9150 1 25 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.721 0.060 19668 9151 1 25 . 1 1 50 50 VAL C C 50 176.860 176.860 177.690 -0.830 19668 9152 1 25 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.383 -0.303 19668 9153 1 25 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.097 1.156 19668 9154 1 25 . 1 1 50 50 VAL H H 50 8.068 8.068 7.571 0.497 19668 9155 1 25 . 1 1 51 51 LYS N N 51 120.593 120.593 119.431 1.162 19668 9156 1 25 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.061 0.146 19668 9157 1 25 . 1 1 51 51 LYS C C 51 178.667 178.667 178.723 -0.056 19668 9158 1 25 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.658 0.677 19668 9159 1 25 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.897 0.361 19668 9160 1 25 . 1 1 51 51 LYS H H 51 8.253 8.253 7.538 0.715 19668 9161 1 25 . 1 1 52 52 LYS N N 52 117.572 117.572 120.792 -3.220 19668 9162 1 25 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.051 0.117 19668 9163 1 25 . 1 1 52 52 LYS C C 52 179.248 179.248 178.771 0.477 19668 9164 1 25 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.441 -0.427 19668 9165 1 25 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.302 -0.122 19668 9166 1 25 . 1 1 52 52 LYS H H 52 7.629 7.629 7.638 -0.009 19668 9167 1 25 . 1 1 53 53 VAL N N 53 119.059 119.059 118.891 0.168 19668 9168 1 25 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.651 0.141 19668 9169 1 25 . 1 1 53 53 VAL C C 53 177.987 177.987 177.748 0.239 19668 9170 1 25 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.698 -0.668 19668 9171 1 25 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.366 0.005 19668 9172 1 25 . 1 1 53 53 VAL H H 53 7.638 7.638 7.487 0.151 19668 9173 1 25 . 1 1 54 54 GLU N N 54 120.388 120.388 119.478 0.910 19668 9174 1 25 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.917 -0.073 19668 9175 1 25 . 1 1 54 54 GLU C C 54 179.624 179.624 179.110 0.514 19668 9176 1 25 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.921 0.320 19668 9177 1 25 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.279 0.539 19668 9178 1 25 . 1 1 54 54 GLU H H 54 8.603 8.603 7.693 0.910 19668 9179 1 25 . 1 1 55 55 GLU N N 55 118.533 118.533 118.781 -0.248 19668 9180 1 25 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.056 0.033 19668 9181 1 25 . 1 1 55 55 GLU C C 55 179.158 179.158 179.010 0.148 19668 9182 1 25 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.030 0.304 19668 9183 1 25 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.425 -0.088 19668 9184 1 25 . 1 1 55 55 GLU H H 55 7.904 7.904 7.511 0.393 19668 9185 1 25 . 1 1 56 56 GLU N N 56 120.258 120.258 119.367 0.891 19668 9186 1 25 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.030 0.070 19668 9187 1 25 . 1 1 56 56 GLU C C 56 179.867 179.867 179.273 0.594 19668 9188 1 25 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.286 0.377 19668 9189 1 25 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.584 0.466 19668 9190 1 25 . 1 1 56 56 GLU H H 56 7.902 7.902 7.448 0.454 19668 9191 1 25 . 1 1 57 57 VAL N N 57 121.168 121.168 118.940 2.228 19668 9192 1 25 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.558 0.010 19668 9193 1 25 . 1 1 57 57 VAL C C 57 176.994 176.994 176.801 0.193 19668 9194 1 25 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.404 1.492 19668 9195 1 25 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.944 -0.417 19668 9196 1 25 . 1 1 57 57 VAL H H 57 8.613 8.613 7.502 1.111 19668 9197 1 25 . 1 1 58 58 LYS N N 58 120.234 120.234 119.719 0.515 19668 9198 1 25 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.949 0.253 19668 9199 1 25 . 1 1 58 58 LYS C C 58 179.131 179.131 178.568 0.563 19668 9200 1 25 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.575 0.012 19668 9201 1 25 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.570 0.721 19668 9202 1 25 . 1 1 58 58 LYS H H 58 7.810 7.810 7.567 0.243 19668 9203 1 25 . 1 1 59 59 LYS N N 59 118.301 118.301 118.936 -0.635 19668 9204 1 25 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.059 0.034 19668 9205 1 25 . 1 1 59 59 LYS C C 59 179.281 179.281 178.423 0.858 19668 9206 1 25 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.082 0.346 19668 9207 1 25 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.068 0.311 19668 9208 1 25 . 1 1 59 59 LYS H H 59 7.876 7.876 7.407 0.469 19668 9209 1 25 . 1 1 60 60 LEU N N 60 121.224 121.224 120.407 0.817 19668 9210 1 25 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.013 0.221 19668 9211 1 25 . 1 1 60 60 LEU C C 60 178.636 178.636 178.584 0.052 19668 9212 1 25 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.749 0.408 19668 9213 1 25 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.343 0.291 19668 9214 1 25 . 1 1 60 60 LEU H H 60 7.893 7.893 7.639 0.254 19668 9215 1 25 . 1 1 61 61 GLU N N 61 118.660 118.660 118.301 0.359 19668 9216 1 25 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.028 -0.229 19668 9217 1 25 . 1 1 61 61 GLU C C 61 179.094 179.094 178.626 0.468 19668 9218 1 25 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.019 1.253 19668 9219 1 25 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.925 1.078 19668 9220 1 25 . 1 1 61 61 GLU H H 61 8.644 8.644 7.778 0.866 19668 9221 1 25 . 1 1 62 62 GLU N N 62 117.555 117.555 119.402 -1.847 19668 9222 1 25 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.969 0.027 19668 9223 1 25 . 1 1 62 62 GLU C C 62 178.940 178.940 179.094 -0.154 19668 9224 1 25 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.389 -0.221 19668 9225 1 25 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.203 0.344 19668 9226 1 25 . 1 1 62 62 GLU H H 62 7.995 7.995 7.522 0.473 19668 9227 1 25 . 1 1 63 63 GLU N N 63 119.097 119.097 117.955 1.142 19668 9228 1 25 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.124 -0.095 19668 9229 1 25 . 1 1 63 63 GLU C C 63 179.890 179.890 179.051 0.839 19668 9230 1 25 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.573 0.768 19668 9231 1 25 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.924 0.743 19668 9232 1 25 . 1 1 63 63 GLU H H 63 7.983 7.983 7.734 0.249 19668 9233 1 25 . 1 1 64 64 ILE N N 64 118.247 118.247 117.951 0.296 19668 9234 1 25 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.836 -0.116 19668 9235 1 25 . 1 1 64 64 ILE C C 64 177.858 177.858 177.652 0.206 19668 9236 1 25 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.185 0.311 19668 9237 1 25 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.524 0.457 19668 9238 1 25 . 1 1 64 64 ILE H H 64 8.261 8.261 7.352 0.909 19668 9239 1 25 . 1 1 65 65 LYS N N 65 118.693 118.693 118.508 0.185 19668 9240 1 25 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.149 -0.051 19668 9241 1 25 . 1 1 65 65 LYS C C 65 177.244 177.244 177.818 -0.574 19668 9242 1 25 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.555 0.098 19668 9243 1 25 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.280 0.425 19668 9244 1 25 . 1 1 65 65 LYS H H 65 7.661 7.661 7.540 0.121 19668 9245 1 25 . 1 1 66 66 LYS N N 66 116.933 116.933 116.914 0.019 19668 9246 1 25 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.117 0.221 19668 9247 1 25 . 1 1 66 66 LYS C C 66 176.011 176.011 177.312 -1.301 19668 9248 1 25 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.818 -1.359 19668 9249 1 25 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.815 0.316 19668 9250 1 25 . 1 1 66 66 LYS H H 66 7.261 7.261 7.610 -0.349 19668 9251 1 26 . 1 1 2 2 SER HA H 2 4.560 4.560 4.646 -0.086 19668 9252 1 26 . 1 1 2 2 SER CA C 2 58.366 58.366 58.279 0.087 19668 9253 1 26 . 1 1 3 3 ARG N N 3 125.213 125.213 122.325 2.888 19668 9254 1 26 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.308 -0.042 19668 9255 1 26 . 1 1 3 3 ARG C C 3 178.381 178.381 177.374 1.007 19668 9256 1 26 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.693 0.703 19668 9257 1 26 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.381 1.274 19668 9258 1 26 . 1 1 3 3 ARG H H 3 8.874 8.874 8.278 0.596 19668 9259 1 26 . 1 1 4 4 VAL N N 4 119.320 119.320 120.194 -0.874 19668 9260 1 26 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.784 0.014 19668 9261 1 26 . 1 1 4 4 VAL C C 4 177.004 177.004 177.703 -0.699 19668 9262 1 26 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.843 -0.328 19668 9263 1 26 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.785 0.018 19668 9264 1 26 . 1 1 4 4 VAL H H 4 8.112 8.112 7.837 0.275 19668 9265 1 26 . 1 1 5 5 LYS N N 5 122.279 122.279 120.148 2.131 19668 9266 1 26 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.081 0.081 19668 9267 1 26 . 1 1 5 5 LYS C C 5 178.547 178.547 177.831 0.716 19668 9268 1 26 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.821 -0.063 19668 9269 1 26 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.731 0.279 19668 9270 1 26 . 1 1 5 5 LYS H H 5 7.847 7.847 8.310 -0.463 19668 9271 1 26 . 1 1 6 6 ALA N N 6 120.295 120.295 121.861 -1.566 19668 9272 1 26 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.105 0.106 19668 9273 1 26 . 1 1 6 6 ALA C C 6 180.834 180.834 179.761 1.073 19668 9274 1 26 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.855 0.048 19668 9275 1 26 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.999 0.133 19668 9276 1 26 . 1 1 6 6 ALA H H 6 7.975 7.975 7.543 0.432 19668 9277 1 26 . 1 1 7 7 LEU N N 7 119.570 119.570 118.437 1.133 19668 9278 1 26 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.065 0.107 19668 9279 1 26 . 1 1 7 7 LEU C C 7 178.431 178.431 178.536 -0.105 19668 9280 1 26 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.982 -0.303 19668 9281 1 26 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.124 0.911 19668 9282 1 26 . 1 1 7 7 LEU H H 7 7.650 7.650 7.659 -0.009 19668 9283 1 26 . 1 1 8 8 GLU N N 8 119.934 119.934 118.344 1.590 19668 9284 1 26 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.053 -0.194 19668 9285 1 26 . 1 1 8 8 GLU C C 8 179.534 179.534 178.568 0.966 19668 9286 1 26 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.391 0.646 19668 9287 1 26 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.705 0.762 19668 9288 1 26 . 1 1 8 8 GLU H H 8 8.411 8.411 7.792 0.619 19668 9289 1 26 . 1 1 9 9 GLU N N 9 118.234 118.234 118.932 -0.698 19668 9290 1 26 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.095 -0.035 19668 9291 1 26 . 1 1 9 9 GLU C C 9 179.596 179.596 178.946 0.650 19668 9292 1 26 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.281 0.049 19668 9293 1 26 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.286 0.132 19668 9294 1 26 . 1 1 9 9 GLU H H 9 8.206 8.206 7.777 0.429 19668 9295 1 26 . 1 1 10 10 LYS N N 10 121.042 121.042 118.947 2.095 19668 9296 1 26 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.162 0.021 19668 9297 1 26 . 1 1 10 10 LYS C C 10 179.380 179.380 179.184 0.196 19668 9298 1 26 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.163 0.162 19668 9299 1 26 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.157 0.252 19668 9300 1 26 . 1 1 10 10 LYS H H 10 7.931 7.931 7.554 0.377 19668 9301 1 26 . 1 1 11 11 VAL N N 11 118.662 118.662 119.762 -1.100 19668 9302 1 26 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.927 -0.113 19668 9303 1 26 . 1 1 11 11 VAL C C 11 178.845 178.845 178.152 0.693 19668 9304 1 26 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.535 1.453 19668 9305 1 26 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.173 0.481 19668 9306 1 26 . 1 1 11 11 VAL H H 11 8.371 8.371 7.589 0.782 19668 9307 1 26 . 1 1 12 12 LYS N N 12 123.188 123.188 120.227 2.961 19668 9308 1 26 . 1 1 12 12 LYS HA H 12 4.226 4.226 4.014 0.212 19668 9309 1 26 . 1 1 12 12 LYS C C 12 179.098 179.098 178.399 0.699 19668 9310 1 26 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.456 0.027 19668 9311 1 26 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.354 -0.148 19668 9312 1 26 . 1 1 12 12 LYS H H 12 8.276 8.276 7.596 0.680 19668 9313 1 26 . 1 1 13 13 ALA N N 13 121.169 121.169 121.558 -0.389 19668 9314 1 26 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.071 0.187 19668 9315 1 26 . 1 1 13 13 ALA C C 13 180.169 180.169 179.688 0.481 19668 9316 1 26 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.831 -0.195 19668 9317 1 26 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.197 -0.090 19668 9318 1 26 . 1 1 13 13 ALA H H 13 7.829 7.829 7.499 0.330 19668 9319 1 26 . 1 1 14 14 LEU N N 14 118.104 118.104 118.257 -0.153 19668 9320 1 26 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.009 0.147 19668 9321 1 26 . 1 1 14 14 LEU C C 14 177.614 177.614 177.823 -0.209 19668 9322 1 26 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.113 -0.508 19668 9323 1 26 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.921 0.874 19668 9324 1 26 . 1 1 14 14 LEU H H 14 7.781 7.781 7.420 0.361 19668 9325 1 26 . 1 1 15 15 GLU N N 15 120.632 120.632 118.995 1.637 19668 9326 1 26 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.352 0.015 19668 9327 1 26 . 1 1 15 15 GLU C C 15 178.243 178.243 178.649 -0.406 19668 9328 1 26 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.486 1.100 19668 9329 1 26 . 1 1 15 15 GLU CB C 15 29.829 29.829 28.936 0.893 19668 9330 1 26 . 1 1 15 15 GLU H H 15 7.873 7.873 7.290 0.583 19668 9331 1 26 . 1 1 16 16 GLU N N 16 115.775 115.775 117.183 -1.408 19668 9332 1 26 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.014 -0.055 19668 9333 1 26 . 1 1 16 16 GLU C C 16 179.006 179.006 178.677 0.329 19668 9334 1 26 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.112 -0.020 19668 9335 1 26 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.405 -0.052 19668 9336 1 26 . 1 1 16 16 GLU H H 16 7.926 7.926 7.682 0.244 19668 9337 1 26 . 1 1 17 17 LYS N N 17 118.801 118.801 119.266 -0.465 19668 9338 1 26 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.086 0.008 19668 9339 1 26 . 1 1 17 17 LYS C C 17 178.853 178.853 178.651 0.202 19668 9340 1 26 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.786 -0.315 19668 9341 1 26 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.808 0.554 19668 9342 1 26 . 1 1 17 17 LYS H H 17 7.518 7.518 7.290 0.228 19668 9343 1 26 . 1 1 18 18 VAL N N 18 118.034 118.034 120.066 -2.032 19668 9344 1 26 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.665 -0.153 19668 9345 1 26 . 1 1 18 18 VAL C C 18 178.362 178.362 178.307 0.055 19668 9346 1 26 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.095 -0.076 19668 9347 1 26 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.512 0.136 19668 9348 1 26 . 1 1 18 18 VAL H H 18 8.048 8.048 7.406 0.642 19668 9349 1 26 . 1 1 19 19 LYS N N 19 118.427 118.427 118.963 -0.536 19668 9350 1 26 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.066 -0.056 19668 9351 1 26 . 1 1 19 19 LYS C C 19 177.706 177.706 177.459 0.247 19668 9352 1 26 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.840 0.145 19668 9353 1 26 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.731 0.693 19668 9354 1 26 . 1 1 19 19 LYS H H 19 8.008 8.008 7.446 0.562 19668 9355 1 26 . 1 1 20 20 ALA N N 20 119.177 119.177 120.840 -1.663 19668 9356 1 26 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.241 0.075 19668 9357 1 26 . 1 1 20 20 ALA C C 20 178.269 178.269 177.915 0.354 19668 9358 1 26 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.823 -0.192 19668 9359 1 26 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.166 -0.033 19668 9360 1 26 . 1 1 20 20 ALA H H 20 7.259 7.259 7.373 -0.114 19668 9361 1 26 . 1 1 21 21 LEU N N 21 118.596 118.596 116.904 1.692 19668 9362 1 26 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.514 -0.253 19668 9363 1 26 . 1 1 21 21 LEU C C 21 177.732 177.732 177.773 -0.041 19668 9364 1 26 . 1 1 21 21 LEU CA C 21 55.657 55.657 54.730 0.927 19668 9365 1 26 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.980 0.153 19668 9366 1 26 . 1 1 21 21 LEU H H 21 7.373 7.373 7.249 0.124 19668 9367 1 26 . 1 1 22 22 GLY N N 22 107.926 107.926 110.338 -2.412 19668 9368 1 26 . 1 1 22 22 GLY C C 22 173.362 173.362 174.427 -1.065 19668 9369 1 26 . 1 1 22 22 GLY CA C 22 45.197 45.197 46.156 -0.959 19668 9370 1 26 . 1 1 22 22 GLY H H 22 8.144 8.144 8.691 -0.547 19668 9371 1 26 . 1 1 23 23 GLY N N 23 108.242 108.242 109.480 -1.238 19668 9372 1 26 . 1 1 23 23 GLY C C 23 174.110 174.110 173.670 0.440 19668 9373 1 26 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.614 0.070 19668 9374 1 26 . 1 1 23 23 GLY H H 23 8.157 8.157 8.000 0.157 19668 9375 1 26 . 1 1 24 24 GLY N N 24 106.969 106.969 108.871 -1.902 19668 9376 1 26 . 1 1 24 24 GLY C C 24 175.172 175.172 174.226 0.946 19668 9377 1 26 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.582 -0.143 19668 9378 1 26 . 1 1 24 24 GLY H H 24 8.466 8.466 8.139 0.327 19668 9379 1 26 . 1 1 25 25 GLY N N 25 108.946 108.946 112.034 -3.088 19668 9380 1 26 . 1 1 25 25 GLY C C 25 176.321 176.321 174.742 1.579 19668 9381 1 26 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.087 2.012 19668 9382 1 26 . 1 1 25 25 GLY H H 25 8.618 8.618 7.915 0.703 19668 9383 1 26 . 1 1 26 26 ARG N N 26 123.559 123.559 122.575 0.984 19668 9384 1 26 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.126 0.153 19668 9385 1 26 . 1 1 26 26 ARG C C 26 178.076 178.076 178.303 -0.227 19668 9386 1 26 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.073 -0.158 19668 9387 1 26 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.928 -0.018 19668 9388 1 26 . 1 1 26 26 ARG H H 26 8.789 8.789 8.477 0.312 19668 9389 1 26 . 1 1 27 27 ILE N N 27 118.726 118.726 119.386 -0.660 19668 9390 1 26 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.792 -0.006 19668 9391 1 26 . 1 1 27 27 ILE C C 27 177.639 177.639 178.075 -0.436 19668 9392 1 26 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.421 -0.797 19668 9393 1 26 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.229 -0.274 19668 9394 1 26 . 1 1 27 27 ILE H H 27 7.762 7.762 8.124 -0.362 19668 9395 1 26 . 1 1 28 28 GLU N N 28 119.843 119.843 119.177 0.666 19668 9396 1 26 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.987 0.026 19668 9397 1 26 . 1 1 28 28 GLU C C 28 179.447 179.447 179.262 0.185 19668 9398 1 26 . 1 1 28 28 GLU CA C 28 59.583 59.583 60.005 -0.422 19668 9399 1 26 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.114 -0.054 19668 9400 1 26 . 1 1 28 28 GLU H H 28 7.867 7.867 7.928 -0.061 19668 9401 1 26 . 1 1 29 29 GLU N N 29 118.447 118.447 119.159 -0.712 19668 9402 1 26 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.071 0.016 19668 9403 1 26 . 1 1 29 29 GLU C C 29 179.310 179.310 179.187 0.123 19668 9404 1 26 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.711 0.569 19668 9405 1 26 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.505 -0.169 19668 9406 1 26 . 1 1 29 29 GLU H H 29 7.755 7.755 7.549 0.206 19668 9407 1 26 . 1 1 30 30 LEU N N 30 121.135 121.135 120.189 0.946 19668 9408 1 26 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.011 0.085 19668 9409 1 26 . 1 1 30 30 LEU C C 30 178.928 178.928 178.460 0.468 19668 9410 1 26 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.327 -0.222 19668 9411 1 26 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.101 -0.421 19668 9412 1 26 . 1 1 30 30 LEU H H 30 7.785 7.785 7.619 0.166 19668 9413 1 26 . 1 1 31 31 LYS N N 31 119.130 119.130 117.742 1.388 19668 9414 1 26 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.034 -0.164 19668 9415 1 26 . 1 1 31 31 LYS C C 31 179.104 179.104 179.040 0.064 19668 9416 1 26 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.450 1.266 19668 9417 1 26 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.850 0.406 19668 9418 1 26 . 1 1 31 31 LYS H H 31 8.413 8.413 7.626 0.787 19668 9419 1 26 . 1 1 32 32 LYS N N 32 119.200 119.200 119.670 -0.470 19668 9420 1 26 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.995 0.107 19668 9421 1 26 . 1 1 32 32 LYS C C 32 179.420 179.420 179.069 0.351 19668 9422 1 26 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.471 -0.014 19668 9423 1 26 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.223 0.043 19668 9424 1 26 . 1 1 32 32 LYS H H 32 7.826 7.826 7.543 0.283 19668 9425 1 26 . 1 1 33 33 LYS N N 33 120.322 120.322 119.134 1.188 19668 9426 1 26 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.045 0.118 19668 9427 1 26 . 1 1 33 33 LYS C C 33 179.174 179.174 178.978 0.196 19668 9428 1 26 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.026 -0.278 19668 9429 1 26 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.357 -0.618 19668 9430 1 26 . 1 1 33 33 LYS H H 33 8.003 8.003 7.518 0.485 19668 9431 1 26 . 1 1 34 34 TYR N N 34 120.223 120.223 119.648 0.575 19668 9432 1 26 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.091 -0.035 19668 9433 1 26 . 1 1 34 34 TYR C C 34 176.356 176.356 177.957 -1.601 19668 9434 1 26 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.752 -0.697 19668 9435 1 26 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.436 -0.409 19668 9436 1 26 . 1 1 34 34 TYR H H 34 8.614 8.614 7.581 1.033 19668 9437 1 26 . 1 1 35 35 GLU N N 35 118.813 118.813 117.176 1.637 19668 9438 1 26 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.983 -0.258 19668 9439 1 26 . 1 1 35 35 GLU C C 35 179.787 179.787 179.158 0.629 19668 9440 1 26 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.957 -0.518 19668 9441 1 26 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.976 0.152 19668 9442 1 26 . 1 1 35 35 GLU H H 35 8.103 8.103 7.855 0.248 19668 9443 1 26 . 1 1 36 36 GLU N N 36 119.670 119.670 119.707 -0.037 19668 9444 1 26 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.088 -0.074 19668 9445 1 26 . 1 1 36 36 GLU C C 36 179.295 179.295 179.012 0.283 19668 9446 1 26 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.243 0.020 19668 9447 1 26 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.464 0.105 19668 9448 1 26 . 1 1 36 36 GLU H H 36 8.028 8.028 7.738 0.290 19668 9449 1 26 . 1 1 37 37 LEU N N 37 121.416 121.416 120.405 1.011 19668 9450 1 26 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.999 0.020 19668 9451 1 26 . 1 1 37 37 LEU C C 37 178.277 178.277 178.901 -0.624 19668 9452 1 26 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.972 -0.132 19668 9453 1 26 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.293 0.336 19668 9454 1 26 . 1 1 37 37 LEU H H 37 8.176 8.176 7.586 0.590 19668 9455 1 26 . 1 1 38 38 LYS N N 38 118.998 118.998 118.086 0.912 19668 9456 1 26 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.961 -0.301 19668 9457 1 26 . 1 1 38 38 LYS C C 38 178.923 178.923 179.070 -0.147 19668 9458 1 26 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.550 0.851 19668 9459 1 26 . 1 1 38 38 LYS CB C 38 32.062 32.062 31.877 0.185 19668 9460 1 26 . 1 1 38 38 LYS H H 38 8.260 8.260 7.616 0.644 19668 9461 1 26 . 1 1 39 39 LYS N N 39 118.070 118.070 118.540 -0.470 19668 9462 1 26 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.059 0.021 19668 9463 1 26 . 1 1 39 39 LYS C C 39 178.687 178.687 178.884 -0.197 19668 9464 1 26 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.647 -0.711 19668 9465 1 26 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.076 0.073 19668 9466 1 26 . 1 1 39 39 LYS H H 39 7.380 7.380 7.662 -0.282 19668 9467 1 26 . 1 1 40 40 LYS N N 40 118.894 118.894 120.141 -1.247 19668 9468 1 26 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.042 0.017 19668 9469 1 26 . 1 1 40 40 LYS C C 40 179.758 179.758 178.882 0.876 19668 9470 1 26 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.351 -0.289 19668 9471 1 26 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.212 0.176 19668 9472 1 26 . 1 1 40 40 LYS H H 40 7.919 7.919 7.382 0.537 19668 9473 1 26 . 1 1 41 41 ILE N N 41 118.270 118.270 118.866 -0.596 19668 9474 1 26 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.749 -0.052 19668 9475 1 26 . 1 1 41 41 ILE C C 41 178.211 178.211 177.065 1.146 19668 9476 1 26 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.741 -0.027 19668 9477 1 26 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.699 0.140 19668 9478 1 26 . 1 1 41 41 ILE H H 41 8.199 8.199 7.452 0.747 19668 9479 1 26 . 1 1 42 42 GLU N N 42 120.117 120.117 117.676 2.441 19668 9480 1 26 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.042 0.049 19668 9481 1 26 . 1 1 42 42 GLU C C 42 178.736 178.736 177.627 1.109 19668 9482 1 26 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.837 0.043 19668 9483 1 26 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.825 -0.434 19668 9484 1 26 . 1 1 42 42 GLU H H 42 7.738 7.738 7.444 0.294 19668 9485 1 26 . 1 1 43 43 GLU N N 43 117.194 117.194 116.709 0.485 19668 9486 1 26 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.149 0.150 19668 9487 1 26 . 1 1 43 43 GLU C C 43 177.658 177.658 177.491 0.167 19668 9488 1 26 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.675 -0.882 19668 9489 1 26 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.359 -0.426 19668 9490 1 26 . 1 1 43 43 GLU H H 43 7.698 7.698 7.565 0.133 19668 9491 1 26 . 1 1 44 44 LEU N N 44 120.812 120.812 117.475 3.337 19668 9492 1 26 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.228 0.011 19668 9493 1 26 . 1 1 44 44 LEU C C 44 178.682 178.682 177.214 1.468 19668 9494 1 26 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.963 0.533 19668 9495 1 26 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.308 0.339 19668 9496 1 26 . 1 1 44 44 LEU H H 44 7.593 7.593 7.466 0.127 19668 9497 1 26 . 1 1 45 45 GLY N N 45 108.681 108.681 109.444 -0.763 19668 9498 1 26 . 1 1 45 45 GLY C C 45 174.957 174.957 174.132 0.825 19668 9499 1 26 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.310 0.775 19668 9500 1 26 . 1 1 45 45 GLY H H 45 8.234 8.234 8.752 -0.518 19668 9501 1 26 . 1 1 46 46 GLY N N 46 108.057 108.057 106.420 1.637 19668 9502 1 26 . 1 1 46 46 GLY C C 46 174.777 174.777 173.364 1.413 19668 9503 1 26 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.936 0.428 19668 9504 1 26 . 1 1 46 46 GLY H H 46 8.182 8.182 7.459 0.723 19668 9505 1 26 . 1 1 47 47 GLY N N 47 108.494 108.494 107.807 0.687 19668 9506 1 26 . 1 1 47 47 GLY C C 47 174.572 174.572 175.190 -0.618 19668 9507 1 26 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.586 0.569 19668 9508 1 26 . 1 1 47 47 GLY H H 47 8.087 8.087 8.153 -0.066 19668 9509 1 26 . 1 1 48 48 GLY N N 48 108.285 108.285 107.953 0.332 19668 9510 1 26 . 1 1 48 48 GLY C C 48 174.495 174.495 173.920 0.575 19668 9511 1 26 . 1 1 48 48 GLY CA C 48 45.454 45.454 44.968 0.486 19668 9512 1 26 . 1 1 48 48 GLY H H 48 8.323 8.323 8.437 -0.114 19668 9513 1 26 . 1 1 49 49 GLU N N 49 121.070 121.070 120.462 0.608 19668 9514 1 26 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.431 -0.014 19668 9515 1 26 . 1 1 49 49 GLU C C 49 177.226 177.226 177.992 -0.766 19668 9516 1 26 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.669 -1.098 19668 9517 1 26 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.429 -0.763 19668 9518 1 26 . 1 1 49 49 GLU H H 49 8.483 8.483 7.682 0.801 19668 9519 1 26 . 1 1 50 50 VAL N N 50 121.794 121.794 117.794 4.000 19668 9520 1 26 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.680 0.101 19668 9521 1 26 . 1 1 50 50 VAL C C 50 176.860 176.860 177.794 -0.934 19668 9522 1 26 . 1 1 50 50 VAL CA C 50 65.080 65.080 66.353 -1.273 19668 9523 1 26 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.218 1.035 19668 9524 1 26 . 1 1 50 50 VAL H H 50 8.068 8.068 7.725 0.343 19668 9525 1 26 . 1 1 51 51 LYS N N 51 120.593 120.593 118.134 2.459 19668 9526 1 26 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.289 -0.082 19668 9527 1 26 . 1 1 51 51 LYS C C 51 178.667 178.667 178.448 0.219 19668 9528 1 26 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.642 0.693 19668 9529 1 26 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.759 0.499 19668 9530 1 26 . 1 1 51 51 LYS H H 51 8.253 8.253 8.301 -0.048 19668 9531 1 26 . 1 1 52 52 LYS N N 52 117.572 117.572 119.708 -2.136 19668 9532 1 26 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.101 0.067 19668 9533 1 26 . 1 1 52 52 LYS C C 52 179.248 179.248 178.805 0.443 19668 9534 1 26 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.137 -0.123 19668 9535 1 26 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.358 -0.178 19668 9536 1 26 . 1 1 52 52 LYS H H 52 7.629 7.629 7.680 -0.051 19668 9537 1 26 . 1 1 53 53 VAL N N 53 119.059 119.059 118.988 0.071 19668 9538 1 26 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.847 -0.055 19668 9539 1 26 . 1 1 53 53 VAL C C 53 177.987 177.987 178.073 -0.086 19668 9540 1 26 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.528 -0.497 19668 9541 1 26 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.832 -0.462 19668 9542 1 26 . 1 1 53 53 VAL H H 53 7.638 7.638 7.385 0.253 19668 9543 1 26 . 1 1 54 54 GLU N N 54 120.388 120.388 119.063 1.325 19668 9544 1 26 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.941 -0.097 19668 9545 1 26 . 1 1 54 54 GLU C C 54 179.624 179.624 178.905 0.719 19668 9546 1 26 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.697 0.544 19668 9547 1 26 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.282 0.536 19668 9548 1 26 . 1 1 54 54 GLU H H 54 8.603 8.603 7.672 0.931 19668 9549 1 26 . 1 1 55 55 GLU N N 55 118.533 118.533 118.304 0.229 19668 9550 1 26 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.052 0.037 19668 9551 1 26 . 1 1 55 55 GLU C C 55 179.158 179.158 178.908 0.250 19668 9552 1 26 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.211 0.124 19668 9553 1 26 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.536 -0.199 19668 9554 1 26 . 1 1 55 55 GLU H H 55 7.904 7.904 7.598 0.306 19668 9555 1 26 . 1 1 56 56 GLU N N 56 120.258 120.258 118.762 1.496 19668 9556 1 26 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.084 0.016 19668 9557 1 26 . 1 1 56 56 GLU C C 56 179.867 179.867 179.011 0.856 19668 9558 1 26 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.751 0.912 19668 9559 1 26 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.317 0.733 19668 9560 1 26 . 1 1 56 56 GLU H H 56 7.902 7.902 7.584 0.318 19668 9561 1 26 . 1 1 57 57 VAL N N 57 121.168 121.168 120.827 0.341 19668 9562 1 26 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.569 -0.001 19668 9563 1 26 . 1 1 57 57 VAL C C 57 176.994 176.994 176.991 0.003 19668 9564 1 26 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.863 2.033 19668 9565 1 26 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.675 -0.148 19668 9566 1 26 . 1 1 57 57 VAL H H 57 8.613 8.613 7.481 1.132 19668 9567 1 26 . 1 1 58 58 LYS N N 58 120.234 120.234 118.099 2.135 19668 9568 1 26 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.959 0.243 19668 9569 1 26 . 1 1 58 58 LYS C C 58 179.131 179.131 178.165 0.966 19668 9570 1 26 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.470 0.117 19668 9571 1 26 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.424 0.867 19668 9572 1 26 . 1 1 58 58 LYS H H 58 7.810 7.810 7.643 0.167 19668 9573 1 26 . 1 1 59 59 LYS N N 59 118.301 118.301 118.369 -0.068 19668 9574 1 26 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.382 -0.289 19668 9575 1 26 . 1 1 59 59 LYS C C 59 179.281 179.281 178.127 1.154 19668 9576 1 26 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.565 0.863 19668 9577 1 26 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.998 0.381 19668 9578 1 26 . 1 1 59 59 LYS H H 59 7.876 7.876 7.429 0.447 19668 9579 1 26 . 1 1 60 60 LEU N N 60 121.224 121.224 121.585 -0.361 19668 9580 1 26 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.067 0.167 19668 9581 1 26 . 1 1 60 60 LEU C C 60 178.636 178.636 178.807 -0.171 19668 9582 1 26 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.717 0.440 19668 9583 1 26 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.286 0.347 19668 9584 1 26 . 1 1 60 60 LEU H H 60 7.893 7.893 7.733 0.160 19668 9585 1 26 . 1 1 61 61 GLU N N 61 118.660 118.660 118.272 0.388 19668 9586 1 26 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.073 -0.274 19668 9587 1 26 . 1 1 61 61 GLU C C 61 179.094 179.094 178.491 0.603 19668 9588 1 26 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.058 1.214 19668 9589 1 26 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.616 1.387 19668 9590 1 26 . 1 1 61 61 GLU H H 61 8.644 8.644 7.825 0.819 19668 9591 1 26 . 1 1 62 62 GLU N N 62 117.555 117.555 120.101 -2.546 19668 9592 1 26 . 1 1 62 62 GLU HA H 62 3.996 3.996 3.997 -0.001 19668 9593 1 26 . 1 1 62 62 GLU C C 62 178.940 178.940 178.863 0.077 19668 9594 1 26 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.188 -0.020 19668 9595 1 26 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.233 0.314 19668 9596 1 26 . 1 1 62 62 GLU H H 62 7.995 7.995 7.657 0.338 19668 9597 1 26 . 1 1 63 63 GLU N N 63 119.097 119.097 118.915 0.182 19668 9598 1 26 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.107 -0.078 19668 9599 1 26 . 1 1 63 63 GLU C C 63 179.890 179.890 179.051 0.839 19668 9600 1 26 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.520 0.820 19668 9601 1 26 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.782 0.885 19668 9602 1 26 . 1 1 63 63 GLU H H 63 7.983 7.983 7.818 0.165 19668 9603 1 26 . 1 1 64 64 ILE N N 64 118.247 118.247 118.199 0.048 19668 9604 1 26 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.826 -0.106 19668 9605 1 26 . 1 1 64 64 ILE C C 64 177.858 177.858 178.025 -0.167 19668 9606 1 26 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.390 0.106 19668 9607 1 26 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.492 0.489 19668 9608 1 26 . 1 1 64 64 ILE H H 64 8.261 8.261 7.259 1.002 19668 9609 1 26 . 1 1 65 65 LYS N N 65 118.693 118.693 118.059 0.634 19668 9610 1 26 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.147 -0.049 19668 9611 1 26 . 1 1 65 65 LYS C C 65 177.244 177.244 177.496 -0.252 19668 9612 1 26 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.363 0.290 19668 9613 1 26 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.265 0.440 19668 9614 1 26 . 1 1 65 65 LYS H H 65 7.661 7.661 7.512 0.149 19668 9615 1 26 . 1 1 66 66 LYS N N 66 116.933 116.933 118.055 -1.122 19668 9616 1 26 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.206 0.132 19668 9617 1 26 . 1 1 66 66 LYS C C 66 176.011 176.011 177.012 -1.001 19668 9618 1 26 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.357 -0.898 19668 9619 1 26 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.886 0.245 19668 9620 1 26 . 1 1 66 66 LYS H H 66 7.261 7.261 7.520 -0.259 19668 9621 1 27 . 1 1 2 2 SER HA H 2 4.560 4.560 4.208 0.352 19668 9622 1 27 . 1 1 2 2 SER CA C 2 58.366 58.366 59.092 -0.726 19668 9623 1 27 . 1 1 3 3 ARG N N 3 125.213 125.213 115.990 9.223 19668 9624 1 27 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.351 -0.085 19668 9625 1 27 . 1 1 3 3 ARG C C 3 178.381 178.381 176.369 2.012 19668 9626 1 27 . 1 1 3 3 ARG CA C 3 58.396 58.396 56.793 1.603 19668 9627 1 27 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.899 0.756 19668 9628 1 27 . 1 1 3 3 ARG H H 3 8.874 8.874 7.971 0.903 19668 9629 1 27 . 1 1 4 4 VAL N N 4 119.320 119.320 121.564 -2.244 19668 9630 1 27 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.757 0.041 19668 9631 1 27 . 1 1 4 4 VAL C C 4 177.004 177.004 177.111 -0.107 19668 9632 1 27 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.013 -0.498 19668 9633 1 27 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.386 0.417 19668 9634 1 27 . 1 1 4 4 VAL H H 4 8.112 8.112 8.284 -0.172 19668 9635 1 27 . 1 1 5 5 LYS N N 5 122.279 122.279 120.733 1.546 19668 9636 1 27 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.031 0.131 19668 9637 1 27 . 1 1 5 5 LYS C C 5 178.547 178.547 177.972 0.575 19668 9638 1 27 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.980 -0.223 19668 9639 1 27 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.680 0.330 19668 9640 1 27 . 1 1 5 5 LYS H H 5 7.847 7.847 7.973 -0.126 19668 9641 1 27 . 1 1 6 6 ALA N N 6 120.295 120.295 120.513 -0.218 19668 9642 1 27 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.335 -0.124 19668 9643 1 27 . 1 1 6 6 ALA C C 6 180.834 180.834 179.716 1.118 19668 9644 1 27 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.716 0.187 19668 9645 1 27 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.773 0.359 19668 9646 1 27 . 1 1 6 6 ALA H H 6 7.975 7.975 8.281 -0.306 19668 9647 1 27 . 1 1 7 7 LEU N N 7 119.570 119.570 118.580 0.990 19668 9648 1 27 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.076 0.096 19668 9649 1 27 . 1 1 7 7 LEU C C 7 178.431 178.431 178.756 -0.325 19668 9650 1 27 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.837 -0.159 19668 9651 1 27 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.069 0.966 19668 9652 1 27 . 1 1 7 7 LEU H H 7 7.650 7.650 7.527 0.123 19668 9653 1 27 . 1 1 8 8 GLU N N 8 119.934 119.934 118.480 1.454 19668 9654 1 27 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.068 -0.209 19668 9655 1 27 . 1 1 8 8 GLU C C 8 179.534 179.534 178.381 1.153 19668 9656 1 27 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.333 0.704 19668 9657 1 27 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.743 0.724 19668 9658 1 27 . 1 1 8 8 GLU H H 8 8.411 8.411 7.917 0.494 19668 9659 1 27 . 1 1 9 9 GLU N N 9 118.234 118.234 119.381 -1.147 19668 9660 1 27 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.039 0.021 19668 9661 1 27 . 1 1 9 9 GLU C C 9 179.596 179.596 178.967 0.629 19668 9662 1 27 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.143 0.187 19668 9663 1 27 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.338 0.080 19668 9664 1 27 . 1 1 9 9 GLU H H 9 8.206 8.206 7.665 0.541 19668 9665 1 27 . 1 1 10 10 LYS N N 10 121.042 121.042 119.203 1.839 19668 9666 1 27 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.143 0.040 19668 9667 1 27 . 1 1 10 10 LYS C C 10 179.380 179.380 179.008 0.372 19668 9668 1 27 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.111 0.214 19668 9669 1 27 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.111 0.298 19668 9670 1 27 . 1 1 10 10 LYS H H 10 7.931 7.931 7.566 0.365 19668 9671 1 27 . 1 1 11 11 VAL N N 11 118.662 118.662 120.016 -1.354 19668 9672 1 27 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.877 -0.063 19668 9673 1 27 . 1 1 11 11 VAL C C 11 178.845 178.845 178.243 0.602 19668 9674 1 27 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.138 0.850 19668 9675 1 27 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.671 -0.017 19668 9676 1 27 . 1 1 11 11 VAL H H 11 8.371 8.371 7.588 0.783 19668 9677 1 27 . 1 1 12 12 LYS N N 12 123.188 123.188 119.584 3.604 19668 9678 1 27 . 1 1 12 12 LYS HA H 12 4.226 4.226 4.016 0.210 19668 9679 1 27 . 1 1 12 12 LYS C C 12 179.098 179.098 178.402 0.696 19668 9680 1 27 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.343 0.140 19668 9681 1 27 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.238 -0.032 19668 9682 1 27 . 1 1 12 12 LYS H H 12 8.276 8.276 7.552 0.724 19668 9683 1 27 . 1 1 13 13 ALA N N 13 121.169 121.169 121.813 -0.644 19668 9684 1 27 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.077 0.181 19668 9685 1 27 . 1 1 13 13 ALA C C 13 180.169 180.169 179.704 0.465 19668 9686 1 27 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.846 -0.209 19668 9687 1 27 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.267 -0.160 19668 9688 1 27 . 1 1 13 13 ALA H H 13 7.829 7.829 7.477 0.352 19668 9689 1 27 . 1 1 14 14 LEU N N 14 118.104 118.104 118.524 -0.420 19668 9690 1 27 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.983 0.173 19668 9691 1 27 . 1 1 14 14 LEU C C 14 177.614 177.614 178.013 -0.399 19668 9692 1 27 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.090 -0.485 19668 9693 1 27 . 1 1 14 14 LEU CB C 14 42.795 42.795 42.046 0.749 19668 9694 1 27 . 1 1 14 14 LEU H H 14 7.781 7.781 7.543 0.238 19668 9695 1 27 . 1 1 15 15 GLU N N 15 120.632 120.632 119.331 1.301 19668 9696 1 27 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.424 -0.057 19668 9697 1 27 . 1 1 15 15 GLU C C 15 178.243 178.243 178.448 -0.205 19668 9698 1 27 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.672 0.914 19668 9699 1 27 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.386 0.443 19668 9700 1 27 . 1 1 15 15 GLU H H 15 7.873 7.873 7.396 0.477 19668 9701 1 27 . 1 1 16 16 GLU N N 16 115.775 115.775 117.054 -1.279 19668 9702 1 27 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.992 -0.033 19668 9703 1 27 . 1 1 16 16 GLU C C 16 179.006 179.006 178.540 0.466 19668 9704 1 27 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.232 -0.140 19668 9705 1 27 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.037 0.316 19668 9706 1 27 . 1 1 16 16 GLU H H 16 7.926 7.926 7.861 0.065 19668 9707 1 27 . 1 1 17 17 LYS N N 17 118.801 118.801 118.974 -0.173 19668 9708 1 27 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.086 0.008 19668 9709 1 27 . 1 1 17 17 LYS C C 17 178.853 178.853 177.904 0.949 19668 9710 1 27 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.901 -0.430 19668 9711 1 27 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.868 0.494 19668 9712 1 27 . 1 1 17 17 LYS H H 17 7.518 7.518 7.538 -0.020 19668 9713 1 27 . 1 1 18 18 VAL N N 18 118.034 118.034 118.511 -0.477 19668 9714 1 27 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.798 -0.286 19668 9715 1 27 . 1 1 18 18 VAL C C 18 178.362 178.362 178.367 -0.005 19668 9716 1 27 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.279 0.740 19668 9717 1 27 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.345 0.305 19668 9718 1 27 . 1 1 18 18 VAL H H 18 8.048 8.048 7.222 0.826 19668 9719 1 27 . 1 1 19 19 LYS N N 19 118.427 118.427 120.055 -1.628 19668 9720 1 27 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.087 -0.077 19668 9721 1 27 . 1 1 19 19 LYS C C 19 177.706 177.706 178.160 -0.454 19668 9722 1 27 . 1 1 19 19 LYS CA C 19 58.985 58.985 59.108 -0.123 19668 9723 1 27 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.599 0.825 19668 9724 1 27 . 1 1 19 19 LYS H H 19 8.008 8.008 7.648 0.360 19668 9725 1 27 . 1 1 20 20 ALA N N 20 119.177 119.177 120.208 -1.031 19668 9726 1 27 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.260 0.056 19668 9727 1 27 . 1 1 20 20 ALA C C 20 178.269 178.269 178.416 -0.147 19668 9728 1 27 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.996 -0.365 19668 9729 1 27 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.585 0.548 19668 9730 1 27 . 1 1 20 20 ALA H H 20 7.259 7.259 7.432 -0.173 19668 9731 1 27 . 1 1 21 21 LEU N N 21 118.596 118.596 117.437 1.159 19668 9732 1 27 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.067 0.194 19668 9733 1 27 . 1 1 21 21 LEU C C 21 177.732 177.732 177.364 0.368 19668 9734 1 27 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.167 -0.510 19668 9735 1 27 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.423 0.710 19668 9736 1 27 . 1 1 21 21 LEU H H 21 7.373 7.373 7.572 -0.199 19668 9737 1 27 . 1 1 22 22 GLY N N 22 107.926 107.926 105.746 2.180 19668 9738 1 27 . 1 1 22 22 GLY C C 22 173.362 173.362 173.629 -0.267 19668 9739 1 27 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.625 0.572 19668 9740 1 27 . 1 1 22 22 GLY H H 22 8.144 8.144 7.437 0.707 19668 9741 1 27 . 1 1 23 23 GLY N N 23 108.242 108.242 108.340 -0.098 19668 9742 1 27 . 1 1 23 23 GLY C C 23 174.110 174.110 173.838 0.272 19668 9743 1 27 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.735 -0.051 19668 9744 1 27 . 1 1 23 23 GLY H H 23 8.157 8.157 7.839 0.318 19668 9745 1 27 . 1 1 24 24 GLY N N 24 106.969 106.969 108.390 -1.421 19668 9746 1 27 . 1 1 24 24 GLY C C 24 175.172 175.172 175.266 -0.094 19668 9747 1 27 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.578 -1.139 19668 9748 1 27 . 1 1 24 24 GLY H H 24 8.466 8.466 9.032 -0.566 19668 9749 1 27 . 1 1 25 25 GLY N N 25 108.946 108.946 109.279 -0.333 19668 9750 1 27 . 1 1 25 25 GLY C C 25 176.321 176.321 175.323 0.998 19668 9751 1 27 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.108 1.991 19668 9752 1 27 . 1 1 25 25 GLY H H 25 8.618 8.618 7.930 0.688 19668 9753 1 27 . 1 1 26 26 ARG N N 26 123.559 123.559 121.941 1.618 19668 9754 1 27 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.376 -0.097 19668 9755 1 27 . 1 1 26 26 ARG C C 26 178.076 178.076 178.021 0.055 19668 9756 1 27 . 1 1 26 26 ARG CA C 26 57.915 57.915 57.783 0.132 19668 9757 1 27 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.508 -0.598 19668 9758 1 27 . 1 1 26 26 ARG H H 26 8.789 8.789 8.426 0.363 19668 9759 1 27 . 1 1 27 27 ILE N N 27 118.726 118.726 119.757 -1.031 19668 9760 1 27 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.859 -0.073 19668 9761 1 27 . 1 1 27 27 ILE C C 27 177.639 177.639 177.899 -0.260 19668 9762 1 27 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.441 -0.817 19668 9763 1 27 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.163 -0.208 19668 9764 1 27 . 1 1 27 27 ILE H H 27 7.762 7.762 8.124 -0.362 19668 9765 1 27 . 1 1 28 28 GLU N N 28 119.843 119.843 118.662 1.181 19668 9766 1 27 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.021 -0.008 19668 9767 1 27 . 1 1 28 28 GLU C C 28 179.447 179.447 179.342 0.105 19668 9768 1 27 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.883 -0.300 19668 9769 1 27 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.821 0.239 19668 9770 1 27 . 1 1 28 28 GLU H H 28 7.867 7.867 8.811 -0.944 19668 9771 1 27 . 1 1 29 29 GLU N N 29 118.447 118.447 119.295 -0.848 19668 9772 1 27 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.069 0.018 19668 9773 1 27 . 1 1 29 29 GLU C C 29 179.310 179.310 179.148 0.162 19668 9774 1 27 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.547 0.733 19668 9775 1 27 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.476 -0.140 19668 9776 1 27 . 1 1 29 29 GLU H H 29 7.755 7.755 7.707 0.048 19668 9777 1 27 . 1 1 30 30 LEU N N 30 121.135 121.135 120.182 0.953 19668 9778 1 27 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.003 0.093 19668 9779 1 27 . 1 1 30 30 LEU C C 30 178.928 178.928 178.477 0.451 19668 9780 1 27 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.302 -0.197 19668 9781 1 27 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.084 -0.404 19668 9782 1 27 . 1 1 30 30 LEU H H 30 7.785 7.785 7.584 0.201 19668 9783 1 27 . 1 1 31 31 LYS N N 31 119.130 119.130 117.653 1.477 19668 9784 1 27 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.045 -0.175 19668 9785 1 27 . 1 1 31 31 LYS C C 31 179.104 179.104 179.033 0.071 19668 9786 1 27 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.364 1.352 19668 9787 1 27 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.824 0.432 19668 9788 1 27 . 1 1 31 31 LYS H H 31 8.413 8.413 7.623 0.790 19668 9789 1 27 . 1 1 32 32 LYS N N 32 119.200 119.200 119.380 -0.180 19668 9790 1 27 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.003 0.099 19668 9791 1 27 . 1 1 32 32 LYS C C 32 179.420 179.420 178.954 0.466 19668 9792 1 27 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.474 -0.017 19668 9793 1 27 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.116 0.150 19668 9794 1 27 . 1 1 32 32 LYS H H 32 7.826 7.826 7.480 0.346 19668 9795 1 27 . 1 1 33 33 LYS N N 33 120.322 120.322 119.012 1.310 19668 9796 1 27 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.019 0.144 19668 9797 1 27 . 1 1 33 33 LYS C C 33 179.174 179.174 178.800 0.374 19668 9798 1 27 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.363 -0.615 19668 9799 1 27 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.358 -0.619 19668 9800 1 27 . 1 1 33 33 LYS H H 33 8.003 8.003 7.648 0.355 19668 9801 1 27 . 1 1 34 34 TYR N N 34 120.223 120.223 118.051 2.172 19668 9802 1 27 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.144 -0.088 19668 9803 1 27 . 1 1 34 34 TYR C C 34 176.356 176.356 177.732 -1.376 19668 9804 1 27 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.606 -0.551 19668 9805 1 27 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.261 -0.234 19668 9806 1 27 . 1 1 34 34 TYR H H 34 8.614 8.614 7.516 1.098 19668 9807 1 27 . 1 1 35 35 GLU N N 35 118.813 118.813 117.227 1.586 19668 9808 1 27 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.934 -0.209 19668 9809 1 27 . 1 1 35 35 GLU C C 35 179.787 179.787 178.963 0.824 19668 9810 1 27 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.791 -0.352 19668 9811 1 27 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.122 0.006 19668 9812 1 27 . 1 1 35 35 GLU H H 35 8.103 8.103 7.886 0.217 19668 9813 1 27 . 1 1 36 36 GLU N N 36 119.670 119.670 119.677 -0.007 19668 9814 1 27 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.099 -0.085 19668 9815 1 27 . 1 1 36 36 GLU C C 36 179.295 179.295 178.912 0.383 19668 9816 1 27 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.123 0.140 19668 9817 1 27 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.333 0.236 19668 9818 1 27 . 1 1 36 36 GLU H H 36 8.028 8.028 7.686 0.342 19668 9819 1 27 . 1 1 37 37 LEU N N 37 121.416 121.416 117.796 3.620 19668 9820 1 27 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.947 0.072 19668 9821 1 27 . 1 1 37 37 LEU C C 37 178.277 178.277 178.866 -0.589 19668 9822 1 27 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.467 0.373 19668 9823 1 27 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.649 -0.020 19668 9824 1 27 . 1 1 37 37 LEU H H 37 8.176 8.176 7.358 0.818 19668 9825 1 27 . 1 1 38 38 LYS N N 38 118.998 118.998 118.436 0.562 19668 9826 1 27 . 1 1 38 38 LYS HA H 38 3.660 3.660 4.019 -0.359 19668 9827 1 27 . 1 1 38 38 LYS C C 38 178.923 178.923 178.826 0.097 19668 9828 1 27 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.695 0.705 19668 9829 1 27 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.114 -0.052 19668 9830 1 27 . 1 1 38 38 LYS H H 38 8.260 8.260 7.456 0.804 19668 9831 1 27 . 1 1 39 39 LYS N N 39 118.070 118.070 119.276 -1.206 19668 9832 1 27 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.029 0.051 19668 9833 1 27 . 1 1 39 39 LYS C C 39 178.687 178.687 178.865 -0.178 19668 9834 1 27 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.446 -0.510 19668 9835 1 27 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.148 0.001 19668 9836 1 27 . 1 1 39 39 LYS H H 39 7.380 7.380 7.542 -0.162 19668 9837 1 27 . 1 1 40 40 LYS N N 40 118.894 118.894 118.884 0.010 19668 9838 1 27 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.069 -0.010 19668 9839 1 27 . 1 1 40 40 LYS C C 40 179.758 179.758 179.021 0.737 19668 9840 1 27 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.395 -0.334 19668 9841 1 27 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.337 0.051 19668 9842 1 27 . 1 1 40 40 LYS H H 40 7.919 7.919 7.516 0.403 19668 9843 1 27 . 1 1 41 41 ILE N N 41 118.270 118.270 117.493 0.777 19668 9844 1 27 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.781 -0.084 19668 9845 1 27 . 1 1 41 41 ILE C C 41 178.211 178.211 177.059 1.152 19668 9846 1 27 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.113 0.601 19668 9847 1 27 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.982 -0.143 19668 9848 1 27 . 1 1 41 41 ILE H H 41 8.199 8.199 7.277 0.922 19668 9849 1 27 . 1 1 42 42 GLU N N 42 120.117 120.117 117.187 2.930 19668 9850 1 27 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.043 0.048 19668 9851 1 27 . 1 1 42 42 GLU C C 42 178.736 178.736 177.489 1.247 19668 9852 1 27 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.499 0.381 19668 9853 1 27 . 1 1 42 42 GLU CB C 42 29.391 29.391 30.172 -0.781 19668 9854 1 27 . 1 1 42 42 GLU H H 42 7.738 7.738 7.548 0.190 19668 9855 1 27 . 1 1 43 43 GLU N N 43 117.194 117.194 115.680 1.514 19668 9856 1 27 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.195 0.104 19668 9857 1 27 . 1 1 43 43 GLU C C 43 177.658 177.658 177.508 0.150 19668 9858 1 27 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.251 -0.458 19668 9859 1 27 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.095 -0.162 19668 9860 1 27 . 1 1 43 43 GLU H H 43 7.698 7.698 7.572 0.126 19668 9861 1 27 . 1 1 44 44 LEU N N 44 120.812 120.812 117.814 2.998 19668 9862 1 27 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.543 -0.304 19668 9863 1 27 . 1 1 44 44 LEU C C 44 178.682 178.682 176.273 2.409 19668 9864 1 27 . 1 1 44 44 LEU CA C 44 56.496 56.496 54.923 1.573 19668 9865 1 27 . 1 1 44 44 LEU CB C 44 42.647 42.647 43.084 -0.437 19668 9866 1 27 . 1 1 44 44 LEU H H 44 7.593 7.593 7.438 0.155 19668 9867 1 27 . 1 1 45 45 GLY N N 45 108.681 108.681 107.857 0.824 19668 9868 1 27 . 1 1 45 45 GLY C C 45 174.957 174.957 174.639 0.318 19668 9869 1 27 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.076 1.010 19668 9870 1 27 . 1 1 45 45 GLY H H 45 8.234 8.234 8.429 -0.195 19668 9871 1 27 . 1 1 46 46 GLY N N 46 108.057 108.057 110.027 -1.970 19668 9872 1 27 . 1 1 46 46 GLY C C 46 174.777 174.777 174.941 -0.164 19668 9873 1 27 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.766 0.598 19668 9874 1 27 . 1 1 46 46 GLY H H 46 8.182 8.182 7.913 0.269 19668 9875 1 27 . 1 1 47 47 GLY N N 47 108.494 108.494 105.211 3.283 19668 9876 1 27 . 1 1 47 47 GLY C C 47 174.572 174.572 174.470 0.102 19668 9877 1 27 . 1 1 47 47 GLY CA C 47 45.155 45.155 45.013 0.142 19668 9878 1 27 . 1 1 47 47 GLY H H 47 8.087 8.087 8.336 -0.249 19668 9879 1 27 . 1 1 48 48 GLY N N 48 108.285 108.285 107.990 0.295 19668 9880 1 27 . 1 1 48 48 GLY C C 48 174.495 174.495 175.300 -0.805 19668 9881 1 27 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.524 -0.070 19668 9882 1 27 . 1 1 48 48 GLY H H 48 8.323 8.323 8.133 0.190 19668 9883 1 27 . 1 1 49 49 GLU N N 49 121.070 121.070 120.211 0.859 19668 9884 1 27 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.467 -0.050 19668 9885 1 27 . 1 1 49 49 GLU C C 49 177.226 177.226 178.347 -1.121 19668 9886 1 27 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.657 -0.086 19668 9887 1 27 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.700 -0.034 19668 9888 1 27 . 1 1 49 49 GLU H H 49 8.483 8.483 8.285 0.198 19668 9889 1 27 . 1 1 50 50 VAL N N 50 121.794 121.794 120.542 1.252 19668 9890 1 27 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.737 0.044 19668 9891 1 27 . 1 1 50 50 VAL C C 50 176.860 176.860 177.018 -0.158 19668 9892 1 27 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.700 -0.620 19668 9893 1 27 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.777 0.476 19668 9894 1 27 . 1 1 50 50 VAL H H 50 8.068 8.068 7.943 0.125 19668 9895 1 27 . 1 1 51 51 LYS N N 51 120.593 120.593 118.270 2.323 19668 9896 1 27 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.094 0.113 19668 9897 1 27 . 1 1 51 51 LYS C C 51 178.667 178.667 178.949 -0.282 19668 9898 1 27 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.916 0.418 19668 9899 1 27 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.564 0.694 19668 9900 1 27 . 1 1 51 51 LYS H H 51 8.253 8.253 8.459 -0.206 19668 9901 1 27 . 1 1 52 52 LYS N N 52 117.572 117.572 120.328 -2.756 19668 9902 1 27 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.076 0.092 19668 9903 1 27 . 1 1 52 52 LYS C C 52 179.248 179.248 178.953 0.295 19668 9904 1 27 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.259 -0.245 19668 9905 1 27 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.473 -0.293 19668 9906 1 27 . 1 1 52 52 LYS H H 52 7.629 7.629 7.651 -0.022 19668 9907 1 27 . 1 1 53 53 VAL N N 53 119.059 119.059 119.328 -0.269 19668 9908 1 27 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.600 0.192 19668 9909 1 27 . 1 1 53 53 VAL C C 53 177.987 177.987 177.507 0.480 19668 9910 1 27 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.723 -0.692 19668 9911 1 27 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.809 -0.438 19668 9912 1 27 . 1 1 53 53 VAL H H 53 7.638 7.638 7.542 0.096 19668 9913 1 27 . 1 1 54 54 GLU N N 54 120.388 120.388 119.367 1.021 19668 9914 1 27 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.892 -0.048 19668 9915 1 27 . 1 1 54 54 GLU C C 54 179.624 179.624 178.964 0.660 19668 9916 1 27 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.828 0.413 19668 9917 1 27 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.351 0.467 19668 9918 1 27 . 1 1 54 54 GLU H H 54 8.603 8.603 7.634 0.969 19668 9919 1 27 . 1 1 55 55 GLU N N 55 118.533 118.533 118.161 0.372 19668 9920 1 27 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.098 -0.008 19668 9921 1 27 . 1 1 55 55 GLU C C 55 179.158 179.158 179.091 0.067 19668 9922 1 27 . 1 1 55 55 GLU CA C 55 59.334 59.334 58.903 0.431 19668 9923 1 27 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.104 0.233 19668 9924 1 27 . 1 1 55 55 GLU H H 55 7.904 7.904 7.596 0.308 19668 9925 1 27 . 1 1 56 56 GLU N N 56 120.258 120.258 119.803 0.455 19668 9926 1 27 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.030 0.070 19668 9927 1 27 . 1 1 56 56 GLU C C 56 179.867 179.867 179.220 0.647 19668 9928 1 27 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.331 0.332 19668 9929 1 27 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.481 0.569 19668 9930 1 27 . 1 1 56 56 GLU H H 56 7.902 7.902 7.463 0.439 19668 9931 1 27 . 1 1 57 57 VAL N N 57 121.168 121.168 119.934 1.234 19668 9932 1 27 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.542 0.026 19668 9933 1 27 . 1 1 57 57 VAL C C 57 176.994 176.994 177.241 -0.247 19668 9934 1 27 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.322 1.574 19668 9935 1 27 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.553 -0.026 19668 9936 1 27 . 1 1 57 57 VAL H H 57 8.613 8.613 7.532 1.081 19668 9937 1 27 . 1 1 58 58 LYS N N 58 120.234 120.234 119.131 1.103 19668 9938 1 27 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.964 0.238 19668 9939 1 27 . 1 1 58 58 LYS C C 58 179.131 179.131 179.140 -0.009 19668 9940 1 27 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.128 0.459 19668 9941 1 27 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.910 0.381 19668 9942 1 27 . 1 1 58 58 LYS H H 58 7.810 7.810 7.461 0.349 19668 9943 1 27 . 1 1 59 59 LYS N N 59 118.301 118.301 118.588 -0.287 19668 9944 1 27 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.034 0.059 19668 9945 1 27 . 1 1 59 59 LYS C C 59 179.281 179.281 178.546 0.735 19668 9946 1 27 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.187 0.241 19668 9947 1 27 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.059 0.320 19668 9948 1 27 . 1 1 59 59 LYS H H 59 7.876 7.876 7.428 0.448 19668 9949 1 27 . 1 1 60 60 LEU N N 60 121.224 121.224 120.259 0.965 19668 9950 1 27 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.032 0.202 19668 9951 1 27 . 1 1 60 60 LEU C C 60 178.636 178.636 178.839 -0.203 19668 9952 1 27 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.863 0.294 19668 9953 1 27 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.371 0.263 19668 9954 1 27 . 1 1 60 60 LEU H H 60 7.893 7.893 7.471 0.422 19668 9955 1 27 . 1 1 61 61 GLU N N 61 118.660 118.660 117.928 0.732 19668 9956 1 27 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.081 -0.282 19668 9957 1 27 . 1 1 61 61 GLU C C 61 179.094 179.094 178.909 0.185 19668 9958 1 27 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.035 1.236 19668 9959 1 27 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.903 1.100 19668 9960 1 27 . 1 1 61 61 GLU H H 61 8.644 8.644 7.868 0.776 19668 9961 1 27 . 1 1 62 62 GLU N N 62 117.555 117.555 119.675 -2.120 19668 9962 1 27 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.012 -0.016 19668 9963 1 27 . 1 1 62 62 GLU C C 62 178.940 178.940 179.135 -0.195 19668 9964 1 27 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.350 -0.182 19668 9965 1 27 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.265 0.282 19668 9966 1 27 . 1 1 62 62 GLU H H 62 7.995 7.995 7.556 0.439 19668 9967 1 27 . 1 1 63 63 GLU N N 63 119.097 119.097 118.297 0.800 19668 9968 1 27 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.146 -0.117 19668 9969 1 27 . 1 1 63 63 GLU C C 63 179.890 179.890 179.054 0.836 19668 9970 1 27 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.660 0.681 19668 9971 1 27 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.998 0.669 19668 9972 1 27 . 1 1 63 63 GLU H H 63 7.983 7.983 7.712 0.271 19668 9973 1 27 . 1 1 64 64 ILE N N 64 118.247 118.247 118.219 0.028 19668 9974 1 27 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.868 -0.148 19668 9975 1 27 . 1 1 64 64 ILE C C 64 177.858 177.858 177.543 0.315 19668 9976 1 27 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.316 0.180 19668 9977 1 27 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.301 0.680 19668 9978 1 27 . 1 1 64 64 ILE H H 64 8.261 8.261 7.260 1.001 19668 9979 1 27 . 1 1 65 65 LYS N N 65 118.693 118.693 118.490 0.203 19668 9980 1 27 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.184 -0.086 19668 9981 1 27 . 1 1 65 65 LYS C C 65 177.244 177.244 177.822 -0.578 19668 9982 1 27 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.736 0.917 19668 9983 1 27 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.136 0.569 19668 9984 1 27 . 1 1 65 65 LYS H H 65 7.661 7.661 7.515 0.146 19668 9985 1 27 . 1 1 66 66 LYS N N 66 116.933 116.933 117.835 -0.902 19668 9986 1 27 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.117 0.221 19668 9987 1 27 . 1 1 66 66 LYS C C 66 176.011 176.011 177.275 -1.264 19668 9988 1 27 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.882 -1.423 19668 9989 1 27 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.655 0.476 19668 9990 1 27 . 1 1 66 66 LYS H H 66 7.261 7.261 7.590 -0.329 19668 9991 1 28 . 1 1 2 2 SER HA H 2 4.560 4.560 4.191 0.369 19668 9992 1 28 . 1 1 2 2 SER CA C 2 58.366 58.366 60.508 -2.142 19668 9993 1 28 . 1 1 3 3 ARG N N 3 125.213 125.213 121.699 3.514 19668 9994 1 28 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.131 0.135 19668 9995 1 28 . 1 1 3 3 ARG C C 3 178.381 178.381 177.987 0.394 19668 9996 1 28 . 1 1 3 3 ARG CA C 3 58.396 58.396 59.029 -0.633 19668 9997 1 28 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.773 0.882 19668 9998 1 28 . 1 1 3 3 ARG H H 3 8.874 8.874 8.345 0.529 19668 9999 1 28 . 1 1 4 4 VAL N N 4 119.320 119.320 121.097 -1.777 19668 10000 1 28 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.926 -0.128 19668 10001 1 28 . 1 1 4 4 VAL C C 4 177.004 177.004 177.744 -0.740 19668 10002 1 28 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.477 0.038 19668 10003 1 28 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.090 0.713 19668 10004 1 28 . 1 1 4 4 VAL H H 4 8.112 8.112 7.914 0.198 19668 10005 1 28 . 1 1 5 5 LYS N N 5 122.279 122.279 121.059 1.220 19668 10006 1 28 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.051 0.111 19668 10007 1 28 . 1 1 5 5 LYS C C 5 178.547 178.547 178.318 0.229 19668 10008 1 28 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.850 -0.092 19668 10009 1 28 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.762 0.248 19668 10010 1 28 . 1 1 5 5 LYS H H 5 7.847 7.847 8.291 -0.444 19668 10011 1 28 . 1 1 6 6 ALA N N 6 120.295 120.295 121.421 -1.126 19668 10012 1 28 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.041 0.170 19668 10013 1 28 . 1 1 6 6 ALA C C 6 180.834 180.834 179.259 1.575 19668 10014 1 28 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.013 -0.110 19668 10015 1 28 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.245 -0.113 19668 10016 1 28 . 1 1 6 6 ALA H H 6 7.975 7.975 7.712 0.263 19668 10017 1 28 . 1 1 7 7 LEU N N 7 119.570 119.570 118.281 1.289 19668 10018 1 28 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.054 0.118 19668 10019 1 28 . 1 1 7 7 LEU C C 7 178.431 178.431 178.623 -0.192 19668 10020 1 28 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.785 -0.106 19668 10021 1 28 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.114 0.921 19668 10022 1 28 . 1 1 7 7 LEU H H 7 7.650 7.650 7.660 -0.010 19668 10023 1 28 . 1 1 8 8 GLU N N 8 119.934 119.934 118.432 1.502 19668 10024 1 28 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.062 -0.203 19668 10025 1 28 . 1 1 8 8 GLU C C 8 179.534 179.534 178.672 0.862 19668 10026 1 28 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.346 0.690 19668 10027 1 28 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.758 0.709 19668 10028 1 28 . 1 1 8 8 GLU H H 8 8.411 8.411 7.828 0.583 19668 10029 1 28 . 1 1 9 9 GLU N N 9 118.234 118.234 119.265 -1.031 19668 10030 1 28 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.091 -0.031 19668 10031 1 28 . 1 1 9 9 GLU C C 9 179.596 179.596 178.835 0.761 19668 10032 1 28 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.313 0.017 19668 10033 1 28 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.441 -0.023 19668 10034 1 28 . 1 1 9 9 GLU H H 9 8.206 8.206 7.743 0.463 19668 10035 1 28 . 1 1 10 10 LYS N N 10 121.042 121.042 118.773 2.269 19668 10036 1 28 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.155 0.028 19668 10037 1 28 . 1 1 10 10 LYS C C 10 179.380 179.380 179.195 0.185 19668 10038 1 28 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.199 0.126 19668 10039 1 28 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.188 0.221 19668 10040 1 28 . 1 1 10 10 LYS H H 10 7.931 7.931 7.561 0.370 19668 10041 1 28 . 1 1 11 11 VAL N N 11 118.662 118.662 119.623 -0.961 19668 10042 1 28 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.922 -0.108 19668 10043 1 28 . 1 1 11 11 VAL C C 11 178.845 178.845 178.246 0.599 19668 10044 1 28 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.251 1.737 19668 10045 1 28 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.117 0.537 19668 10046 1 28 . 1 1 11 11 VAL H H 11 8.371 8.371 7.612 0.759 19668 10047 1 28 . 1 1 12 12 LYS N N 12 123.188 123.188 120.021 3.167 19668 10048 1 28 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.992 0.234 19668 10049 1 28 . 1 1 12 12 LYS C C 12 179.098 179.098 178.416 0.682 19668 10050 1 28 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.466 0.017 19668 10051 1 28 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.251 -0.045 19668 10052 1 28 . 1 1 12 12 LYS H H 12 8.276 8.276 7.574 0.702 19668 10053 1 28 . 1 1 13 13 ALA N N 13 121.169 121.169 122.434 -1.265 19668 10054 1 28 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.312 -0.054 19668 10055 1 28 . 1 1 13 13 ALA C C 13 180.169 180.169 179.628 0.541 19668 10056 1 28 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.730 -0.094 19668 10057 1 28 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.506 -0.400 19668 10058 1 28 . 1 1 13 13 ALA H H 13 7.829 7.829 7.432 0.397 19668 10059 1 28 . 1 1 14 14 LEU N N 14 118.104 118.104 118.287 -0.183 19668 10060 1 28 . 1 1 14 14 LEU HA H 14 4.156 4.156 4.001 0.155 19668 10061 1 28 . 1 1 14 14 LEU C C 14 177.614 177.614 177.895 -0.281 19668 10062 1 28 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.164 -0.559 19668 10063 1 28 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.905 0.890 19668 10064 1 28 . 1 1 14 14 LEU H H 14 7.781 7.781 7.390 0.391 19668 10065 1 28 . 1 1 15 15 GLU N N 15 120.632 120.632 118.877 1.755 19668 10066 1 28 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.381 -0.014 19668 10067 1 28 . 1 1 15 15 GLU C C 15 178.243 178.243 178.700 -0.457 19668 10068 1 28 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.572 1.014 19668 10069 1 28 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.047 0.782 19668 10070 1 28 . 1 1 15 15 GLU H H 15 7.873 7.873 7.336 0.537 19668 10071 1 28 . 1 1 16 16 GLU N N 16 115.775 115.775 117.210 -1.435 19668 10072 1 28 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.991 -0.032 19668 10073 1 28 . 1 1 16 16 GLU C C 16 179.006 179.006 178.654 0.352 19668 10074 1 28 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.825 0.267 19668 10075 1 28 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.379 -0.026 19668 10076 1 28 . 1 1 16 16 GLU H H 16 7.926 7.926 7.710 0.216 19668 10077 1 28 . 1 1 17 17 LYS N N 17 118.801 118.801 119.151 -0.350 19668 10078 1 28 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.067 0.027 19668 10079 1 28 . 1 1 17 17 LYS C C 17 178.853 178.853 178.215 0.638 19668 10080 1 28 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.830 -0.358 19668 10081 1 28 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.868 0.494 19668 10082 1 28 . 1 1 17 17 LYS H H 17 7.518 7.518 7.348 0.170 19668 10083 1 28 . 1 1 18 18 VAL N N 18 118.034 118.034 118.979 -0.945 19668 10084 1 28 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.780 -0.268 19668 10085 1 28 . 1 1 18 18 VAL C C 18 178.362 178.362 178.481 -0.119 19668 10086 1 28 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.245 0.774 19668 10087 1 28 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.276 0.373 19668 10088 1 28 . 1 1 18 18 VAL H H 18 8.048 8.048 7.442 0.606 19668 10089 1 28 . 1 1 19 19 LYS N N 19 118.427 118.427 119.191 -0.764 19668 10090 1 28 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.125 -0.115 19668 10091 1 28 . 1 1 19 19 LYS C C 19 177.706 177.706 178.177 -0.471 19668 10092 1 28 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.926 0.059 19668 10093 1 28 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.547 0.877 19668 10094 1 28 . 1 1 19 19 LYS H H 19 8.008 8.008 7.575 0.433 19668 10095 1 28 . 1 1 20 20 ALA N N 20 119.177 119.177 120.133 -0.956 19668 10096 1 28 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.291 0.025 19668 10097 1 28 . 1 1 20 20 ALA C C 20 178.269 178.269 178.320 -0.051 19668 10098 1 28 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.885 -0.254 19668 10099 1 28 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.646 0.487 19668 10100 1 28 . 1 1 20 20 ALA H H 20 7.259 7.259 7.437 -0.178 19668 10101 1 28 . 1 1 21 21 LEU N N 21 118.596 118.596 117.484 1.112 19668 10102 1 28 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.066 0.195 19668 10103 1 28 . 1 1 21 21 LEU C C 21 177.732 177.732 177.283 0.449 19668 10104 1 28 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.100 -0.443 19668 10105 1 28 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.382 0.751 19668 10106 1 28 . 1 1 21 21 LEU H H 21 7.373 7.373 7.558 -0.185 19668 10107 1 28 . 1 1 22 22 GLY N N 22 107.926 107.926 105.880 2.046 19668 10108 1 28 . 1 1 22 22 GLY C C 22 173.362 173.362 173.574 -0.212 19668 10109 1 28 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.683 0.514 19668 10110 1 28 . 1 1 22 22 GLY H H 22 8.144 8.144 7.421 0.723 19668 10111 1 28 . 1 1 23 23 GLY N N 23 108.242 108.242 108.050 0.192 19668 10112 1 28 . 1 1 23 23 GLY C C 23 174.110 174.110 173.619 0.491 19668 10113 1 28 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.739 -0.055 19668 10114 1 28 . 1 1 23 23 GLY H H 23 8.157 8.157 7.827 0.330 19668 10115 1 28 . 1 1 24 24 GLY N N 24 106.969 106.969 108.100 -1.131 19668 10116 1 28 . 1 1 24 24 GLY C C 24 175.172 175.172 174.895 0.277 19668 10117 1 28 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.701 -0.262 19668 10118 1 28 . 1 1 24 24 GLY H H 24 8.466 8.466 8.287 0.179 19668 10119 1 28 . 1 1 25 25 GLY N N 25 108.946 108.946 110.194 -1.248 19668 10120 1 28 . 1 1 25 25 GLY C C 25 176.321 176.321 175.337 0.984 19668 10121 1 28 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.339 1.760 19668 10122 1 28 . 1 1 25 25 GLY H H 25 8.618 8.618 7.976 0.642 19668 10123 1 28 . 1 1 26 26 ARG N N 26 123.559 123.559 122.605 0.954 19668 10124 1 28 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.212 0.067 19668 10125 1 28 . 1 1 26 26 ARG C C 26 178.076 178.076 178.038 0.038 19668 10126 1 28 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.798 -0.883 19668 10127 1 28 . 1 1 26 26 ARG CB C 26 29.910 29.910 29.826 0.083 19668 10128 1 28 . 1 1 26 26 ARG H H 26 8.789 8.789 8.507 0.282 19668 10129 1 28 . 1 1 27 27 ILE N N 27 118.726 118.726 119.305 -0.579 19668 10130 1 28 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.869 -0.083 19668 10131 1 28 . 1 1 27 27 ILE C C 27 177.639 177.639 178.059 -0.420 19668 10132 1 28 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.572 -0.948 19668 10133 1 28 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.048 -0.093 19668 10134 1 28 . 1 1 27 27 ILE H H 27 7.762 7.762 8.074 -0.312 19668 10135 1 28 . 1 1 28 28 GLU N N 28 119.843 119.843 118.523 1.320 19668 10136 1 28 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.066 -0.053 19668 10137 1 28 . 1 1 28 28 GLU C C 28 179.447 179.447 179.198 0.249 19668 10138 1 28 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.754 -0.171 19668 10139 1 28 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.782 0.278 19668 10140 1 28 . 1 1 28 28 GLU H H 28 7.867 7.867 8.765 -0.898 19668 10141 1 28 . 1 1 29 29 GLU N N 29 118.447 118.447 119.179 -0.732 19668 10142 1 28 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.112 -0.025 19668 10143 1 28 . 1 1 29 29 GLU C C 29 179.310 179.310 178.899 0.411 19668 10144 1 28 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.613 0.667 19668 10145 1 28 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.224 0.112 19668 10146 1 28 . 1 1 29 29 GLU H H 29 7.755 7.755 7.796 -0.041 19668 10147 1 28 . 1 1 30 30 LEU N N 30 121.135 121.135 121.635 -0.500 19668 10148 1 28 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.994 0.102 19668 10149 1 28 . 1 1 30 30 LEU C C 30 178.928 178.928 178.739 0.189 19668 10150 1 28 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.292 -0.187 19668 10151 1 28 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.146 -0.466 19668 10152 1 28 . 1 1 30 30 LEU H H 30 7.785 7.785 7.624 0.161 19668 10153 1 28 . 1 1 31 31 LYS N N 31 119.130 119.130 117.733 1.397 19668 10154 1 28 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.084 -0.214 19668 10155 1 28 . 1 1 31 31 LYS C C 31 179.104 179.104 178.955 0.149 19668 10156 1 28 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.443 1.273 19668 10157 1 28 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.793 0.463 19668 10158 1 28 . 1 1 31 31 LYS H H 31 8.413 8.413 7.652 0.761 19668 10159 1 28 . 1 1 32 32 LYS N N 32 119.200 119.200 119.701 -0.501 19668 10160 1 28 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.987 0.115 19668 10161 1 28 . 1 1 32 32 LYS C C 32 179.420 179.420 179.074 0.346 19668 10162 1 28 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.443 0.014 19668 10163 1 28 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.223 0.043 19668 10164 1 28 . 1 1 32 32 LYS H H 32 7.826 7.826 7.511 0.315 19668 10165 1 28 . 1 1 33 33 LYS N N 33 120.322 120.322 119.106 1.216 19668 10166 1 28 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.038 0.125 19668 10167 1 28 . 1 1 33 33 LYS C C 33 179.174 179.174 178.994 0.180 19668 10168 1 28 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.006 -0.258 19668 10169 1 28 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.297 -0.558 19668 10170 1 28 . 1 1 33 33 LYS H H 33 8.003 8.003 7.511 0.492 19668 10171 1 28 . 1 1 34 34 TYR N N 34 120.223 120.223 118.907 1.316 19668 10172 1 28 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.129 -0.073 19668 10173 1 28 . 1 1 34 34 TYR C C 34 176.356 176.356 178.485 -2.129 19668 10174 1 28 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.787 -0.732 19668 10175 1 28 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.370 -0.343 19668 10176 1 28 . 1 1 34 34 TYR H H 34 8.614 8.614 7.605 1.009 19668 10177 1 28 . 1 1 35 35 GLU N N 35 118.813 118.813 118.504 0.309 19668 10178 1 28 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.935 -0.210 19668 10179 1 28 . 1 1 35 35 GLU C C 35 179.787 179.787 178.084 1.703 19668 10180 1 28 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.718 -0.279 19668 10181 1 28 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.831 0.297 19668 10182 1 28 . 1 1 35 35 GLU H H 35 8.103 8.103 7.976 0.127 19668 10183 1 28 . 1 1 36 36 GLU N N 36 119.670 119.670 119.512 0.158 19668 10184 1 28 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.073 -0.059 19668 10185 1 28 . 1 1 36 36 GLU C C 36 179.295 179.295 178.915 0.380 19668 10186 1 28 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.091 0.172 19668 10187 1 28 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.581 -0.012 19668 10188 1 28 . 1 1 36 36 GLU H H 36 8.028 8.028 7.675 0.353 19668 10189 1 28 . 1 1 37 37 LEU N N 37 121.416 121.416 120.127 1.289 19668 10190 1 28 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.984 0.035 19668 10191 1 28 . 1 1 37 37 LEU C C 37 178.277 178.277 178.971 -0.694 19668 10192 1 28 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.805 0.035 19668 10193 1 28 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.409 0.220 19668 10194 1 28 . 1 1 37 37 LEU H H 37 8.176 8.176 7.411 0.765 19668 10195 1 28 . 1 1 38 38 LYS N N 38 118.998 118.998 118.234 0.764 19668 10196 1 28 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.944 -0.284 19668 10197 1 28 . 1 1 38 38 LYS C C 38 178.923 178.923 178.936 -0.013 19668 10198 1 28 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.966 0.434 19668 10199 1 28 . 1 1 38 38 LYS CB C 38 32.062 32.062 31.997 0.066 19668 10200 1 28 . 1 1 38 38 LYS H H 38 8.260 8.260 7.623 0.637 19668 10201 1 28 . 1 1 39 39 LYS N N 39 118.070 118.070 118.202 -0.132 19668 10202 1 28 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.035 0.045 19668 10203 1 28 . 1 1 39 39 LYS C C 39 178.687 178.687 178.755 -0.068 19668 10204 1 28 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.399 -0.463 19668 10205 1 28 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.156 -0.007 19668 10206 1 28 . 1 1 39 39 LYS H H 39 7.380 7.380 7.716 -0.336 19668 10207 1 28 . 1 1 40 40 LYS N N 40 118.894 118.894 119.838 -0.944 19668 10208 1 28 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.049 0.010 19668 10209 1 28 . 1 1 40 40 LYS C C 40 179.758 179.758 179.126 0.632 19668 10210 1 28 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.249 -0.187 19668 10211 1 28 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.287 0.101 19668 10212 1 28 . 1 1 40 40 LYS H H 40 7.919 7.919 7.391 0.528 19668 10213 1 28 . 1 1 41 41 ILE N N 41 118.270 118.270 118.783 -0.513 19668 10214 1 28 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.767 -0.070 19668 10215 1 28 . 1 1 41 41 ILE C C 41 178.211 178.211 178.221 -0.010 19668 10216 1 28 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.774 -0.060 19668 10217 1 28 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.695 0.144 19668 10218 1 28 . 1 1 41 41 ILE H H 41 8.199 8.199 7.569 0.630 19668 10219 1 28 . 1 1 42 42 GLU N N 42 120.117 120.117 118.368 1.749 19668 10220 1 28 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.062 0.029 19668 10221 1 28 . 1 1 42 42 GLU C C 42 178.736 178.736 177.451 1.285 19668 10222 1 28 . 1 1 42 42 GLU CA C 42 58.880 58.880 59.043 -0.163 19668 10223 1 28 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.665 -0.274 19668 10224 1 28 . 1 1 42 42 GLU H H 42 7.738 7.738 7.566 0.172 19668 10225 1 28 . 1 1 43 43 GLU N N 43 117.194 117.194 116.651 0.543 19668 10226 1 28 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.180 0.119 19668 10227 1 28 . 1 1 43 43 GLU C C 43 177.658 177.658 176.661 0.997 19668 10228 1 28 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.730 0.063 19668 10229 1 28 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.172 -0.238 19668 10230 1 28 . 1 1 43 43 GLU H H 43 7.698 7.698 7.506 0.192 19668 10231 1 28 . 1 1 44 44 LEU N N 44 120.812 120.812 120.945 -0.133 19668 10232 1 28 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.110 0.129 19668 10233 1 28 . 1 1 44 44 LEU C C 44 178.682 178.682 177.392 1.290 19668 10234 1 28 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.511 0.985 19668 10235 1 28 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.266 0.381 19668 10236 1 28 . 1 1 44 44 LEU H H 44 7.593 7.593 7.201 0.392 19668 10237 1 28 . 1 1 45 45 GLY N N 45 108.681 108.681 112.963 -4.282 19668 10238 1 28 . 1 1 45 45 GLY C C 45 174.957 174.957 174.402 0.555 19668 10239 1 28 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.088 0.998 19668 10240 1 28 . 1 1 45 45 GLY H H 45 8.234 8.234 8.202 0.032 19668 10241 1 28 . 1 1 46 46 GLY N N 46 108.057 108.057 109.487 -1.430 19668 10242 1 28 . 1 1 46 46 GLY C C 46 174.777 174.777 174.632 0.145 19668 10243 1 28 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.047 1.317 19668 10244 1 28 . 1 1 46 46 GLY H H 46 8.182 8.182 8.133 0.049 19668 10245 1 28 . 1 1 47 47 GLY N N 47 108.494 108.494 106.050 2.444 19668 10246 1 28 . 1 1 47 47 GLY C C 47 174.572 174.572 174.491 0.081 19668 10247 1 28 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.836 0.319 19668 10248 1 28 . 1 1 47 47 GLY H H 47 8.087 8.087 8.329 -0.242 19668 10249 1 28 . 1 1 48 48 GLY N N 48 108.285 108.285 109.868 -1.583 19668 10250 1 28 . 1 1 48 48 GLY C C 48 174.495 174.495 175.510 -1.015 19668 10251 1 28 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.289 0.165 19668 10252 1 28 . 1 1 48 48 GLY H H 48 8.323 8.323 8.448 -0.125 19668 10253 1 28 . 1 1 49 49 GLU N N 49 121.070 121.070 121.569 -0.499 19668 10254 1 28 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.341 0.076 19668 10255 1 28 . 1 1 49 49 GLU C C 49 177.226 177.226 177.709 -0.483 19668 10256 1 28 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.696 -1.125 19668 10257 1 28 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.681 -0.015 19668 10258 1 28 . 1 1 49 49 GLU H H 49 8.483 8.483 8.147 0.336 19668 10259 1 28 . 1 1 50 50 VAL N N 50 121.794 121.794 117.282 4.512 19668 10260 1 28 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.740 0.041 19668 10261 1 28 . 1 1 50 50 VAL C C 50 176.860 176.860 177.773 -0.913 19668 10262 1 28 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.888 -0.808 19668 10263 1 28 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.012 1.241 19668 10264 1 28 . 1 1 50 50 VAL H H 50 8.068 8.068 8.282 -0.214 19668 10265 1 28 . 1 1 51 51 LYS N N 51 120.593 120.593 119.109 1.484 19668 10266 1 28 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.392 -0.185 19668 10267 1 28 . 1 1 51 51 LYS C C 51 178.667 178.667 178.842 -0.175 19668 10268 1 28 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.183 0.152 19668 10269 1 28 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.969 0.289 19668 10270 1 28 . 1 1 51 51 LYS H H 51 8.253 8.253 8.132 0.121 19668 10271 1 28 . 1 1 52 52 LYS N N 52 117.572 117.572 120.910 -3.338 19668 10272 1 28 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.016 0.152 19668 10273 1 28 . 1 1 52 52 LYS C C 52 179.248 179.248 178.719 0.529 19668 10274 1 28 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.722 -0.708 19668 10275 1 28 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.277 -0.097 19668 10276 1 28 . 1 1 52 52 LYS H H 52 7.629 7.629 7.615 0.014 19668 10277 1 28 . 1 1 53 53 VAL N N 53 119.059 119.059 118.580 0.479 19668 10278 1 28 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.640 0.152 19668 10279 1 28 . 1 1 53 53 VAL C C 53 177.987 177.987 177.864 0.123 19668 10280 1 28 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.629 -0.598 19668 10281 1 28 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.372 -0.001 19668 10282 1 28 . 1 1 53 53 VAL H H 53 7.638 7.638 7.532 0.106 19668 10283 1 28 . 1 1 54 54 GLU N N 54 120.388 120.388 118.629 1.759 19668 10284 1 28 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.925 -0.081 19668 10285 1 28 . 1 1 54 54 GLU C C 54 179.624 179.624 178.796 0.828 19668 10286 1 28 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.775 0.466 19668 10287 1 28 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.146 0.672 19668 10288 1 28 . 1 1 54 54 GLU H H 54 8.603 8.603 7.720 0.883 19668 10289 1 28 . 1 1 55 55 GLU N N 55 118.533 118.533 118.877 -0.344 19668 10290 1 28 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.052 0.037 19668 10291 1 28 . 1 1 55 55 GLU C C 55 179.158 179.158 178.783 0.375 19668 10292 1 28 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.710 -0.376 19668 10293 1 28 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.384 -0.048 19668 10294 1 28 . 1 1 55 55 GLU H H 55 7.904 7.904 7.579 0.325 19668 10295 1 28 . 1 1 56 56 GLU N N 56 120.258 120.258 119.166 1.092 19668 10296 1 28 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.023 0.077 19668 10297 1 28 . 1 1 56 56 GLU C C 56 179.867 179.867 179.177 0.690 19668 10298 1 28 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.190 0.473 19668 10299 1 28 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.067 0.983 19668 10300 1 28 . 1 1 56 56 GLU H H 56 7.902 7.902 7.521 0.381 19668 10301 1 28 . 1 1 57 57 VAL N N 57 121.168 121.168 119.918 1.250 19668 10302 1 28 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.525 0.043 19668 10303 1 28 . 1 1 57 57 VAL C C 57 176.994 176.994 177.299 -0.305 19668 10304 1 28 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.422 1.474 19668 10305 1 28 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.669 -0.142 19668 10306 1 28 . 1 1 57 57 VAL H H 57 8.613 8.613 7.509 1.104 19668 10307 1 28 . 1 1 58 58 LYS N N 58 120.234 120.234 118.236 1.998 19668 10308 1 28 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.981 0.221 19668 10309 1 28 . 1 1 58 58 LYS C C 58 179.131 179.131 178.786 0.345 19668 10310 1 28 . 1 1 58 58 LYS CA C 58 59.587 59.587 58.915 0.672 19668 10311 1 28 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.888 0.403 19668 10312 1 28 . 1 1 58 58 LYS H H 58 7.810 7.810 7.522 0.288 19668 10313 1 28 . 1 1 59 59 LYS N N 59 118.301 118.301 118.831 -0.530 19668 10314 1 28 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.020 0.073 19668 10315 1 28 . 1 1 59 59 LYS C C 59 179.281 179.281 178.485 0.796 19668 10316 1 28 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.108 0.320 19668 10317 1 28 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.080 0.300 19668 10318 1 28 . 1 1 59 59 LYS H H 59 7.876 7.876 7.420 0.456 19668 10319 1 28 . 1 1 60 60 LEU N N 60 121.224 121.224 120.179 1.045 19668 10320 1 28 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.004 0.230 19668 10321 1 28 . 1 1 60 60 LEU C C 60 178.636 178.636 178.715 -0.079 19668 10322 1 28 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.733 0.424 19668 10323 1 28 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.290 0.344 19668 10324 1 28 . 1 1 60 60 LEU H H 60 7.893 7.893 7.671 0.222 19668 10325 1 28 . 1 1 61 61 GLU N N 61 118.660 118.660 118.290 0.370 19668 10326 1 28 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.058 -0.259 19668 10327 1 28 . 1 1 61 61 GLU C C 61 179.094 179.094 178.706 0.388 19668 10328 1 28 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.079 1.193 19668 10329 1 28 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.508 1.495 19668 10330 1 28 . 1 1 61 61 GLU H H 61 8.644 8.644 7.818 0.826 19668 10331 1 28 . 1 1 62 62 GLU N N 62 117.555 117.555 118.787 -1.232 19668 10332 1 28 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.008 -0.012 19668 10333 1 28 . 1 1 62 62 GLU C C 62 178.940 178.940 178.951 -0.011 19668 10334 1 28 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.424 -0.256 19668 10335 1 28 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.343 0.204 19668 10336 1 28 . 1 1 62 62 GLU H H 62 7.995 7.995 7.660 0.335 19668 10337 1 28 . 1 1 63 63 GLU N N 63 119.097 119.097 118.155 0.942 19668 10338 1 28 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.174 -0.145 19668 10339 1 28 . 1 1 63 63 GLU C C 63 179.890 179.890 178.867 1.023 19668 10340 1 28 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.381 0.960 19668 10341 1 28 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.023 0.645 19668 10342 1 28 . 1 1 63 63 GLU H H 63 7.983 7.983 7.638 0.345 19668 10343 1 28 . 1 1 64 64 ILE N N 64 118.247 118.247 118.526 -0.279 19668 10344 1 28 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.793 -0.073 19668 10345 1 28 . 1 1 64 64 ILE C C 64 177.858 177.858 177.692 0.166 19668 10346 1 28 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.332 0.164 19668 10347 1 28 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.571 0.410 19668 10348 1 28 . 1 1 64 64 ILE H H 64 8.261 8.261 7.313 0.948 19668 10349 1 28 . 1 1 65 65 LYS N N 65 118.693 118.693 118.391 0.302 19668 10350 1 28 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.183 -0.085 19668 10351 1 28 . 1 1 65 65 LYS C C 65 177.244 177.244 177.569 -0.325 19668 10352 1 28 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.256 0.397 19668 10353 1 28 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.140 0.565 19668 10354 1 28 . 1 1 65 65 LYS H H 65 7.661 7.661 7.646 0.015 19668 10355 1 28 . 1 1 66 66 LYS N N 66 116.933 116.933 117.482 -0.549 19668 10356 1 28 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.153 0.185 19668 10357 1 28 . 1 1 66 66 LYS C C 66 176.011 176.011 176.998 -0.987 19668 10358 1 28 . 1 1 66 66 LYS CA C 66 56.459 56.459 58.066 -1.607 19668 10359 1 28 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.645 0.486 19668 10360 1 28 . 1 1 66 66 LYS H H 66 7.261 7.261 7.680 -0.419 19668 10361 1 29 . 1 1 2 2 SER HA H 2 4.560 4.560 4.628 -0.068 19668 10362 1 29 . 1 1 2 2 SER CA C 2 58.366 58.366 59.888 -1.522 19668 10363 1 29 . 1 1 3 3 ARG N N 3 125.213 125.213 120.021 5.192 19668 10364 1 29 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.407 -0.141 19668 10365 1 29 . 1 1 3 3 ARG C C 3 178.381 178.381 177.496 0.885 19668 10366 1 29 . 1 1 3 3 ARG CA C 3 58.396 58.396 57.726 0.670 19668 10367 1 29 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.884 0.772 19668 10368 1 29 . 1 1 3 3 ARG H H 3 8.874 8.874 8.361 0.513 19668 10369 1 29 . 1 1 4 4 VAL N N 4 119.320 119.320 120.003 -0.683 19668 10370 1 29 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.871 -0.073 19668 10371 1 29 . 1 1 4 4 VAL C C 4 177.004 177.004 177.568 -0.564 19668 10372 1 29 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.475 0.040 19668 10373 1 29 . 1 1 4 4 VAL CB C 4 31.803 31.803 30.976 0.827 19668 10374 1 29 . 1 1 4 4 VAL H H 4 8.112 8.112 8.250 -0.138 19668 10375 1 29 . 1 1 5 5 LYS N N 5 122.279 122.279 120.574 1.705 19668 10376 1 29 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.019 0.143 19668 10377 1 29 . 1 1 5 5 LYS C C 5 178.547 178.547 177.942 0.605 19668 10378 1 29 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.913 -0.155 19668 10379 1 29 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.617 0.393 19668 10380 1 29 . 1 1 5 5 LYS H H 5 7.847 7.847 8.159 -0.312 19668 10381 1 29 . 1 1 6 6 ALA N N 6 120.295 120.295 120.857 -0.562 19668 10382 1 29 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.057 0.154 19668 10383 1 29 . 1 1 6 6 ALA C C 6 180.834 180.834 179.307 1.527 19668 10384 1 29 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.040 -0.137 19668 10385 1 29 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.836 0.296 19668 10386 1 29 . 1 1 6 6 ALA H H 6 7.975 7.975 8.038 -0.063 19668 10387 1 29 . 1 1 7 7 LEU N N 7 119.570 119.570 118.630 0.940 19668 10388 1 29 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.070 0.102 19668 10389 1 29 . 1 1 7 7 LEU C C 7 178.431 178.431 178.726 -0.295 19668 10390 1 29 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.945 -0.266 19668 10391 1 29 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.124 0.911 19668 10392 1 29 . 1 1 7 7 LEU H H 7 7.650 7.650 7.545 0.105 19668 10393 1 29 . 1 1 8 8 GLU N N 8 119.934 119.934 118.372 1.562 19668 10394 1 29 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.055 -0.196 19668 10395 1 29 . 1 1 8 8 GLU C C 8 179.534 179.534 178.629 0.905 19668 10396 1 29 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.363 0.674 19668 10397 1 29 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.756 0.711 19668 10398 1 29 . 1 1 8 8 GLU H H 8 8.411 8.411 7.848 0.563 19668 10399 1 29 . 1 1 9 9 GLU N N 9 118.234 118.234 119.047 -0.813 19668 10400 1 29 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.087 -0.027 19668 10401 1 29 . 1 1 9 9 GLU C C 9 179.596 179.596 178.896 0.700 19668 10402 1 29 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.321 0.009 19668 10403 1 29 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.382 0.036 19668 10404 1 29 . 1 1 9 9 GLU H H 9 8.206 8.206 7.714 0.492 19668 10405 1 29 . 1 1 10 10 LYS N N 10 121.042 121.042 118.931 2.111 19668 10406 1 29 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.160 0.023 19668 10407 1 29 . 1 1 10 10 LYS C C 10 179.380 179.380 179.147 0.233 19668 10408 1 29 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.130 0.195 19668 10409 1 29 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.139 0.270 19668 10410 1 29 . 1 1 10 10 LYS H H 10 7.931 7.931 7.559 0.372 19668 10411 1 29 . 1 1 11 11 VAL N N 11 118.662 118.662 119.991 -1.329 19668 10412 1 29 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.823 -0.009 19668 10413 1 29 . 1 1 11 11 VAL C C 11 178.845 178.845 178.049 0.796 19668 10414 1 29 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.202 0.786 19668 10415 1 29 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.646 0.008 19668 10416 1 29 . 1 1 11 11 VAL H H 11 8.371 8.371 7.579 0.792 19668 10417 1 29 . 1 1 12 12 LYS N N 12 123.188 123.188 119.752 3.436 19668 10418 1 29 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.959 0.267 19668 10419 1 29 . 1 1 12 12 LYS C C 12 179.098 179.098 178.369 0.729 19668 10420 1 29 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.362 0.121 19668 10421 1 29 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.338 -0.132 19668 10422 1 29 . 1 1 12 12 LYS H H 12 8.276 8.276 7.531 0.745 19668 10423 1 29 . 1 1 13 13 ALA N N 13 121.169 121.169 121.597 -0.428 19668 10424 1 29 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.064 0.194 19668 10425 1 29 . 1 1 13 13 ALA C C 13 180.169 180.169 179.696 0.473 19668 10426 1 29 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.810 -0.174 19668 10427 1 29 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.188 -0.081 19668 10428 1 29 . 1 1 13 13 ALA H H 13 7.829 7.829 7.483 0.346 19668 10429 1 29 . 1 1 14 14 LEU N N 14 118.104 118.104 118.480 -0.376 19668 10430 1 29 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.926 0.230 19668 10431 1 29 . 1 1 14 14 LEU C C 14 177.614 177.614 178.163 -0.549 19668 10432 1 29 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.105 -0.500 19668 10433 1 29 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.975 0.820 19668 10434 1 29 . 1 1 14 14 LEU H H 14 7.781 7.781 7.387 0.394 19668 10435 1 29 . 1 1 15 15 GLU N N 15 120.632 120.632 119.035 1.597 19668 10436 1 29 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.388 -0.021 19668 10437 1 29 . 1 1 15 15 GLU C C 15 178.243 178.243 178.592 -0.349 19668 10438 1 29 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.542 1.044 19668 10439 1 29 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.009 0.820 19668 10440 1 29 . 1 1 15 15 GLU H H 15 7.873 7.873 7.292 0.581 19668 10441 1 29 . 1 1 16 16 GLU N N 16 115.775 115.775 117.172 -1.397 19668 10442 1 29 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.969 -0.010 19668 10443 1 29 . 1 1 16 16 GLU C C 16 179.006 179.006 178.777 0.229 19668 10444 1 29 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.937 0.155 19668 10445 1 29 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.374 -0.021 19668 10446 1 29 . 1 1 16 16 GLU H H 16 7.926 7.926 7.711 0.215 19668 10447 1 29 . 1 1 17 17 LYS N N 17 118.801 118.801 118.527 0.274 19668 10448 1 29 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.090 0.004 19668 10449 1 29 . 1 1 17 17 LYS C C 17 178.853 178.853 178.395 0.458 19668 10450 1 29 . 1 1 17 17 LYS CA C 17 58.471 58.471 59.121 -0.650 19668 10451 1 29 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.911 0.451 19668 10452 1 29 . 1 1 17 17 LYS H H 17 7.518 7.518 7.588 -0.070 19668 10453 1 29 . 1 1 18 18 VAL N N 18 118.034 118.034 118.961 -0.927 19668 10454 1 29 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.750 -0.238 19668 10455 1 29 . 1 1 18 18 VAL C C 18 178.362 178.362 178.518 -0.156 19668 10456 1 29 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.806 0.213 19668 10457 1 29 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.278 0.371 19668 10458 1 29 . 1 1 18 18 VAL H H 18 8.048 8.048 7.200 0.848 19668 10459 1 29 . 1 1 19 19 LYS N N 19 118.427 118.427 119.960 -1.533 19668 10460 1 29 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.098 -0.088 19668 10461 1 29 . 1 1 19 19 LYS C C 19 177.706 177.706 178.721 -1.015 19668 10462 1 29 . 1 1 19 19 LYS CA C 19 58.985 58.985 59.030 -0.045 19668 10463 1 29 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.667 0.757 19668 10464 1 29 . 1 1 19 19 LYS H H 19 8.008 8.008 7.615 0.393 19668 10465 1 29 . 1 1 20 20 ALA N N 20 119.177 119.177 120.119 -0.942 19668 10466 1 29 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.206 0.110 19668 10467 1 29 . 1 1 20 20 ALA C C 20 178.269 178.269 178.248 0.021 19668 10468 1 29 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.386 -0.755 19668 10469 1 29 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.318 0.815 19668 10470 1 29 . 1 1 20 20 ALA H H 20 7.259 7.259 7.413 -0.154 19668 10471 1 29 . 1 1 21 21 LEU N N 21 118.596 118.596 117.159 1.437 19668 10472 1 29 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.062 0.199 19668 10473 1 29 . 1 1 21 21 LEU C C 21 177.732 177.732 177.313 0.419 19668 10474 1 29 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.915 -0.258 19668 10475 1 29 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.432 0.701 19668 10476 1 29 . 1 1 21 21 LEU H H 21 7.373 7.373 7.488 -0.115 19668 10477 1 29 . 1 1 22 22 GLY N N 22 107.926 107.926 105.772 2.154 19668 10478 1 29 . 1 1 22 22 GLY C C 22 173.362 173.362 173.356 0.006 19668 10479 1 29 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.866 0.331 19668 10480 1 29 . 1 1 22 22 GLY H H 22 8.144 8.144 7.503 0.641 19668 10481 1 29 . 1 1 23 23 GLY N N 23 108.242 108.242 107.956 0.286 19668 10482 1 29 . 1 1 23 23 GLY C C 23 174.110 174.110 172.952 1.158 19668 10483 1 29 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.930 -0.246 19668 10484 1 29 . 1 1 23 23 GLY H H 23 8.157 8.157 7.839 0.318 19668 10485 1 29 . 1 1 24 24 GLY N N 24 106.969 106.969 110.362 -3.393 19668 10486 1 29 . 1 1 24 24 GLY C C 24 175.172 175.172 174.139 1.033 19668 10487 1 29 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.953 -0.514 19668 10488 1 29 . 1 1 24 24 GLY H H 24 8.466 8.466 7.947 0.519 19668 10489 1 29 . 1 1 25 25 GLY N N 25 108.946 108.946 113.204 -4.258 19668 10490 1 29 . 1 1 25 25 GLY C C 25 176.321 176.321 174.510 1.811 19668 10491 1 29 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.497 1.602 19668 10492 1 29 . 1 1 25 25 GLY H H 25 8.618 8.618 8.306 0.312 19668 10493 1 29 . 1 1 26 26 ARG N N 26 123.559 123.559 124.468 -0.909 19668 10494 1 29 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.338 -0.059 19668 10495 1 29 . 1 1 26 26 ARG C C 26 178.076 178.076 177.997 0.079 19668 10496 1 29 . 1 1 26 26 ARG CA C 26 57.915 57.915 57.438 0.478 19668 10497 1 29 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.664 -0.754 19668 10498 1 29 . 1 1 26 26 ARG H H 26 8.789 8.789 8.437 0.352 19668 10499 1 29 . 1 1 27 27 ILE N N 27 118.726 118.726 119.795 -1.069 19668 10500 1 29 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.685 0.101 19668 10501 1 29 . 1 1 27 27 ILE C C 27 177.639 177.639 177.157 0.482 19668 10502 1 29 . 1 1 27 27 ILE CA C 27 63.624 63.624 65.369 -1.745 19668 10503 1 29 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.497 -0.542 19668 10504 1 29 . 1 1 27 27 ILE H H 27 7.762 7.762 8.022 -0.260 19668 10505 1 29 . 1 1 28 28 GLU N N 28 119.843 119.843 119.105 0.738 19668 10506 1 29 . 1 1 28 28 GLU HA H 28 4.013 4.013 3.997 0.016 19668 10507 1 29 . 1 1 28 28 GLU C C 28 179.447 179.447 178.823 0.624 19668 10508 1 29 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.413 0.171 19668 10509 1 29 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.721 0.339 19668 10510 1 29 . 1 1 28 28 GLU H H 28 7.867 7.867 8.747 -0.880 19668 10511 1 29 . 1 1 29 29 GLU N N 29 118.447 118.447 119.872 -1.425 19668 10512 1 29 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.026 0.061 19668 10513 1 29 . 1 1 29 29 GLU C C 29 179.310 179.310 179.118 0.192 19668 10514 1 29 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.562 0.718 19668 10515 1 29 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.415 -0.079 19668 10516 1 29 . 1 1 29 29 GLU H H 29 7.755 7.755 7.641 0.114 19668 10517 1 29 . 1 1 30 30 LEU N N 30 121.135 121.135 119.894 1.241 19668 10518 1 29 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.013 0.083 19668 10519 1 29 . 1 1 30 30 LEU C C 30 178.928 178.928 178.456 0.472 19668 10520 1 29 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.257 -0.152 19668 10521 1 29 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.086 -0.406 19668 10522 1 29 . 1 1 30 30 LEU H H 30 7.785 7.785 7.611 0.174 19668 10523 1 29 . 1 1 31 31 LYS N N 31 119.130 119.130 117.819 1.311 19668 10524 1 29 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.099 -0.229 19668 10525 1 29 . 1 1 31 31 LYS C C 31 179.104 179.104 178.998 0.106 19668 10526 1 29 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.354 1.362 19668 10527 1 29 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.843 0.413 19668 10528 1 29 . 1 1 31 31 LYS H H 31 8.413 8.413 7.588 0.825 19668 10529 1 29 . 1 1 32 32 LYS N N 32 119.200 119.200 119.419 -0.219 19668 10530 1 29 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.009 0.093 19668 10531 1 29 . 1 1 32 32 LYS C C 32 179.420 179.420 179.148 0.272 19668 10532 1 29 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.341 0.116 19668 10533 1 29 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.162 0.104 19668 10534 1 29 . 1 1 32 32 LYS H H 32 7.826 7.826 7.546 0.280 19668 10535 1 29 . 1 1 33 33 LYS N N 33 120.322 120.322 119.257 1.065 19668 10536 1 29 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.092 0.071 19668 10537 1 29 . 1 1 33 33 LYS C C 33 179.174 179.174 178.745 0.429 19668 10538 1 29 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.089 0.659 19668 10539 1 29 . 1 1 33 33 LYS CB C 33 31.739 31.739 31.892 -0.153 19668 10540 1 29 . 1 1 33 33 LYS H H 33 8.003 8.003 7.510 0.493 19668 10541 1 29 . 1 1 34 34 TYR N N 34 120.223 120.223 119.434 0.789 19668 10542 1 29 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.114 -0.058 19668 10543 1 29 . 1 1 34 34 TYR C C 34 176.356 176.356 178.050 -1.694 19668 10544 1 29 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.844 -0.789 19668 10545 1 29 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.366 -0.339 19668 10546 1 29 . 1 1 34 34 TYR H H 34 8.614 8.614 7.585 1.029 19668 10547 1 29 . 1 1 35 35 GLU N N 35 118.813 118.813 117.315 1.498 19668 10548 1 29 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.967 -0.242 19668 10549 1 29 . 1 1 35 35 GLU C C 35 179.787 179.787 178.951 0.836 19668 10550 1 29 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.978 -0.539 19668 10551 1 29 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.085 0.043 19668 10552 1 29 . 1 1 35 35 GLU H H 35 8.103 8.103 7.825 0.278 19668 10553 1 29 . 1 1 36 36 GLU N N 36 119.670 119.670 119.493 0.177 19668 10554 1 29 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.085 -0.071 19668 10555 1 29 . 1 1 36 36 GLU C C 36 179.295 179.295 179.010 0.285 19668 10556 1 29 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.187 0.076 19668 10557 1 29 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.562 0.007 19668 10558 1 29 . 1 1 36 36 GLU H H 36 8.028 8.028 7.663 0.365 19668 10559 1 29 . 1 1 37 37 LEU N N 37 121.416 121.416 119.824 1.592 19668 10560 1 29 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.018 0.001 19668 10561 1 29 . 1 1 37 37 LEU C C 37 178.277 178.277 179.090 -0.813 19668 10562 1 29 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.979 -0.139 19668 10563 1 29 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.406 0.223 19668 10564 1 29 . 1 1 37 37 LEU H H 37 8.176 8.176 7.402 0.774 19668 10565 1 29 . 1 1 38 38 LYS N N 38 118.998 118.998 118.219 0.779 19668 10566 1 29 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.952 -0.292 19668 10567 1 29 . 1 1 38 38 LYS C C 38 178.923 178.923 178.914 0.009 19668 10568 1 29 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.009 0.391 19668 10569 1 29 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.049 0.013 19668 10570 1 29 . 1 1 38 38 LYS H H 38 8.260 8.260 7.609 0.651 19668 10571 1 29 . 1 1 39 39 LYS N N 39 118.070 118.070 117.543 0.527 19668 10572 1 29 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.046 0.034 19668 10573 1 29 . 1 1 39 39 LYS C C 39 178.687 178.687 178.864 -0.177 19668 10574 1 29 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.669 -0.733 19668 10575 1 29 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.164 -0.015 19668 10576 1 29 . 1 1 39 39 LYS H H 39 7.380 7.380 7.759 -0.379 19668 10577 1 29 . 1 1 40 40 LYS N N 40 118.894 118.894 119.854 -0.960 19668 10578 1 29 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.070 -0.011 19668 10579 1 29 . 1 1 40 40 LYS C C 40 179.758 179.758 179.079 0.679 19668 10580 1 29 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.432 -0.370 19668 10581 1 29 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.197 0.192 19668 10582 1 29 . 1 1 40 40 LYS H H 40 7.919 7.919 7.441 0.478 19668 10583 1 29 . 1 1 41 41 ILE N N 41 118.270 118.270 118.504 -0.234 19668 10584 1 29 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.754 -0.057 19668 10585 1 29 . 1 1 41 41 ILE C C 41 178.211 178.211 176.939 1.272 19668 10586 1 29 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.691 0.023 19668 10587 1 29 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.795 0.044 19668 10588 1 29 . 1 1 41 41 ILE H H 41 8.199 8.199 7.461 0.738 19668 10589 1 29 . 1 1 42 42 GLU N N 42 120.117 120.117 117.500 2.617 19668 10590 1 29 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.022 0.069 19668 10591 1 29 . 1 1 42 42 GLU C C 42 178.736 178.736 177.747 0.989 19668 10592 1 29 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.709 0.171 19668 10593 1 29 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.867 -0.476 19668 10594 1 29 . 1 1 42 42 GLU H H 42 7.738 7.738 7.472 0.266 19668 10595 1 29 . 1 1 43 43 GLU N N 43 117.194 117.194 116.680 0.514 19668 10596 1 29 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.163 0.136 19668 10597 1 29 . 1 1 43 43 GLU C C 43 177.658 177.658 177.363 0.295 19668 10598 1 29 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.273 -0.480 19668 10599 1 29 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.339 -0.406 19668 10600 1 29 . 1 1 43 43 GLU H H 43 7.698 7.698 7.491 0.207 19668 10601 1 29 . 1 1 44 44 LEU N N 44 120.812 120.812 120.609 0.203 19668 10602 1 29 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.201 0.038 19668 10603 1 29 . 1 1 44 44 LEU C C 44 178.682 178.682 177.087 1.595 19668 10604 1 29 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.399 1.097 19668 10605 1 29 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.587 0.060 19668 10606 1 29 . 1 1 44 44 LEU H H 44 7.593 7.593 7.294 0.299 19668 10607 1 29 . 1 1 45 45 GLY N N 45 108.681 108.681 108.995 -0.314 19668 10608 1 29 . 1 1 45 45 GLY C C 45 174.957 174.957 173.618 1.339 19668 10609 1 29 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.628 1.458 19668 10610 1 29 . 1 1 45 45 GLY H H 45 8.234 8.234 8.763 -0.529 19668 10611 1 29 . 1 1 46 46 GLY N N 46 108.057 108.057 107.366 0.691 19668 10612 1 29 . 1 1 46 46 GLY C C 46 174.777 174.777 173.432 1.345 19668 10613 1 29 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.656 0.708 19668 10614 1 29 . 1 1 46 46 GLY H H 46 8.182 8.182 7.752 0.430 19668 10615 1 29 . 1 1 47 47 GLY N N 47 108.494 108.494 106.673 1.821 19668 10616 1 29 . 1 1 47 47 GLY C C 47 174.572 174.572 174.801 -0.229 19668 10617 1 29 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.752 0.403 19668 10618 1 29 . 1 1 47 47 GLY H H 47 8.087 8.087 8.232 -0.145 19668 10619 1 29 . 1 1 48 48 GLY N N 48 108.285 108.285 108.125 0.160 19668 10620 1 29 . 1 1 48 48 GLY C C 48 174.495 174.495 174.019 0.476 19668 10621 1 29 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.182 0.272 19668 10622 1 29 . 1 1 48 48 GLY H H 48 8.323 8.323 8.485 -0.162 19668 10623 1 29 . 1 1 49 49 GLU N N 49 121.070 121.070 120.895 0.175 19668 10624 1 29 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.438 -0.021 19668 10625 1 29 . 1 1 49 49 GLU C C 49 177.226 177.226 177.985 -0.759 19668 10626 1 29 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.097 0.474 19668 10627 1 29 . 1 1 49 49 GLU CB C 49 29.666 29.666 30.004 -0.338 19668 10628 1 29 . 1 1 49 49 GLU H H 49 8.483 8.483 8.224 0.259 19668 10629 1 29 . 1 1 50 50 VAL N N 50 121.794 121.794 119.018 2.776 19668 10630 1 29 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.672 0.109 19668 10631 1 29 . 1 1 50 50 VAL C C 50 176.860 176.860 177.419 -0.559 19668 10632 1 29 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.695 -0.615 19668 10633 1 29 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.164 1.089 19668 10634 1 29 . 1 1 50 50 VAL H H 50 8.068 8.068 8.069 -0.001 19668 10635 1 29 . 1 1 51 51 LYS N N 51 120.593 120.593 120.275 0.318 19668 10636 1 29 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.290 -0.083 19668 10637 1 29 . 1 1 51 51 LYS C C 51 178.667 178.667 178.708 -0.041 19668 10638 1 29 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.037 0.298 19668 10639 1 29 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.494 0.764 19668 10640 1 29 . 1 1 51 51 LYS H H 51 8.253 8.253 8.522 -0.269 19668 10641 1 29 . 1 1 52 52 LYS N N 52 117.572 117.572 119.111 -1.539 19668 10642 1 29 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.061 0.107 19668 10643 1 29 . 1 1 52 52 LYS C C 52 179.248 179.248 178.589 0.659 19668 10644 1 29 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.101 -0.087 19668 10645 1 29 . 1 1 52 52 LYS CB C 52 32.180 32.180 31.826 0.354 19668 10646 1 29 . 1 1 52 52 LYS H H 52 7.629 7.629 7.868 -0.239 19668 10647 1 29 . 1 1 53 53 VAL N N 53 119.059 119.059 120.426 -1.367 19668 10648 1 29 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.810 -0.018 19668 10649 1 29 . 1 1 53 53 VAL C C 53 177.987 177.987 177.835 0.152 19668 10650 1 29 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.753 -0.722 19668 10651 1 29 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.770 -0.399 19668 10652 1 29 . 1 1 53 53 VAL H H 53 7.638 7.638 7.590 0.048 19668 10653 1 29 . 1 1 54 54 GLU N N 54 120.388 120.388 119.164 1.224 19668 10654 1 29 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.944 -0.100 19668 10655 1 29 . 1 1 54 54 GLU C C 54 179.624 179.624 178.991 0.633 19668 10656 1 29 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.773 0.468 19668 10657 1 29 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.231 0.587 19668 10658 1 29 . 1 1 54 54 GLU H H 54 8.603 8.603 7.667 0.936 19668 10659 1 29 . 1 1 55 55 GLU N N 55 118.533 118.533 118.542 -0.009 19668 10660 1 29 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.047 0.042 19668 10661 1 29 . 1 1 55 55 GLU C C 55 179.158 179.158 178.878 0.280 19668 10662 1 29 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.339 -0.005 19668 10663 1 29 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.509 -0.172 19668 10664 1 29 . 1 1 55 55 GLU H H 55 7.904 7.904 7.667 0.237 19668 10665 1 29 . 1 1 56 56 GLU N N 56 120.258 120.258 119.076 1.182 19668 10666 1 29 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.010 0.090 19668 10667 1 29 . 1 1 56 56 GLU C C 56 179.867 179.867 179.057 0.810 19668 10668 1 29 . 1 1 56 56 GLU CA C 56 59.663 59.663 58.786 0.877 19668 10669 1 29 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.145 0.905 19668 10670 1 29 . 1 1 56 56 GLU H H 56 7.902 7.902 7.617 0.285 19668 10671 1 29 . 1 1 57 57 VAL N N 57 121.168 121.168 120.689 0.479 19668 10672 1 29 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.512 0.056 19668 10673 1 29 . 1 1 57 57 VAL C C 57 176.994 176.994 177.235 -0.241 19668 10674 1 29 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.960 0.937 19668 10675 1 29 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.794 -0.267 19668 10676 1 29 . 1 1 57 57 VAL H H 57 8.613 8.613 7.478 1.135 19668 10677 1 29 . 1 1 58 58 LYS N N 58 120.234 120.234 118.167 2.067 19668 10678 1 29 . 1 1 58 58 LYS HA H 58 4.202 4.202 4.000 0.202 19668 10679 1 29 . 1 1 58 58 LYS C C 58 179.131 179.131 178.886 0.245 19668 10680 1 29 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.102 0.485 19668 10681 1 29 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.937 0.354 19668 10682 1 29 . 1 1 58 58 LYS H H 58 7.810 7.810 7.561 0.249 19668 10683 1 29 . 1 1 59 59 LYS N N 59 118.301 118.301 118.815 -0.514 19668 10684 1 29 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.026 0.067 19668 10685 1 29 . 1 1 59 59 LYS C C 59 179.281 179.281 178.435 0.846 19668 10686 1 29 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.138 0.290 19668 10687 1 29 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.083 0.296 19668 10688 1 29 . 1 1 59 59 LYS H H 59 7.876 7.876 7.369 0.507 19668 10689 1 29 . 1 1 60 60 LEU N N 60 121.224 121.224 120.352 0.872 19668 10690 1 29 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.004 0.230 19668 10691 1 29 . 1 1 60 60 LEU C C 60 178.636 178.636 178.650 -0.014 19668 10692 1 29 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.801 0.356 19668 10693 1 29 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.315 0.319 19668 10694 1 29 . 1 1 60 60 LEU H H 60 7.893 7.893 7.624 0.269 19668 10695 1 29 . 1 1 61 61 GLU N N 61 118.660 118.660 117.971 0.689 19668 10696 1 29 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.065 -0.266 19668 10697 1 29 . 1 1 61 61 GLU C C 61 179.094 179.094 178.760 0.334 19668 10698 1 29 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.135 1.137 19668 10699 1 29 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.764 1.239 19668 10700 1 29 . 1 1 61 61 GLU H H 61 8.644 8.644 7.810 0.834 19668 10701 1 29 . 1 1 62 62 GLU N N 62 117.555 117.555 119.509 -1.954 19668 10702 1 29 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.016 -0.020 19668 10703 1 29 . 1 1 62 62 GLU C C 62 178.940 178.940 179.131 -0.191 19668 10704 1 29 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.249 -0.081 19668 10705 1 29 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.156 0.391 19668 10706 1 29 . 1 1 62 62 GLU H H 62 7.995 7.995 7.574 0.421 19668 10707 1 29 . 1 1 63 63 GLU N N 63 119.097 119.097 118.195 0.902 19668 10708 1 29 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.143 -0.114 19668 10709 1 29 . 1 1 63 63 GLU C C 63 179.890 179.890 179.018 0.872 19668 10710 1 29 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.532 0.809 19668 10711 1 29 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.000 0.667 19668 10712 1 29 . 1 1 63 63 GLU H H 63 7.983 7.983 7.730 0.253 19668 10713 1 29 . 1 1 64 64 ILE N N 64 118.247 118.247 118.294 -0.047 19668 10714 1 29 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.830 -0.110 19668 10715 1 29 . 1 1 64 64 ILE C C 64 177.858 177.858 177.896 -0.038 19668 10716 1 29 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.230 0.266 19668 10717 1 29 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.473 0.508 19668 10718 1 29 . 1 1 64 64 ILE H H 64 8.261 8.261 7.312 0.949 19668 10719 1 29 . 1 1 65 65 LYS N N 65 118.693 118.693 118.219 0.474 19668 10720 1 29 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.120 -0.022 19668 10721 1 29 . 1 1 65 65 LYS C C 65 177.244 177.244 177.588 -0.344 19668 10722 1 29 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.519 0.134 19668 10723 1 29 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.336 0.369 19668 10724 1 29 . 1 1 65 65 LYS H H 65 7.661 7.661 7.516 0.145 19668 10725 1 29 . 1 1 66 66 LYS N N 66 116.933 116.933 118.412 -1.479 19668 10726 1 29 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.153 0.185 19668 10727 1 29 . 1 1 66 66 LYS C C 66 176.011 176.011 176.935 -0.924 19668 10728 1 29 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.733 -1.274 19668 10729 1 29 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.705 0.426 19668 10730 1 29 . 1 1 66 66 LYS H H 66 7.261 7.261 7.792 -0.531 19668 10731 1 30 . 1 1 2 2 SER HA H 2 4.560 4.560 4.474 0.086 19668 10732 1 30 . 1 1 2 2 SER CA C 2 58.366 58.366 58.417 -0.051 19668 10733 1 30 . 1 1 3 3 ARG N N 3 125.213 125.213 121.481 3.732 19668 10734 1 30 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.216 0.050 19668 10735 1 30 . 1 1 3 3 ARG C C 3 178.381 178.381 177.893 0.488 19668 10736 1 30 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.603 -0.207 19668 10737 1 30 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.671 0.984 19668 10738 1 30 . 1 1 3 3 ARG H H 3 8.874 8.874 8.300 0.574 19668 10739 1 30 . 1 1 4 4 VAL N N 4 119.320 119.320 119.613 -0.293 19668 10740 1 30 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.808 -0.010 19668 10741 1 30 . 1 1 4 4 VAL C C 4 177.004 177.004 177.615 -0.611 19668 10742 1 30 . 1 1 4 4 VAL CA C 4 65.515 65.515 66.227 -0.712 19668 10743 1 30 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.284 0.519 19668 10744 1 30 . 1 1 4 4 VAL H H 4 8.112 8.112 8.029 0.083 19668 10745 1 30 . 1 1 5 5 LYS N N 5 122.279 122.279 120.138 2.141 19668 10746 1 30 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.993 0.169 19668 10747 1 30 . 1 1 5 5 LYS C C 5 178.547 178.547 177.849 0.698 19668 10748 1 30 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.720 0.038 19668 10749 1 30 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.536 0.474 19668 10750 1 30 . 1 1 5 5 LYS H H 5 7.847 7.847 7.868 -0.021 19668 10751 1 30 . 1 1 6 6 ALA N N 6 120.295 120.295 121.749 -1.454 19668 10752 1 30 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.107 0.104 19668 10753 1 30 . 1 1 6 6 ALA C C 6 180.834 180.834 179.781 1.053 19668 10754 1 30 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.889 0.014 19668 10755 1 30 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.035 0.097 19668 10756 1 30 . 1 1 6 6 ALA H H 6 7.975 7.975 7.586 0.389 19668 10757 1 30 . 1 1 7 7 LEU N N 7 119.570 119.570 118.372 1.198 19668 10758 1 30 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.060 0.112 19668 10759 1 30 . 1 1 7 7 LEU C C 7 178.431 178.431 178.511 -0.080 19668 10760 1 30 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.781 -0.102 19668 10761 1 30 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.038 0.996 19668 10762 1 30 . 1 1 7 7 LEU H H 7 7.650 7.650 7.647 0.003 19668 10763 1 30 . 1 1 8 8 GLU N N 8 119.934 119.934 118.364 1.570 19668 10764 1 30 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.056 -0.197 19668 10765 1 30 . 1 1 8 8 GLU C C 8 179.534 179.534 178.631 0.903 19668 10766 1 30 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.383 0.654 19668 10767 1 30 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.752 0.715 19668 10768 1 30 . 1 1 8 8 GLU H H 8 8.411 8.411 7.842 0.569 19668 10769 1 30 . 1 1 9 9 GLU N N 9 118.234 118.234 119.146 -0.912 19668 10770 1 30 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.098 -0.038 19668 10771 1 30 . 1 1 9 9 GLU C C 9 179.596 179.596 178.909 0.687 19668 10772 1 30 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.114 0.216 19668 10773 1 30 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.343 0.075 19668 10774 1 30 . 1 1 9 9 GLU H H 9 8.206 8.206 7.725 0.481 19668 10775 1 30 . 1 1 10 10 LYS N N 10 121.042 121.042 119.049 1.993 19668 10776 1 30 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.151 0.032 19668 10777 1 30 . 1 1 10 10 LYS C C 10 179.380 179.380 179.114 0.266 19668 10778 1 30 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.172 0.153 19668 10779 1 30 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.083 0.326 19668 10780 1 30 . 1 1 10 10 LYS H H 10 7.931 7.931 7.550 0.381 19668 10781 1 30 . 1 1 11 11 VAL N N 11 118.662 118.662 120.042 -1.380 19668 10782 1 30 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.913 -0.099 19668 10783 1 30 . 1 1 11 11 VAL C C 11 178.845 178.845 178.236 0.609 19668 10784 1 30 . 1 1 11 11 VAL CA C 11 66.988 66.988 65.290 1.698 19668 10785 1 30 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.102 0.552 19668 10786 1 30 . 1 1 11 11 VAL H H 11 8.371 8.371 7.620 0.751 19668 10787 1 30 . 1 1 12 12 LYS N N 12 123.188 123.188 119.760 3.428 19668 10788 1 30 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.906 0.320 19668 10789 1 30 . 1 1 12 12 LYS C C 12 179.098 179.098 178.527 0.571 19668 10790 1 30 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.619 -0.136 19668 10791 1 30 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.260 -0.054 19668 10792 1 30 . 1 1 12 12 LYS H H 12 8.276 8.276 7.534 0.742 19668 10793 1 30 . 1 1 13 13 ALA N N 13 121.169 121.169 121.757 -0.588 19668 10794 1 30 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.046 0.211 19668 10795 1 30 . 1 1 13 13 ALA C C 13 180.169 180.169 179.447 0.722 19668 10796 1 30 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.834 -0.198 19668 10797 1 30 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.404 -0.297 19668 10798 1 30 . 1 1 13 13 ALA H H 13 7.829 7.829 7.427 0.402 19668 10799 1 30 . 1 1 14 14 LEU N N 14 118.104 118.104 118.626 -0.522 19668 10800 1 30 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.982 0.174 19668 10801 1 30 . 1 1 14 14 LEU C C 14 177.614 177.614 177.940 -0.326 19668 10802 1 30 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.007 -0.402 19668 10803 1 30 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.990 0.805 19668 10804 1 30 . 1 1 14 14 LEU H H 14 7.781 7.781 7.416 0.365 19668 10805 1 30 . 1 1 15 15 GLU N N 15 120.632 120.632 119.466 1.166 19668 10806 1 30 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.369 -0.002 19668 10807 1 30 . 1 1 15 15 GLU C C 15 178.243 178.243 178.655 -0.412 19668 10808 1 30 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.640 0.946 19668 10809 1 30 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.090 0.739 19668 10810 1 30 . 1 1 15 15 GLU H H 15 7.873 7.873 7.322 0.551 19668 10811 1 30 . 1 1 16 16 GLU N N 16 115.775 115.775 117.241 -1.466 19668 10812 1 30 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.995 -0.036 19668 10813 1 30 . 1 1 16 16 GLU C C 16 179.006 179.006 178.718 0.288 19668 10814 1 30 . 1 1 16 16 GLU CA C 16 59.092 59.092 58.923 0.169 19668 10815 1 30 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.416 -0.063 19668 10816 1 30 . 1 1 16 16 GLU H H 16 7.926 7.926 7.690 0.236 19668 10817 1 30 . 1 1 17 17 LYS N N 17 118.801 118.801 118.987 -0.186 19668 10818 1 30 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.074 0.020 19668 10819 1 30 . 1 1 17 17 LYS C C 17 178.853 178.853 178.351 0.502 19668 10820 1 30 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.694 -0.223 19668 10821 1 30 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.844 0.518 19668 10822 1 30 . 1 1 17 17 LYS H H 17 7.518 7.518 7.365 0.153 19668 10823 1 30 . 1 1 18 18 VAL N N 18 118.034 118.034 119.921 -1.887 19668 10824 1 30 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.751 -0.239 19668 10825 1 30 . 1 1 18 18 VAL C C 18 178.362 178.362 178.708 -0.346 19668 10826 1 30 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.063 -0.044 19668 10827 1 30 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.547 0.102 19668 10828 1 30 . 1 1 18 18 VAL H H 18 8.048 8.048 7.373 0.674 19668 10829 1 30 . 1 1 19 19 LYS N N 19 118.427 118.427 119.745 -1.318 19668 10830 1 30 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.095 -0.085 19668 10831 1 30 . 1 1 19 19 LYS C C 19 177.706 177.706 177.955 -0.249 19668 10832 1 30 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.576 0.409 19668 10833 1 30 . 1 1 19 19 LYS CB C 19 32.424 32.424 32.056 0.368 19668 10834 1 30 . 1 1 19 19 LYS H H 19 8.008 8.008 7.570 0.438 19668 10835 1 30 . 1 1 20 20 ALA N N 20 119.177 119.177 120.011 -0.834 19668 10836 1 30 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.298 0.018 19668 10837 1 30 . 1 1 20 20 ALA C C 20 178.269 178.269 178.742 -0.473 19668 10838 1 30 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.214 -0.583 19668 10839 1 30 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.607 0.526 19668 10840 1 30 . 1 1 20 20 ALA H H 20 7.259 7.259 7.449 -0.190 19668 10841 1 30 . 1 1 21 21 LEU N N 21 118.596 118.596 117.433 1.163 19668 10842 1 30 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.097 0.164 19668 10843 1 30 . 1 1 21 21 LEU C C 21 177.732 177.732 177.307 0.425 19668 10844 1 30 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.992 -0.335 19668 10845 1 30 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.357 0.776 19668 10846 1 30 . 1 1 21 21 LEU H H 21 7.373 7.373 7.483 -0.110 19668 10847 1 30 . 1 1 22 22 GLY N N 22 107.926 107.926 104.918 3.008 19668 10848 1 30 . 1 1 22 22 GLY C C 22 173.362 173.362 173.358 0.004 19668 10849 1 30 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.714 0.483 19668 10850 1 30 . 1 1 22 22 GLY H H 22 8.144 8.144 7.316 0.828 19668 10851 1 30 . 1 1 23 23 GLY N N 23 108.242 108.242 108.066 0.176 19668 10852 1 30 . 1 1 23 23 GLY C C 23 174.110 174.110 174.260 -0.150 19668 10853 1 30 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.434 0.250 19668 10854 1 30 . 1 1 23 23 GLY H H 23 8.157 8.157 7.917 0.240 19668 10855 1 30 . 1 1 24 24 GLY N N 24 106.969 106.969 108.152 -1.183 19668 10856 1 30 . 1 1 24 24 GLY C C 24 175.172 175.172 175.198 -0.026 19668 10857 1 30 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.110 -0.671 19668 10858 1 30 . 1 1 24 24 GLY H H 24 8.466 8.466 8.983 -0.517 19668 10859 1 30 . 1 1 25 25 GLY N N 25 108.946 108.946 109.525 -0.579 19668 10860 1 30 . 1 1 25 25 GLY C C 25 176.321 176.321 175.546 0.775 19668 10861 1 30 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.015 2.084 19668 10862 1 30 . 1 1 25 25 GLY H H 25 8.618 8.618 8.025 0.593 19668 10863 1 30 . 1 1 26 26 ARG N N 26 123.559 123.559 121.589 1.970 19668 10864 1 30 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.367 -0.088 19668 10865 1 30 . 1 1 26 26 ARG C C 26 178.076 178.076 178.174 -0.098 19668 10866 1 30 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.262 -0.347 19668 10867 1 30 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.091 -0.181 19668 10868 1 30 . 1 1 26 26 ARG H H 26 8.789 8.789 8.588 0.201 19668 10869 1 30 . 1 1 27 27 ILE N N 27 118.726 118.726 119.870 -1.144 19668 10870 1 30 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.820 -0.034 19668 10871 1 30 . 1 1 27 27 ILE C C 27 177.639 177.639 177.934 -0.295 19668 10872 1 30 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.400 -0.776 19668 10873 1 30 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.053 -0.098 19668 10874 1 30 . 1 1 27 27 ILE H H 27 7.762 7.762 8.083 -0.321 19668 10875 1 30 . 1 1 28 28 GLU N N 28 119.843 119.843 119.249 0.594 19668 10876 1 30 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.040 -0.027 19668 10877 1 30 . 1 1 28 28 GLU C C 28 179.447 179.447 178.475 0.972 19668 10878 1 30 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.314 0.269 19668 10879 1 30 . 1 1 28 28 GLU CB C 28 29.060 29.060 28.881 0.179 19668 10880 1 30 . 1 1 28 28 GLU H H 28 7.867 7.867 8.869 -1.002 19668 10881 1 30 . 1 1 29 29 GLU N N 29 118.447 118.447 119.608 -1.161 19668 10882 1 30 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.086 0.001 19668 10883 1 30 . 1 1 29 29 GLU C C 29 179.310 179.310 178.853 0.457 19668 10884 1 30 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.318 0.962 19668 10885 1 30 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.276 0.060 19668 10886 1 30 . 1 1 29 29 GLU H H 29 7.755 7.755 7.606 0.149 19668 10887 1 30 . 1 1 30 30 LEU N N 30 121.135 121.135 121.579 -0.444 19668 10888 1 30 . 1 1 30 30 LEU HA H 30 4.096 4.096 3.987 0.109 19668 10889 1 30 . 1 1 30 30 LEU C C 30 178.928 178.928 178.733 0.195 19668 10890 1 30 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.281 -0.176 19668 10891 1 30 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.152 -0.472 19668 10892 1 30 . 1 1 30 30 LEU H H 30 7.785 7.785 7.627 0.158 19668 10893 1 30 . 1 1 31 31 LYS N N 31 119.130 119.130 117.699 1.431 19668 10894 1 30 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.108 -0.238 19668 10895 1 30 . 1 1 31 31 LYS C C 31 179.104 179.104 178.975 0.129 19668 10896 1 30 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.442 1.274 19668 10897 1 30 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.795 0.461 19668 10898 1 30 . 1 1 31 31 LYS H H 31 8.413 8.413 7.654 0.759 19668 10899 1 30 . 1 1 32 32 LYS N N 32 119.200 119.200 119.774 -0.574 19668 10900 1 30 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.986 0.116 19668 10901 1 30 . 1 1 32 32 LYS C C 32 179.420 179.420 179.036 0.384 19668 10902 1 30 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.477 -0.020 19668 10903 1 30 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.339 -0.073 19668 10904 1 30 . 1 1 32 32 LYS H H 32 7.826 7.826 7.533 0.293 19668 10905 1 30 . 1 1 33 33 LYS N N 33 120.322 120.322 119.115 1.207 19668 10906 1 30 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.084 0.079 19668 10907 1 30 . 1 1 33 33 LYS C C 33 179.174 179.174 178.791 0.383 19668 10908 1 30 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.437 0.311 19668 10909 1 30 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.046 -0.307 19668 10910 1 30 . 1 1 33 33 LYS H H 33 8.003 8.003 7.474 0.529 19668 10911 1 30 . 1 1 34 34 TYR N N 34 120.223 120.223 119.450 0.773 19668 10912 1 30 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.110 -0.054 19668 10913 1 30 . 1 1 34 34 TYR C C 34 176.356 176.356 178.010 -1.654 19668 10914 1 30 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.610 -0.555 19668 10915 1 30 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.335 -0.308 19668 10916 1 30 . 1 1 34 34 TYR H H 34 8.614 8.614 7.557 1.057 19668 10917 1 30 . 1 1 35 35 GLU N N 35 118.813 118.813 117.627 1.186 19668 10918 1 30 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.950 -0.225 19668 10919 1 30 . 1 1 35 35 GLU C C 35 179.787 179.787 179.037 0.750 19668 10920 1 30 . 1 1 35 35 GLU CA C 35 59.439 59.439 60.012 -0.573 19668 10921 1 30 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.110 0.018 19668 10922 1 30 . 1 1 35 35 GLU H H 35 8.103 8.103 7.918 0.185 19668 10923 1 30 . 1 1 36 36 GLU N N 36 119.670 119.670 119.534 0.136 19668 10924 1 30 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.080 -0.066 19668 10925 1 30 . 1 1 36 36 GLU C C 36 179.295 179.295 179.097 0.198 19668 10926 1 30 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.185 0.078 19668 10927 1 30 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.504 0.065 19668 10928 1 30 . 1 1 36 36 GLU H H 36 8.028 8.028 7.704 0.324 19668 10929 1 30 . 1 1 37 37 LEU N N 37 121.416 121.416 119.924 1.492 19668 10930 1 30 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.013 0.006 19668 10931 1 30 . 1 1 37 37 LEU C C 37 178.277 178.277 178.950 -0.673 19668 10932 1 30 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.950 -0.110 19668 10933 1 30 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.387 0.242 19668 10934 1 30 . 1 1 37 37 LEU H H 37 8.176 8.176 7.337 0.839 19668 10935 1 30 . 1 1 38 38 LYS N N 38 118.998 118.998 118.216 0.782 19668 10936 1 30 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.951 -0.291 19668 10937 1 30 . 1 1 38 38 LYS C C 38 178.923 178.923 179.229 -0.306 19668 10938 1 30 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.860 0.540 19668 10939 1 30 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.028 0.034 19668 10940 1 30 . 1 1 38 38 LYS H H 38 8.260 8.260 7.648 0.612 19668 10941 1 30 . 1 1 39 39 LYS N N 39 118.070 118.070 118.647 -0.577 19668 10942 1 30 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.045 0.035 19668 10943 1 30 . 1 1 39 39 LYS C C 39 178.687 178.687 178.894 -0.207 19668 10944 1 30 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.627 -0.691 19668 10945 1 30 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.284 -0.135 19668 10946 1 30 . 1 1 39 39 LYS H H 39 7.380 7.380 7.586 -0.206 19668 10947 1 30 . 1 1 40 40 LYS N N 40 118.894 118.894 119.650 -0.756 19668 10948 1 30 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.061 -0.002 19668 10949 1 30 . 1 1 40 40 LYS C C 40 179.758 179.758 178.987 0.771 19668 10950 1 30 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.557 -0.495 19668 10951 1 30 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.343 0.045 19668 10952 1 30 . 1 1 40 40 LYS H H 40 7.919 7.919 7.454 0.465 19668 10953 1 30 . 1 1 41 41 ILE N N 41 118.270 118.270 118.458 -0.188 19668 10954 1 30 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.821 -0.124 19668 10955 1 30 . 1 1 41 41 ILE C C 41 178.211 178.211 177.702 0.509 19668 10956 1 30 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.564 0.150 19668 10957 1 30 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.811 0.028 19668 10958 1 30 . 1 1 41 41 ILE H H 41 8.199 8.199 7.554 0.645 19668 10959 1 30 . 1 1 42 42 GLU N N 42 120.117 120.117 117.895 2.222 19668 10960 1 30 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.109 -0.018 19668 10961 1 30 . 1 1 42 42 GLU C C 42 178.736 178.736 177.286 1.450 19668 10962 1 30 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.738 0.142 19668 10963 1 30 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.893 -0.502 19668 10964 1 30 . 1 1 42 42 GLU H H 42 7.738 7.738 7.573 0.165 19668 10965 1 30 . 1 1 43 43 GLU N N 43 117.194 117.194 117.065 0.129 19668 10966 1 30 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.176 0.123 19668 10967 1 30 . 1 1 43 43 GLU C C 43 177.658 177.658 177.321 0.337 19668 10968 1 30 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.946 -0.153 19668 10969 1 30 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.377 -0.444 19668 10970 1 30 . 1 1 43 43 GLU H H 43 7.698 7.698 7.497 0.201 19668 10971 1 30 . 1 1 44 44 LEU N N 44 120.812 120.812 121.841 -1.029 19668 10972 1 30 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.149 0.090 19668 10973 1 30 . 1 1 44 44 LEU C C 44 178.682 178.682 177.544 1.138 19668 10974 1 30 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.454 1.042 19668 10975 1 30 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.357 0.290 19668 10976 1 30 . 1 1 44 44 LEU H H 44 7.593 7.593 7.563 0.030 19668 10977 1 30 . 1 1 45 45 GLY N N 45 108.681 108.681 112.278 -3.597 19668 10978 1 30 . 1 1 45 45 GLY C C 45 174.957 174.957 173.573 1.384 19668 10979 1 30 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.649 0.437 19668 10980 1 30 . 1 1 45 45 GLY H H 45 8.234 8.234 8.719 -0.485 19668 10981 1 30 . 1 1 46 46 GLY N N 46 108.057 108.057 106.784 1.273 19668 10982 1 30 . 1 1 46 46 GLY C C 46 174.777 174.777 173.586 1.191 19668 10983 1 30 . 1 1 46 46 GLY CA C 46 45.364 45.364 45.030 0.334 19668 10984 1 30 . 1 1 46 46 GLY H H 46 8.182 8.182 7.732 0.450 19668 10985 1 30 . 1 1 47 47 GLY N N 47 108.494 108.494 110.469 -1.975 19668 10986 1 30 . 1 1 47 47 GLY C C 47 174.572 174.572 174.757 -0.185 19668 10987 1 30 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.467 0.688 19668 10988 1 30 . 1 1 47 47 GLY H H 47 8.087 8.087 8.136 -0.049 19668 10989 1 30 . 1 1 48 48 GLY N N 48 108.285 108.285 107.776 0.509 19668 10990 1 30 . 1 1 48 48 GLY C C 48 174.495 174.495 174.262 0.233 19668 10991 1 30 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.510 -0.056 19668 10992 1 30 . 1 1 48 48 GLY H H 48 8.323 8.323 8.456 -0.133 19668 10993 1 30 . 1 1 49 49 GLU N N 49 121.070 121.070 122.576 -1.506 19668 10994 1 30 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.470 -0.053 19668 10995 1 30 . 1 1 49 49 GLU C C 49 177.226 177.226 178.566 -1.340 19668 10996 1 30 . 1 1 49 49 GLU CA C 49 56.571 56.571 56.756 -0.185 19668 10997 1 30 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.721 -0.055 19668 10998 1 30 . 1 1 49 49 GLU H H 49 8.483 8.483 8.375 0.108 19668 10999 1 30 . 1 1 50 50 VAL N N 50 121.794 121.794 114.911 6.883 19668 11000 1 30 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.704 0.077 19668 11001 1 30 . 1 1 50 50 VAL C C 50 176.860 176.860 177.531 -0.671 19668 11002 1 30 . 1 1 50 50 VAL CA C 50 65.080 65.080 66.309 -1.229 19668 11003 1 30 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.215 1.038 19668 11004 1 30 . 1 1 50 50 VAL H H 50 8.068 8.068 8.015 0.053 19668 11005 1 30 . 1 1 51 51 LYS N N 51 120.593 120.593 119.200 1.393 19668 11006 1 30 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.463 -0.256 19668 11007 1 30 . 1 1 51 51 LYS C C 51 178.667 178.667 179.016 -0.349 19668 11008 1 30 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.141 0.195 19668 11009 1 30 . 1 1 51 51 LYS CB C 51 32.258 32.258 32.002 0.256 19668 11010 1 30 . 1 1 51 51 LYS H H 51 8.253 8.253 8.183 0.070 19668 11011 1 30 . 1 1 52 52 LYS N N 52 117.572 117.572 119.943 -2.371 19668 11012 1 30 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.048 0.120 19668 11013 1 30 . 1 1 52 52 LYS C C 52 179.248 179.248 178.816 0.432 19668 11014 1 30 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.512 -0.498 19668 11015 1 30 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.243 -0.063 19668 11016 1 30 . 1 1 52 52 LYS H H 52 7.629 7.629 7.326 0.303 19668 11017 1 30 . 1 1 53 53 VAL N N 53 119.059 119.059 119.373 -0.314 19668 11018 1 30 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.619 0.173 19668 11019 1 30 . 1 1 53 53 VAL C C 53 177.987 177.987 177.666 0.321 19668 11020 1 30 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.765 -0.734 19668 11021 1 30 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.355 0.016 19668 11022 1 30 . 1 1 53 53 VAL H H 53 7.638 7.638 7.908 -0.270 19668 11023 1 30 . 1 1 54 54 GLU N N 54 120.388 120.388 119.281 1.107 19668 11024 1 30 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.926 -0.082 19668 11025 1 30 . 1 1 54 54 GLU C C 54 179.624 179.624 179.074 0.550 19668 11026 1 30 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.883 0.358 19668 11027 1 30 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.220 0.598 19668 11028 1 30 . 1 1 54 54 GLU H H 54 8.603 8.603 7.702 0.901 19668 11029 1 30 . 1 1 55 55 GLU N N 55 118.533 118.533 118.713 -0.180 19668 11030 1 30 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.056 0.033 19668 11031 1 30 . 1 1 55 55 GLU C C 55 179.158 179.158 179.035 0.123 19668 11032 1 30 . 1 1 55 55 GLU CA C 55 59.334 59.334 58.957 0.377 19668 11033 1 30 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.318 0.019 19668 11034 1 30 . 1 1 55 55 GLU H H 55 7.904 7.904 7.578 0.326 19668 11035 1 30 . 1 1 56 56 GLU N N 56 120.258 120.258 119.695 0.563 19668 11036 1 30 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.026 0.074 19668 11037 1 30 . 1 1 56 56 GLU C C 56 179.867 179.867 179.168 0.699 19668 11038 1 30 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.228 0.435 19668 11039 1 30 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.502 0.548 19668 11040 1 30 . 1 1 56 56 GLU H H 56 7.902 7.902 7.451 0.451 19668 11041 1 30 . 1 1 57 57 VAL N N 57 121.168 121.168 118.901 2.267 19668 11042 1 30 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.540 0.028 19668 11043 1 30 . 1 1 57 57 VAL C C 57 176.994 176.994 176.918 0.076 19668 11044 1 30 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.351 1.545 19668 11045 1 30 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.771 -0.244 19668 11046 1 30 . 1 1 57 57 VAL H H 57 8.613 8.613 7.498 1.115 19668 11047 1 30 . 1 1 58 58 LYS N N 58 120.234 120.234 119.191 1.043 19668 11048 1 30 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.947 0.255 19668 11049 1 30 . 1 1 58 58 LYS C C 58 179.131 179.131 178.483 0.648 19668 11050 1 30 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.394 0.193 19668 11051 1 30 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.548 0.743 19668 11052 1 30 . 1 1 58 58 LYS H H 58 7.810 7.810 7.539 0.271 19668 11053 1 30 . 1 1 59 59 LYS N N 59 118.301 118.301 118.583 -0.282 19668 11054 1 30 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.064 0.029 19668 11055 1 30 . 1 1 59 59 LYS C C 59 179.281 179.281 178.091 1.190 19668 11056 1 30 . 1 1 59 59 LYS CA C 59 59.428 59.428 58.988 0.440 19668 11057 1 30 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.906 0.473 19668 11058 1 30 . 1 1 59 59 LYS H H 59 7.876 7.876 7.408 0.468 19668 11059 1 30 . 1 1 60 60 LEU N N 60 121.224 121.224 121.281 -0.057 19668 11060 1 30 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.018 0.216 19668 11061 1 30 . 1 1 60 60 LEU C C 60 178.636 178.636 178.889 -0.253 19668 11062 1 30 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.801 0.356 19668 11063 1 30 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.238 0.396 19668 11064 1 30 . 1 1 60 60 LEU H H 60 7.893 7.893 7.500 0.393 19668 11065 1 30 . 1 1 61 61 GLU N N 61 118.660 118.660 117.895 0.765 19668 11066 1 30 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.074 -0.275 19668 11067 1 30 . 1 1 61 61 GLU C C 61 179.094 179.094 178.693 0.401 19668 11068 1 30 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.122 1.150 19668 11069 1 30 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.638 1.365 19668 11070 1 30 . 1 1 61 61 GLU H H 61 8.644 8.644 7.801 0.843 19668 11071 1 30 . 1 1 62 62 GLU N N 62 117.555 117.555 119.668 -2.113 19668 11072 1 30 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.030 -0.034 19668 11073 1 30 . 1 1 62 62 GLU C C 62 178.940 178.940 179.135 -0.195 19668 11074 1 30 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.384 -0.216 19668 11075 1 30 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.345 0.202 19668 11076 1 30 . 1 1 62 62 GLU H H 62 7.995 7.995 7.552 0.443 19668 11077 1 30 . 1 1 63 63 GLU N N 63 119.097 119.097 118.490 0.607 19668 11078 1 30 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.144 -0.115 19668 11079 1 30 . 1 1 63 63 GLU C C 63 179.890 179.890 179.021 0.869 19668 11080 1 30 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.790 0.551 19668 11081 1 30 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.022 0.645 19668 11082 1 30 . 1 1 63 63 GLU H H 63 7.983 7.983 7.712 0.271 19668 11083 1 30 . 1 1 64 64 ILE N N 64 118.247 118.247 119.301 -1.054 19668 11084 1 30 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.775 -0.055 19668 11085 1 30 . 1 1 64 64 ILE C C 64 177.858 177.858 178.625 -0.767 19668 11086 1 30 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.515 -0.019 19668 11087 1 30 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.456 0.525 19668 11088 1 30 . 1 1 64 64 ILE H H 64 8.261 8.261 7.194 1.067 19668 11089 1 30 . 1 1 65 65 LYS N N 65 118.693 118.693 120.228 -1.535 19668 11090 1 30 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.116 -0.018 19668 11091 1 30 . 1 1 65 65 LYS C C 65 177.244 177.244 177.854 -0.610 19668 11092 1 30 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.957 -0.304 19668 11093 1 30 . 1 1 65 65 LYS CB C 65 32.705 32.705 31.939 0.767 19668 11094 1 30 . 1 1 65 65 LYS H H 65 7.661 7.661 7.721 -0.060 19668 11095 1 30 . 1 1 66 66 LYS N N 66 116.933 116.933 117.458 -0.525 19668 11096 1 30 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.142 0.196 19668 11097 1 30 . 1 1 66 66 LYS C C 66 176.011 176.011 176.623 -0.612 19668 11098 1 30 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.943 -1.484 19668 11099 1 30 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.864 0.267 19668 11100 1 30 . 1 1 66 66 LYS H H 66 7.261 7.261 7.611 -0.350 19668 11101 1 31 . 1 1 2 2 SER HA H 2 4.560 4.560 4.414 0.146 19668 11102 1 31 . 1 1 2 2 SER CA C 2 58.366 58.366 59.091 -0.725 19668 11103 1 31 . 1 1 3 3 ARG N N 3 125.213 125.213 123.109 2.104 19668 11104 1 31 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.253 0.013 19668 11105 1 31 . 1 1 3 3 ARG C C 3 178.381 178.381 178.305 0.076 19668 11106 1 31 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.149 0.247 19668 11107 1 31 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.238 1.417 19668 11108 1 31 . 1 1 3 3 ARG H H 3 8.874 8.874 8.407 0.467 19668 11109 1 31 . 1 1 4 4 VAL N N 4 119.320 119.320 120.113 -0.793 19668 11110 1 31 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.817 -0.019 19668 11111 1 31 . 1 1 4 4 VAL C C 4 177.004 177.004 177.618 -0.614 19668 11112 1 31 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.669 -0.154 19668 11113 1 31 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.680 0.123 19668 11114 1 31 . 1 1 4 4 VAL H H 4 8.112 8.112 7.968 0.144 19668 11115 1 31 . 1 1 5 5 LYS N N 5 122.279 122.279 120.437 1.842 19668 11116 1 31 . 1 1 5 5 LYS HA H 5 4.162 4.162 3.959 0.203 19668 11117 1 31 . 1 1 5 5 LYS C C 5 178.547 178.547 178.225 0.322 19668 11118 1 31 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.862 -0.104 19668 11119 1 31 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.614 0.395 19668 11120 1 31 . 1 1 5 5 LYS H H 5 7.847 7.847 8.456 -0.609 19668 11121 1 31 . 1 1 6 6 ALA N N 6 120.295 120.295 121.946 -1.651 19668 11122 1 31 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.096 0.115 19668 11123 1 31 . 1 1 6 6 ALA C C 6 180.834 180.834 179.756 1.078 19668 11124 1 31 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.036 -0.133 19668 11125 1 31 . 1 1 6 6 ALA CB C 6 18.132 18.132 17.911 0.221 19668 11126 1 31 . 1 1 6 6 ALA H H 6 7.975 7.975 7.552 0.423 19668 11127 1 31 . 1 1 7 7 LEU N N 7 119.570 119.570 118.405 1.165 19668 11128 1 31 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.067 0.105 19668 11129 1 31 . 1 1 7 7 LEU C C 7 178.431 178.431 178.586 -0.155 19668 11130 1 31 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.957 -0.278 19668 11131 1 31 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.034 1.001 19668 11132 1 31 . 1 1 7 7 LEU H H 7 7.650 7.650 7.550 0.100 19668 11133 1 31 . 1 1 8 8 GLU N N 8 119.934 119.934 118.429 1.505 19668 11134 1 31 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.062 -0.203 19668 11135 1 31 . 1 1 8 8 GLU C C 8 179.534 179.534 178.598 0.936 19668 11136 1 31 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.344 0.693 19668 11137 1 31 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.760 0.707 19668 11138 1 31 . 1 1 8 8 GLU H H 8 8.411 8.411 7.854 0.557 19668 11139 1 31 . 1 1 9 9 GLU N N 9 118.234 118.234 119.100 -0.866 19668 11140 1 31 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.074 -0.014 19668 11141 1 31 . 1 1 9 9 GLU C C 9 179.596 179.596 178.875 0.721 19668 11142 1 31 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.424 -0.094 19668 11143 1 31 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.431 -0.013 19668 11144 1 31 . 1 1 9 9 GLU H H 9 8.206 8.206 7.717 0.489 19668 11145 1 31 . 1 1 10 10 LYS N N 10 121.042 121.042 119.148 1.894 19668 11146 1 31 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.130 0.053 19668 11147 1 31 . 1 1 10 10 LYS C C 10 179.380 179.380 179.070 0.310 19668 11148 1 31 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.139 0.186 19668 11149 1 31 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.111 0.298 19668 11150 1 31 . 1 1 10 10 LYS H H 10 7.931 7.931 7.557 0.374 19668 11151 1 31 . 1 1 11 11 VAL N N 11 118.662 118.662 120.427 -1.765 19668 11152 1 31 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.811 0.003 19668 11153 1 31 . 1 1 11 11 VAL C C 11 178.845 178.845 178.187 0.658 19668 11154 1 31 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.873 0.115 19668 11155 1 31 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.663 -0.009 19668 11156 1 31 . 1 1 11 11 VAL H H 11 8.371 8.371 7.593 0.778 19668 11157 1 31 . 1 1 12 12 LYS N N 12 123.188 123.188 119.651 3.537 19668 11158 1 31 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.897 0.329 19668 11159 1 31 . 1 1 12 12 LYS C C 12 179.098 179.098 178.304 0.794 19668 11160 1 31 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.550 -0.067 19668 11161 1 31 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.264 -0.058 19668 11162 1 31 . 1 1 12 12 LYS H H 12 8.276 8.276 7.514 0.762 19668 11163 1 31 . 1 1 13 13 ALA N N 13 121.169 121.169 121.689 -0.520 19668 11164 1 31 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.065 0.193 19668 11165 1 31 . 1 1 13 13 ALA C C 13 180.169 180.169 179.789 0.380 19668 11166 1 31 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.791 -0.155 19668 11167 1 31 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.267 -0.160 19668 11168 1 31 . 1 1 13 13 ALA H H 13 7.829 7.829 7.443 0.386 19668 11169 1 31 . 1 1 14 14 LEU N N 14 118.104 118.104 118.352 -0.248 19668 11170 1 31 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.933 0.223 19668 11171 1 31 . 1 1 14 14 LEU C C 14 177.614 177.614 178.120 -0.506 19668 11172 1 31 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.299 -0.694 19668 11173 1 31 . 1 1 14 14 LEU CB C 14 42.795 42.795 42.003 0.792 19668 11174 1 31 . 1 1 14 14 LEU H H 14 7.781 7.781 7.389 0.392 19668 11175 1 31 . 1 1 15 15 GLU N N 15 120.632 120.632 118.823 1.809 19668 11176 1 31 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.387 -0.020 19668 11177 1 31 . 1 1 15 15 GLU C C 15 178.243 178.243 178.496 -0.253 19668 11178 1 31 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.593 0.994 19668 11179 1 31 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.221 0.608 19668 11180 1 31 . 1 1 15 15 GLU H H 15 7.873 7.873 7.318 0.555 19668 11181 1 31 . 1 1 16 16 GLU N N 16 115.775 115.775 117.047 -1.272 19668 11182 1 31 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.992 -0.033 19668 11183 1 31 . 1 1 16 16 GLU C C 16 179.006 179.006 178.551 0.455 19668 11184 1 31 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.218 -0.126 19668 11185 1 31 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.027 0.326 19668 11186 1 31 . 1 1 16 16 GLU H H 16 7.926 7.926 7.815 0.111 19668 11187 1 31 . 1 1 17 17 LYS N N 17 118.801 118.801 119.432 -0.631 19668 11188 1 31 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.101 -0.007 19668 11189 1 31 . 1 1 17 17 LYS C C 17 178.853 178.853 178.704 0.149 19668 11190 1 31 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.767 -0.296 19668 11191 1 31 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.998 0.364 19668 11192 1 31 . 1 1 17 17 LYS H H 17 7.518 7.518 7.504 0.014 19668 11193 1 31 . 1 1 18 18 VAL N N 18 118.034 118.034 120.005 -1.971 19668 11194 1 31 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.723 -0.211 19668 11195 1 31 . 1 1 18 18 VAL C C 18 178.362 178.362 177.853 0.509 19668 11196 1 31 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.581 0.438 19668 11197 1 31 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.165 0.484 19668 11198 1 31 . 1 1 18 18 VAL H H 18 8.048 8.048 7.451 0.597 19668 11199 1 31 . 1 1 19 19 LYS N N 19 118.427 118.427 117.454 0.973 19668 11200 1 31 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.262 -0.252 19668 11201 1 31 . 1 1 19 19 LYS C C 19 177.706 177.706 177.642 0.064 19668 11202 1 31 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.580 0.405 19668 11203 1 31 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.888 0.536 19668 11204 1 31 . 1 1 19 19 LYS H H 19 8.008 8.008 7.398 0.610 19668 11205 1 31 . 1 1 20 20 ALA N N 20 119.177 119.177 120.341 -1.164 19668 11206 1 31 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.228 0.088 19668 11207 1 31 . 1 1 20 20 ALA C C 20 178.269 178.269 179.149 -0.880 19668 11208 1 31 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.940 -1.309 19668 11209 1 31 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.740 0.393 19668 11210 1 31 . 1 1 20 20 ALA H H 20 7.259 7.259 7.504 -0.245 19668 11211 1 31 . 1 1 21 21 LEU N N 21 118.596 118.596 114.628 3.968 19668 11212 1 31 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.288 -0.027 19668 11213 1 31 . 1 1 21 21 LEU C C 21 177.732 177.732 177.350 0.382 19668 11214 1 31 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.772 -0.115 19668 11215 1 31 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.574 0.559 19668 11216 1 31 . 1 1 21 21 LEU H H 21 7.373 7.373 7.232 0.141 19668 11217 1 31 . 1 1 22 22 GLY N N 22 107.926 107.926 104.851 3.075 19668 11218 1 31 . 1 1 22 22 GLY C C 22 173.362 173.362 172.381 0.981 19668 11219 1 31 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.652 0.545 19668 11220 1 31 . 1 1 22 22 GLY H H 22 8.144 8.144 7.323 0.821 19668 11221 1 31 . 1 1 23 23 GLY N N 23 108.242 108.242 105.731 2.511 19668 11222 1 31 . 1 1 23 23 GLY C C 23 174.110 174.110 172.759 1.351 19668 11223 1 31 . 1 1 23 23 GLY CA C 23 44.684 44.684 44.849 -0.165 19668 11224 1 31 . 1 1 23 23 GLY H H 23 8.157 8.157 8.173 -0.016 19668 11225 1 31 . 1 1 24 24 GLY N N 24 106.969 106.969 109.011 -2.042 19668 11226 1 31 . 1 1 24 24 GLY C C 24 175.172 175.172 174.686 0.486 19668 11227 1 31 . 1 1 24 24 GLY CA C 24 44.439 44.439 44.878 -0.439 19668 11228 1 31 . 1 1 24 24 GLY H H 24 8.466 8.466 8.201 0.265 19668 11229 1 31 . 1 1 25 25 GLY N N 25 108.946 108.946 113.972 -5.026 19668 11230 1 31 . 1 1 25 25 GLY C C 25 176.321 176.321 175.021 1.300 19668 11231 1 31 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.319 1.780 19668 11232 1 31 . 1 1 25 25 GLY H H 25 8.618 8.618 7.990 0.628 19668 11233 1 31 . 1 1 26 26 ARG N N 26 123.559 123.559 124.202 -0.643 19668 11234 1 31 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.114 0.165 19668 11235 1 31 . 1 1 26 26 ARG C C 26 178.076 178.076 178.499 -0.423 19668 11236 1 31 . 1 1 26 26 ARG CA C 26 57.915 57.915 59.133 -1.218 19668 11237 1 31 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.228 -0.318 19668 11238 1 31 . 1 1 26 26 ARG H H 26 8.789 8.789 8.390 0.399 19668 11239 1 31 . 1 1 27 27 ILE N N 27 118.726 118.726 117.922 0.804 19668 11240 1 31 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.802 -0.016 19668 11241 1 31 . 1 1 27 27 ILE C C 27 177.639 177.639 178.007 -0.368 19668 11242 1 31 . 1 1 27 27 ILE CA C 27 63.624 63.624 65.140 -1.516 19668 11243 1 31 . 1 1 27 27 ILE CB C 27 36.955 36.955 37.260 -0.305 19668 11244 1 31 . 1 1 27 27 ILE H H 27 7.762 7.762 8.200 -0.438 19668 11245 1 31 . 1 1 28 28 GLU N N 28 119.843 119.843 119.338 0.505 19668 11246 1 31 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.033 -0.020 19668 11247 1 31 . 1 1 28 28 GLU C C 28 179.447 179.447 179.057 0.390 19668 11248 1 31 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.925 -0.342 19668 11249 1 31 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.313 -0.253 19668 11250 1 31 . 1 1 28 28 GLU H H 28 7.867 7.867 8.419 -0.552 19668 11251 1 31 . 1 1 29 29 GLU N N 29 118.447 118.447 119.402 -0.955 19668 11252 1 31 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.027 0.060 19668 11253 1 31 . 1 1 29 29 GLU C C 29 179.310 179.310 178.989 0.321 19668 11254 1 31 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.998 0.282 19668 11255 1 31 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.142 0.194 19668 11256 1 31 . 1 1 29 29 GLU H H 29 7.755 7.755 8.536 -0.781 19668 11257 1 31 . 1 1 30 30 LEU N N 30 121.135 121.135 120.709 0.426 19668 11258 1 31 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.002 0.094 19668 11259 1 31 . 1 1 30 30 LEU C C 30 178.928 178.928 178.601 0.327 19668 11260 1 31 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.389 -0.284 19668 11261 1 31 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.046 -0.366 19668 11262 1 31 . 1 1 30 30 LEU H H 30 7.785 7.785 7.658 0.127 19668 11263 1 31 . 1 1 31 31 LYS N N 31 119.130 119.130 117.268 1.862 19668 11264 1 31 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.144 -0.274 19668 11265 1 31 . 1 1 31 31 LYS C C 31 179.104 179.104 178.916 0.188 19668 11266 1 31 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.194 1.522 19668 11267 1 31 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.793 0.463 19668 11268 1 31 . 1 1 31 31 LYS H H 31 8.413 8.413 7.704 0.709 19668 11269 1 31 . 1 1 32 32 LYS N N 32 119.200 119.200 119.359 -0.159 19668 11270 1 31 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.997 0.105 19668 11271 1 31 . 1 1 32 32 LYS C C 32 179.420 179.420 179.029 0.391 19668 11272 1 31 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.445 0.012 19668 11273 1 31 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.133 0.133 19668 11274 1 31 . 1 1 32 32 LYS H H 32 7.826 7.826 7.563 0.263 19668 11275 1 31 . 1 1 33 33 LYS N N 33 120.322 120.322 119.237 1.085 19668 11276 1 31 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.029 0.134 19668 11277 1 31 . 1 1 33 33 LYS C C 33 179.174 179.174 178.944 0.230 19668 11278 1 31 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.906 -0.158 19668 11279 1 31 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.219 -0.480 19668 11280 1 31 . 1 1 33 33 LYS H H 33 8.003 8.003 7.504 0.499 19668 11281 1 31 . 1 1 34 34 TYR N N 34 120.223 120.223 119.849 0.374 19668 11282 1 31 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.091 -0.035 19668 11283 1 31 . 1 1 34 34 TYR C C 34 176.356 176.356 177.873 -1.517 19668 11284 1 31 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.814 -0.759 19668 11285 1 31 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.226 -0.199 19668 11286 1 31 . 1 1 34 34 TYR H H 34 8.614 8.614 7.577 1.037 19668 11287 1 31 . 1 1 35 35 GLU N N 35 118.813 118.813 117.283 1.530 19668 11288 1 31 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.974 -0.249 19668 11289 1 31 . 1 1 35 35 GLU C C 35 179.787 179.787 179.051 0.736 19668 11290 1 31 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.701 -0.262 19668 11291 1 31 . 1 1 35 35 GLU CB C 35 29.128 29.128 28.887 0.240 19668 11292 1 31 . 1 1 35 35 GLU H H 35 8.103 8.103 7.816 0.287 19668 11293 1 31 . 1 1 36 36 GLU N N 36 119.670 119.670 119.737 -0.067 19668 11294 1 31 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.090 -0.076 19668 11295 1 31 . 1 1 36 36 GLU C C 36 179.295 179.295 178.965 0.330 19668 11296 1 31 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.368 -0.105 19668 11297 1 31 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.465 0.104 19668 11298 1 31 . 1 1 36 36 GLU H H 36 8.028 8.028 7.575 0.453 19668 11299 1 31 . 1 1 37 37 LEU N N 37 121.416 121.416 120.219 1.197 19668 11300 1 31 . 1 1 37 37 LEU HA H 37 4.019 4.019 4.019 0.000 19668 11301 1 31 . 1 1 37 37 LEU C C 37 178.277 178.277 179.129 -0.852 19668 11302 1 31 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.902 -0.062 19668 11303 1 31 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.275 0.354 19668 11304 1 31 . 1 1 37 37 LEU H H 37 8.176 8.176 7.322 0.854 19668 11305 1 31 . 1 1 38 38 LYS N N 38 118.998 118.998 118.609 0.389 19668 11306 1 31 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.936 -0.276 19668 11307 1 31 . 1 1 38 38 LYS C C 38 178.923 178.923 178.895 0.028 19668 11308 1 31 . 1 1 38 38 LYS CA C 38 60.400 60.400 60.100 0.300 19668 11309 1 31 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.357 -0.295 19668 11310 1 31 . 1 1 38 38 LYS H H 38 8.260 8.260 7.653 0.607 19668 11311 1 31 . 1 1 39 39 LYS N N 39 118.070 118.070 118.216 -0.146 19668 11312 1 31 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.115 -0.035 19668 11313 1 31 . 1 1 39 39 LYS C C 39 178.687 178.687 178.807 -0.120 19668 11314 1 31 . 1 1 39 39 LYS CA C 39 58.936 58.936 58.996 -0.060 19668 11315 1 31 . 1 1 39 39 LYS CB C 39 32.149 32.149 31.874 0.275 19668 11316 1 31 . 1 1 39 39 LYS H H 39 7.380 7.380 7.485 -0.105 19668 11317 1 31 . 1 1 40 40 LYS N N 40 118.894 118.894 120.207 -1.313 19668 11318 1 31 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.052 0.007 19668 11319 1 31 . 1 1 40 40 LYS C C 40 179.758 179.758 179.185 0.573 19668 11320 1 31 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.251 -0.188 19668 11321 1 31 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.449 -0.061 19668 11322 1 31 . 1 1 40 40 LYS H H 40 7.919 7.919 7.401 0.518 19668 11323 1 31 . 1 1 41 41 ILE N N 41 118.270 118.270 118.583 -0.313 19668 11324 1 31 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.778 -0.081 19668 11325 1 31 . 1 1 41 41 ILE C C 41 178.211 178.211 178.073 0.138 19668 11326 1 31 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.857 -0.143 19668 11327 1 31 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.818 0.021 19668 11328 1 31 . 1 1 41 41 ILE H H 41 8.199 8.199 7.576 0.623 19668 11329 1 31 . 1 1 42 42 GLU N N 42 120.117 120.117 118.140 1.977 19668 11330 1 31 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.063 0.028 19668 11331 1 31 . 1 1 42 42 GLU C C 42 178.736 178.736 177.508 1.228 19668 11332 1 31 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.947 -0.067 19668 11333 1 31 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.761 -0.370 19668 11334 1 31 . 1 1 42 42 GLU H H 42 7.738 7.738 7.548 0.190 19668 11335 1 31 . 1 1 43 43 GLU N N 43 117.194 117.194 116.506 0.688 19668 11336 1 31 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.227 0.072 19668 11337 1 31 . 1 1 43 43 GLU C C 43 177.658 177.658 176.765 0.893 19668 11338 1 31 . 1 1 43 43 GLU CA C 43 56.793 56.793 56.856 -0.063 19668 11339 1 31 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.299 -0.366 19668 11340 1 31 . 1 1 43 43 GLU H H 43 7.698 7.698 7.564 0.134 19668 11341 1 31 . 1 1 44 44 LEU N N 44 120.812 120.812 119.926 0.886 19668 11342 1 31 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.103 0.136 19668 11343 1 31 . 1 1 44 44 LEU C C 44 178.682 178.682 176.686 1.996 19668 11344 1 31 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.762 0.734 19668 11345 1 31 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.562 0.084 19668 11346 1 31 . 1 1 44 44 LEU H H 44 7.593 7.593 7.107 0.486 19668 11347 1 31 . 1 1 45 45 GLY N N 45 108.681 108.681 109.970 -1.289 19668 11348 1 31 . 1 1 45 45 GLY C C 45 174.957 174.957 174.238 0.719 19668 11349 1 31 . 1 1 45 45 GLY CA C 45 46.086 46.086 44.685 1.401 19668 11350 1 31 . 1 1 45 45 GLY H H 45 8.234 8.234 8.483 -0.249 19668 11351 1 31 . 1 1 46 46 GLY N N 46 108.057 108.057 109.677 -1.620 19668 11352 1 31 . 1 1 46 46 GLY C C 46 174.777 174.777 174.876 -0.099 19668 11353 1 31 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.583 0.781 19668 11354 1 31 . 1 1 46 46 GLY H H 46 8.182 8.182 8.112 0.070 19668 11355 1 31 . 1 1 47 47 GLY N N 47 108.494 108.494 105.860 2.634 19668 11356 1 31 . 1 1 47 47 GLY C C 47 174.572 174.572 174.360 0.212 19668 11357 1 31 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.742 0.413 19668 11358 1 31 . 1 1 47 47 GLY H H 47 8.087 8.087 8.270 -0.183 19668 11359 1 31 . 1 1 48 48 GLY N N 48 108.285 108.285 108.877 -0.592 19668 11360 1 31 . 1 1 48 48 GLY C C 48 174.495 174.495 175.473 -0.978 19668 11361 1 31 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.336 0.118 19668 11362 1 31 . 1 1 48 48 GLY H H 48 8.323 8.323 8.436 -0.113 19668 11363 1 31 . 1 1 49 49 GLU N N 49 121.070 121.070 121.589 -0.519 19668 11364 1 31 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.389 0.028 19668 11365 1 31 . 1 1 49 49 GLU C C 49 177.226 177.226 178.318 -1.092 19668 11366 1 31 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.220 -0.649 19668 11367 1 31 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.913 -0.247 19668 11368 1 31 . 1 1 49 49 GLU H H 49 8.483 8.483 8.317 0.166 19668 11369 1 31 . 1 1 50 50 VAL N N 50 121.794 121.794 118.867 2.927 19668 11370 1 31 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.643 0.138 19668 11371 1 31 . 1 1 50 50 VAL C C 50 176.860 176.860 177.432 -0.572 19668 11372 1 31 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.975 -0.895 19668 11373 1 31 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.390 0.862 19668 11374 1 31 . 1 1 50 50 VAL H H 50 8.068 8.068 8.096 -0.028 19668 11375 1 31 . 1 1 51 51 LYS N N 51 120.593 120.593 119.540 1.053 19668 11376 1 31 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.369 -0.162 19668 11377 1 31 . 1 1 51 51 LYS C C 51 178.667 178.667 178.907 -0.240 19668 11378 1 31 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.252 0.083 19668 11379 1 31 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.723 0.535 19668 11380 1 31 . 1 1 51 51 LYS H H 51 8.253 8.253 8.357 -0.104 19668 11381 1 31 . 1 1 52 52 LYS N N 52 117.572 117.572 119.224 -1.652 19668 11382 1 31 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.092 0.076 19668 11383 1 31 . 1 1 52 52 LYS C C 52 179.248 179.248 178.648 0.600 19668 11384 1 31 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.004 0.010 19668 11385 1 31 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.340 -0.160 19668 11386 1 31 . 1 1 52 52 LYS H H 52 7.629 7.629 7.708 -0.079 19668 11387 1 31 . 1 1 53 53 VAL N N 53 119.059 119.059 118.793 0.266 19668 11388 1 31 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.684 0.108 19668 11389 1 31 . 1 1 53 53 VAL C C 53 177.987 177.987 177.670 0.317 19668 11390 1 31 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.642 -0.611 19668 11391 1 31 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.762 -0.392 19668 11392 1 31 . 1 1 53 53 VAL H H 53 7.638 7.638 7.273 0.365 19668 11393 1 31 . 1 1 54 54 GLU N N 54 120.388 120.388 119.377 1.011 19668 11394 1 31 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.920 -0.076 19668 11395 1 31 . 1 1 54 54 GLU C C 54 179.624 179.624 178.963 0.661 19668 11396 1 31 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.784 0.457 19668 11397 1 31 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.174 0.644 19668 11398 1 31 . 1 1 54 54 GLU H H 54 8.603 8.603 7.619 0.984 19668 11399 1 31 . 1 1 55 55 GLU N N 55 118.533 118.533 118.942 -0.409 19668 11400 1 31 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.054 0.035 19668 11401 1 31 . 1 1 55 55 GLU C C 55 179.158 179.158 178.955 0.203 19668 11402 1 31 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.117 0.217 19668 11403 1 31 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.500 -0.163 19668 11404 1 31 . 1 1 55 55 GLU H H 55 7.904 7.904 7.586 0.318 19668 11405 1 31 . 1 1 56 56 GLU N N 56 120.258 120.258 119.597 0.661 19668 11406 1 31 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.043 0.057 19668 11407 1 31 . 1 1 56 56 GLU C C 56 179.867 179.867 179.261 0.606 19668 11408 1 31 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.145 0.518 19668 11409 1 31 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.421 0.629 19668 11410 1 31 . 1 1 56 56 GLU H H 56 7.902 7.902 7.412 0.490 19668 11411 1 31 . 1 1 57 57 VAL N N 57 121.168 121.168 120.154 1.014 19668 11412 1 31 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.570 -0.002 19668 11413 1 31 . 1 1 57 57 VAL C C 57 176.994 176.994 177.397 -0.403 19668 11414 1 31 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.686 2.211 19668 11415 1 31 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.452 0.075 19668 11416 1 31 . 1 1 57 57 VAL H H 57 8.613 8.613 7.522 1.091 19668 11417 1 31 . 1 1 58 58 LYS N N 58 120.234 120.234 118.271 1.963 19668 11418 1 31 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.938 0.264 19668 11419 1 31 . 1 1 58 58 LYS C C 58 179.131 179.131 178.845 0.286 19668 11420 1 31 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.647 -0.060 19668 11421 1 31 . 1 1 58 58 LYS CB C 58 32.291 32.291 32.112 0.179 19668 11422 1 31 . 1 1 58 58 LYS H H 58 7.810 7.810 7.469 0.341 19668 11423 1 31 . 1 1 59 59 LYS N N 59 118.301 118.301 118.666 -0.365 19668 11424 1 31 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.021 0.072 19668 11425 1 31 . 1 1 59 59 LYS C C 59 179.281 179.281 178.514 0.767 19668 11426 1 31 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.076 0.352 19668 11427 1 31 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.054 0.325 19668 11428 1 31 . 1 1 59 59 LYS H H 59 7.876 7.876 7.365 0.511 19668 11429 1 31 . 1 1 60 60 LEU N N 60 121.224 121.224 120.161 1.063 19668 11430 1 31 . 1 1 60 60 LEU HA H 60 4.234 4.234 3.964 0.270 19668 11431 1 31 . 1 1 60 60 LEU C C 60 178.636 178.636 178.714 -0.078 19668 11432 1 31 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.789 0.368 19668 11433 1 31 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.267 0.367 19668 11434 1 31 . 1 1 60 60 LEU H H 60 7.893 7.893 7.564 0.329 19668 11435 1 31 . 1 1 61 61 GLU N N 61 118.660 118.660 117.923 0.737 19668 11436 1 31 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.052 -0.253 19668 11437 1 31 . 1 1 61 61 GLU C C 61 179.094 179.094 178.757 0.337 19668 11438 1 31 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.167 1.105 19668 11439 1 31 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.758 1.245 19668 11440 1 31 . 1 1 61 61 GLU H H 61 8.644 8.644 7.778 0.866 19668 11441 1 31 . 1 1 62 62 GLU N N 62 117.555 117.555 119.477 -1.922 19668 11442 1 31 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.015 -0.019 19668 11443 1 31 . 1 1 62 62 GLU C C 62 178.940 178.940 179.051 -0.111 19668 11444 1 31 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.375 -0.207 19668 11445 1 31 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.272 0.275 19668 11446 1 31 . 1 1 62 62 GLU H H 62 7.995 7.995 7.557 0.438 19668 11447 1 31 . 1 1 63 63 GLU N N 63 119.097 119.097 118.192 0.905 19668 11448 1 31 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.144 -0.115 19668 11449 1 31 . 1 1 63 63 GLU C C 63 179.890 179.890 178.989 0.901 19668 11450 1 31 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.855 0.485 19668 11451 1 31 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.254 0.413 19668 11452 1 31 . 1 1 63 63 GLU H H 63 7.983 7.983 7.678 0.305 19668 11453 1 31 . 1 1 64 64 ILE N N 64 118.247 118.247 119.177 -0.930 19668 11454 1 31 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.836 -0.116 19668 11455 1 31 . 1 1 64 64 ILE C C 64 177.858 177.858 177.988 -0.130 19668 11456 1 31 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.293 0.203 19668 11457 1 31 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.444 0.537 19668 11458 1 31 . 1 1 64 64 ILE H H 64 8.261 8.261 7.236 1.025 19668 11459 1 31 . 1 1 65 65 LYS N N 65 118.693 118.693 117.635 1.058 19668 11460 1 31 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.169 -0.071 19668 11461 1 31 . 1 1 65 65 LYS C C 65 177.244 177.244 177.553 -0.309 19668 11462 1 31 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.452 0.201 19668 11463 1 31 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.316 0.389 19668 11464 1 31 . 1 1 65 65 LYS H H 65 7.661 7.661 7.604 0.057 19668 11465 1 31 . 1 1 66 66 LYS N N 66 116.933 116.933 117.706 -0.773 19668 11466 1 31 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.187 0.151 19668 11467 1 31 . 1 1 66 66 LYS C C 66 176.011 176.011 177.225 -1.214 19668 11468 1 31 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.602 -1.143 19668 11469 1 31 . 1 1 66 66 LYS CB C 66 33.131 33.131 33.176 -0.045 19668 11470 1 31 . 1 1 66 66 LYS H H 66 7.261 7.261 7.633 -0.372 19668 11471 1 32 . 1 1 2 2 SER HA H 2 4.560 4.560 4.142 0.418 19668 11472 1 32 . 1 1 2 2 SER CA C 2 58.366 58.366 60.413 -2.047 19668 11473 1 32 . 1 1 3 3 ARG N N 3 125.213 125.213 120.524 4.689 19668 11474 1 32 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.216 0.050 19668 11475 1 32 . 1 1 3 3 ARG C C 3 178.381 178.381 178.217 0.164 19668 11476 1 32 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.773 -0.377 19668 11477 1 32 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.958 0.697 19668 11478 1 32 . 1 1 3 3 ARG H H 3 8.874 8.874 8.418 0.456 19668 11479 1 32 . 1 1 4 4 VAL N N 4 119.320 119.320 119.950 -0.630 19668 11480 1 32 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.824 -0.026 19668 11481 1 32 . 1 1 4 4 VAL C C 4 177.004 177.004 177.743 -0.739 19668 11482 1 32 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.688 -0.173 19668 11483 1 32 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.105 0.698 19668 11484 1 32 . 1 1 4 4 VAL H H 4 8.112 8.112 7.739 0.373 19668 11485 1 32 . 1 1 5 5 LYS N N 5 122.279 122.279 120.987 1.292 19668 11486 1 32 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.050 0.112 19668 11487 1 32 . 1 1 5 5 LYS C C 5 178.547 178.547 178.291 0.256 19668 11488 1 32 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.834 -0.076 19668 11489 1 32 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.748 0.262 19668 11490 1 32 . 1 1 5 5 LYS H H 5 7.847 7.847 8.293 -0.446 19668 11491 1 32 . 1 1 6 6 ALA N N 6 120.295 120.295 121.652 -1.357 19668 11492 1 32 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.040 0.171 19668 11493 1 32 . 1 1 6 6 ALA C C 6 180.834 180.834 179.202 1.632 19668 11494 1 32 . 1 1 6 6 ALA CA C 6 54.903 54.903 55.225 -0.322 19668 11495 1 32 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.100 0.032 19668 11496 1 32 . 1 1 6 6 ALA H H 6 7.975 7.975 7.633 0.342 19668 11497 1 32 . 1 1 7 7 LEU N N 7 119.570 119.570 118.519 1.051 19668 11498 1 32 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.075 0.097 19668 11499 1 32 . 1 1 7 7 LEU C C 7 178.431 178.431 178.770 -0.339 19668 11500 1 32 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.816 -0.137 19668 11501 1 32 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.089 0.946 19668 11502 1 32 . 1 1 7 7 LEU H H 7 7.650 7.650 7.509 0.141 19668 11503 1 32 . 1 1 8 8 GLU N N 8 119.934 119.934 118.480 1.454 19668 11504 1 32 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.081 -0.222 19668 11505 1 32 . 1 1 8 8 GLU C C 8 179.534 179.534 178.398 1.136 19668 11506 1 32 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.323 0.714 19668 11507 1 32 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.781 0.686 19668 11508 1 32 . 1 1 8 8 GLU H H 8 8.411 8.411 7.873 0.538 19668 11509 1 32 . 1 1 9 9 GLU N N 9 118.234 118.234 119.036 -0.802 19668 11510 1 32 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.051 0.009 19668 11511 1 32 . 1 1 9 9 GLU C C 9 179.596 179.596 178.934 0.662 19668 11512 1 32 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.327 0.003 19668 11513 1 32 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.284 0.134 19668 11514 1 32 . 1 1 9 9 GLU H H 9 8.206 8.206 7.717 0.489 19668 11515 1 32 . 1 1 10 10 LYS N N 10 121.042 121.042 118.971 2.071 19668 11516 1 32 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.148 0.035 19668 11517 1 32 . 1 1 10 10 LYS C C 10 179.380 179.380 179.080 0.300 19668 11518 1 32 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.106 0.219 19668 11519 1 32 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.140 0.269 19668 11520 1 32 . 1 1 10 10 LYS H H 10 7.931 7.931 7.562 0.369 19668 11521 1 32 . 1 1 11 11 VAL N N 11 118.662 118.662 120.129 -1.467 19668 11522 1 32 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.814 0.000 19668 11523 1 32 . 1 1 11 11 VAL C C 11 178.845 178.845 178.162 0.683 19668 11524 1 32 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.252 0.736 19668 11525 1 32 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.646 0.008 19668 11526 1 32 . 1 1 11 11 VAL H H 11 8.371 8.371 7.585 0.786 19668 11527 1 32 . 1 1 12 12 LYS N N 12 123.188 123.188 119.519 3.669 19668 11528 1 32 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.989 0.237 19668 11529 1 32 . 1 1 12 12 LYS C C 12 179.098 179.098 178.321 0.777 19668 11530 1 32 . 1 1 12 12 LYS CA C 12 59.483 59.483 58.872 0.611 19668 11531 1 32 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.166 0.040 19668 11532 1 32 . 1 1 12 12 LYS H H 12 8.276 8.276 7.528 0.748 19668 11533 1 32 . 1 1 13 13 ALA N N 13 121.169 121.169 121.779 -0.610 19668 11534 1 32 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.070 0.188 19668 11535 1 32 . 1 1 13 13 ALA C C 13 180.169 180.169 179.754 0.415 19668 11536 1 32 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.825 -0.189 19668 11537 1 32 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.239 -0.132 19668 11538 1 32 . 1 1 13 13 ALA H H 13 7.829 7.829 7.449 0.380 19668 11539 1 32 . 1 1 14 14 LEU N N 14 118.104 118.104 118.786 -0.682 19668 11540 1 32 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.956 0.200 19668 11541 1 32 . 1 1 14 14 LEU C C 14 177.614 177.614 178.060 -0.446 19668 11542 1 32 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.083 -0.478 19668 11543 1 32 . 1 1 14 14 LEU CB C 14 42.795 42.795 42.056 0.739 19668 11544 1 32 . 1 1 14 14 LEU H H 14 7.781 7.781 7.462 0.319 19668 11545 1 32 . 1 1 15 15 GLU N N 15 120.632 120.632 119.327 1.305 19668 11546 1 32 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.385 -0.018 19668 11547 1 32 . 1 1 15 15 GLU C C 15 178.243 178.243 178.428 -0.185 19668 11548 1 32 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.771 0.815 19668 11549 1 32 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.285 0.544 19668 11550 1 32 . 1 1 15 15 GLU H H 15 7.873 7.873 7.413 0.460 19668 11551 1 32 . 1 1 16 16 GLU N N 16 115.775 115.775 117.165 -1.390 19668 11552 1 32 . 1 1 16 16 GLU HA H 16 3.959 3.959 3.969 -0.010 19668 11553 1 32 . 1 1 16 16 GLU C C 16 179.006 179.006 178.560 0.446 19668 11554 1 32 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.249 -0.158 19668 11555 1 32 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.122 0.231 19668 11556 1 32 . 1 1 16 16 GLU H H 16 7.926 7.926 7.857 0.069 19668 11557 1 32 . 1 1 17 17 LYS N N 17 118.801 118.801 119.361 -0.560 19668 11558 1 32 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.070 0.024 19668 11559 1 32 . 1 1 17 17 LYS C C 17 178.853 178.853 178.600 0.253 19668 11560 1 32 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.622 -0.151 19668 11561 1 32 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.921 0.441 19668 11562 1 32 . 1 1 17 17 LYS H H 17 7.518 7.518 7.477 0.041 19668 11563 1 32 . 1 1 18 18 VAL N N 18 118.034 118.034 120.175 -2.141 19668 11564 1 32 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.615 -0.103 19668 11565 1 32 . 1 1 18 18 VAL C C 18 178.362 178.362 177.594 0.768 19668 11566 1 32 . 1 1 18 18 VAL CA C 18 66.019 66.019 66.531 -0.512 19668 11567 1 32 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.547 0.102 19668 11568 1 32 . 1 1 18 18 VAL H H 18 8.048 8.048 7.422 0.626 19668 11569 1 32 . 1 1 19 19 LYS N N 19 118.427 118.427 117.493 0.934 19668 11570 1 32 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.047 -0.037 19668 11571 1 32 . 1 1 19 19 LYS C C 19 177.706 177.706 177.340 0.366 19668 11572 1 32 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.711 0.274 19668 11573 1 32 . 1 1 19 19 LYS CB C 19 32.424 32.424 32.002 0.422 19668 11574 1 32 . 1 1 19 19 LYS H H 19 8.008 8.008 7.436 0.572 19668 11575 1 32 . 1 1 20 20 ALA N N 20 119.177 119.177 120.384 -1.207 19668 11576 1 32 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.345 -0.029 19668 11577 1 32 . 1 1 20 20 ALA C C 20 178.269 178.269 178.637 -0.368 19668 11578 1 32 . 1 1 20 20 ALA CA C 20 52.631 52.631 52.674 -0.043 19668 11579 1 32 . 1 1 20 20 ALA CB C 20 19.133 19.133 19.253 -0.120 19668 11580 1 32 . 1 1 20 20 ALA H H 20 7.259 7.259 7.443 -0.184 19668 11581 1 32 . 1 1 21 21 LEU N N 21 118.596 118.596 116.557 2.039 19668 11582 1 32 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.253 0.008 19668 11583 1 32 . 1 1 21 21 LEU C C 21 177.732 177.732 177.416 0.316 19668 11584 1 32 . 1 1 21 21 LEU CA C 21 55.657 55.657 56.265 -0.608 19668 11585 1 32 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.501 0.632 19668 11586 1 32 . 1 1 21 21 LEU H H 21 7.373 7.373 7.288 0.085 19668 11587 1 32 . 1 1 22 22 GLY N N 22 107.926 107.926 105.585 2.341 19668 11588 1 32 . 1 1 22 22 GLY C C 22 173.362 173.362 172.479 0.883 19668 11589 1 32 . 1 1 22 22 GLY CA C 22 45.197 45.197 45.272 -0.075 19668 11590 1 32 . 1 1 22 22 GLY H H 22 8.144 8.144 7.492 0.652 19668 11591 1 32 . 1 1 23 23 GLY N N 23 108.242 108.242 106.985 1.257 19668 11592 1 32 . 1 1 23 23 GLY C C 23 174.110 174.110 173.031 1.079 19668 11593 1 32 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.294 -0.610 19668 11594 1 32 . 1 1 23 23 GLY H H 23 8.157 8.157 7.948 0.209 19668 11595 1 32 . 1 1 24 24 GLY N N 24 106.969 106.969 109.296 -2.327 19668 11596 1 32 . 1 1 24 24 GLY C C 24 175.172 175.172 174.868 0.304 19668 11597 1 32 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.032 -0.593 19668 11598 1 32 . 1 1 24 24 GLY H H 24 8.466 8.466 7.864 0.602 19668 11599 1 32 . 1 1 25 25 GLY N N 25 108.946 108.946 107.423 1.523 19668 11600 1 32 . 1 1 25 25 GLY C C 25 176.321 176.321 176.027 0.294 19668 11601 1 32 . 1 1 25 25 GLY CA C 25 47.099 47.099 46.135 0.964 19668 11602 1 32 . 1 1 25 25 GLY H H 25 8.618 8.618 8.351 0.267 19668 11603 1 32 . 1 1 26 26 ARG N N 26 123.559 123.559 120.794 2.765 19668 11604 1 32 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.430 -0.151 19668 11605 1 32 . 1 1 26 26 ARG C C 26 178.076 178.076 178.154 -0.078 19668 11606 1 32 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.292 -0.377 19668 11607 1 32 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.288 -0.378 19668 11608 1 32 . 1 1 26 26 ARG H H 26 8.789 8.789 8.404 0.385 19668 11609 1 32 . 1 1 27 27 ILE N N 27 118.726 118.726 118.836 -0.110 19668 11610 1 32 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.877 -0.091 19668 11611 1 32 . 1 1 27 27 ILE C C 27 177.639 177.639 178.227 -0.588 19668 11612 1 32 . 1 1 27 27 ILE CA C 27 63.624 63.624 63.300 0.324 19668 11613 1 32 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.661 0.294 19668 11614 1 32 . 1 1 27 27 ILE H H 27 7.762 7.762 8.073 -0.311 19668 11615 1 32 . 1 1 28 28 GLU N N 28 119.843 119.843 119.148 0.695 19668 11616 1 32 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.035 -0.022 19668 11617 1 32 . 1 1 28 28 GLU C C 28 179.447 179.447 178.998 0.449 19668 11618 1 32 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.678 -0.095 19668 11619 1 32 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.384 -0.324 19668 11620 1 32 . 1 1 28 28 GLU H H 28 7.867 7.867 7.750 0.117 19668 11621 1 32 . 1 1 29 29 GLU N N 29 118.447 118.447 119.294 -0.847 19668 11622 1 32 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.063 0.024 19668 11623 1 32 . 1 1 29 29 GLU C C 29 179.310 179.310 178.888 0.422 19668 11624 1 32 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.721 0.559 19668 11625 1 32 . 1 1 29 29 GLU CB C 29 29.336 29.336 28.841 0.495 19668 11626 1 32 . 1 1 29 29 GLU H H 29 7.755 7.755 7.694 0.061 19668 11627 1 32 . 1 1 30 30 LEU N N 30 121.135 121.135 120.813 0.322 19668 11628 1 32 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.004 0.092 19668 11629 1 32 . 1 1 30 30 LEU C C 30 178.928 178.928 178.715 0.213 19668 11630 1 32 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.264 -0.159 19668 11631 1 32 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.097 -0.417 19668 11632 1 32 . 1 1 30 30 LEU H H 30 7.785 7.785 7.597 0.188 19668 11633 1 32 . 1 1 31 31 LYS N N 31 119.130 119.130 117.802 1.328 19668 11634 1 32 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.100 -0.230 19668 11635 1 32 . 1 1 31 31 LYS C C 31 179.104 179.104 178.987 0.117 19668 11636 1 32 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.388 1.329 19668 11637 1 32 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.858 0.399 19668 11638 1 32 . 1 1 31 31 LYS H H 31 8.413 8.413 7.589 0.824 19668 11639 1 32 . 1 1 32 32 LYS N N 32 119.200 119.200 119.823 -0.623 19668 11640 1 32 . 1 1 32 32 LYS HA H 32 4.102 4.102 3.999 0.103 19668 11641 1 32 . 1 1 32 32 LYS C C 32 179.420 179.420 179.047 0.373 19668 11642 1 32 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.674 -0.217 19668 11643 1 32 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.132 0.134 19668 11644 1 32 . 1 1 32 32 LYS H H 32 7.826 7.826 7.537 0.289 19668 11645 1 32 . 1 1 33 33 LYS N N 33 120.322 120.322 119.037 1.285 19668 11646 1 32 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.043 0.120 19668 11647 1 32 . 1 1 33 33 LYS C C 33 179.174 179.174 178.615 0.559 19668 11648 1 32 . 1 1 33 33 LYS CA C 33 58.748 58.748 59.083 -0.335 19668 11649 1 32 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.349 -0.609 19668 11650 1 32 . 1 1 33 33 LYS H H 33 8.003 8.003 7.491 0.512 19668 11651 1 32 . 1 1 34 34 TYR N N 34 120.223 120.223 119.557 0.666 19668 11652 1 32 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.103 -0.047 19668 11653 1 32 . 1 1 34 34 TYR C C 34 176.356 176.356 178.055 -1.699 19668 11654 1 32 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.658 -0.603 19668 11655 1 32 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.325 -0.298 19668 11656 1 32 . 1 1 34 34 TYR H H 34 8.614 8.614 7.566 1.048 19668 11657 1 32 . 1 1 35 35 GLU N N 35 118.813 118.813 117.397 1.416 19668 11658 1 32 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.936 -0.211 19668 11659 1 32 . 1 1 35 35 GLU C C 35 179.787 179.787 178.722 1.065 19668 11660 1 32 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.773 -0.334 19668 11661 1 32 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.000 0.128 19668 11662 1 32 . 1 1 35 35 GLU H H 35 8.103 8.103 7.860 0.243 19668 11663 1 32 . 1 1 36 36 GLU N N 36 119.670 119.670 119.711 -0.041 19668 11664 1 32 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.079 -0.065 19668 11665 1 32 . 1 1 36 36 GLU C C 36 179.295 179.295 178.956 0.339 19668 11666 1 32 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.175 0.088 19668 11667 1 32 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.532 0.037 19668 11668 1 32 . 1 1 36 36 GLU H H 36 8.028 8.028 7.681 0.347 19668 11669 1 32 . 1 1 37 37 LEU N N 37 121.416 121.416 119.886 1.530 19668 11670 1 32 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.993 0.026 19668 11671 1 32 . 1 1 37 37 LEU C C 37 178.277 178.277 179.052 -0.775 19668 11672 1 32 . 1 1 37 37 LEU CA C 37 57.840 57.840 58.024 -0.184 19668 11673 1 32 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.442 0.187 19668 11674 1 32 . 1 1 37 37 LEU H H 37 8.176 8.176 7.390 0.786 19668 11675 1 32 . 1 1 38 38 LYS N N 38 118.998 118.998 118.145 0.853 19668 11676 1 32 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.938 -0.278 19668 11677 1 32 . 1 1 38 38 LYS C C 38 178.923 178.923 179.233 -0.310 19668 11678 1 32 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.736 0.664 19668 11679 1 32 . 1 1 38 38 LYS CB C 38 32.062 32.062 31.975 0.087 19668 11680 1 32 . 1 1 38 38 LYS H H 38 8.260 8.260 7.632 0.628 19668 11681 1 32 . 1 1 39 39 LYS N N 39 118.070 118.070 118.458 -0.388 19668 11682 1 32 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.078 0.002 19668 11683 1 32 . 1 1 39 39 LYS C C 39 178.687 178.687 178.792 -0.105 19668 11684 1 32 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.254 -0.318 19668 11685 1 32 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.386 -0.237 19668 11686 1 32 . 1 1 39 39 LYS H H 39 7.380 7.380 7.542 -0.162 19668 11687 1 32 . 1 1 40 40 LYS N N 40 118.894 118.894 119.632 -0.738 19668 11688 1 32 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.076 -0.017 19668 11689 1 32 . 1 1 40 40 LYS C C 40 179.758 179.758 179.233 0.525 19668 11690 1 32 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.282 -0.220 19668 11691 1 32 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.240 0.148 19668 11692 1 32 . 1 1 40 40 LYS H H 40 7.919 7.919 7.371 0.548 19668 11693 1 32 . 1 1 41 41 ILE N N 41 118.270 118.270 118.700 -0.430 19668 11694 1 32 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.785 -0.088 19668 11695 1 32 . 1 1 41 41 ILE C C 41 178.211 178.211 178.062 0.149 19668 11696 1 32 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.702 0.012 19668 11697 1 32 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.695 0.144 19668 11698 1 32 . 1 1 41 41 ILE H H 41 8.199 8.199 7.536 0.663 19668 11699 1 32 . 1 1 42 42 GLU N N 42 120.117 120.117 118.624 1.493 19668 11700 1 32 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.038 0.053 19668 11701 1 32 . 1 1 42 42 GLU C C 42 178.736 178.736 177.432 1.304 19668 11702 1 32 . 1 1 42 42 GLU CA C 42 58.880 58.880 59.081 -0.202 19668 11703 1 32 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.831 -0.440 19668 11704 1 32 . 1 1 42 42 GLU H H 42 7.738 7.738 7.491 0.247 19668 11705 1 32 . 1 1 43 43 GLU N N 43 117.194 117.194 116.266 0.928 19668 11706 1 32 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.158 0.141 19668 11707 1 32 . 1 1 43 43 GLU C C 43 177.658 177.658 176.879 0.779 19668 11708 1 32 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.169 -0.376 19668 11709 1 32 . 1 1 43 43 GLU CB C 43 29.933 29.933 29.932 0.001 19668 11710 1 32 . 1 1 43 43 GLU H H 43 7.698 7.698 7.629 0.069 19668 11711 1 32 . 1 1 44 44 LEU N N 44 120.812 120.812 121.536 -0.724 19668 11712 1 32 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.119 0.120 19668 11713 1 32 . 1 1 44 44 LEU C C 44 178.682 178.682 176.733 1.949 19668 11714 1 32 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.296 1.200 19668 11715 1 32 . 1 1 44 44 LEU CB C 44 42.647 42.647 41.960 0.687 19668 11716 1 32 . 1 1 44 44 LEU H H 44 7.593 7.593 7.157 0.436 19668 11717 1 32 . 1 1 45 45 GLY N N 45 108.681 108.681 111.470 -2.789 19668 11718 1 32 . 1 1 45 45 GLY C C 45 174.957 174.957 174.399 0.558 19668 11719 1 32 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.336 0.750 19668 11720 1 32 . 1 1 45 45 GLY H H 45 8.234 8.234 8.304 -0.070 19668 11721 1 32 . 1 1 46 46 GLY N N 46 108.057 108.057 109.861 -1.804 19668 11722 1 32 . 1 1 46 46 GLY C C 46 174.777 174.777 173.484 1.293 19668 11723 1 32 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.710 0.654 19668 11724 1 32 . 1 1 46 46 GLY H H 46 8.182 8.182 8.219 -0.037 19668 11725 1 32 . 1 1 47 47 GLY N N 47 108.494 108.494 106.856 1.638 19668 11726 1 32 . 1 1 47 47 GLY C C 47 174.572 174.572 173.789 0.783 19668 11727 1 32 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.774 0.381 19668 11728 1 32 . 1 1 47 47 GLY H H 47 8.087 8.087 8.113 -0.026 19668 11729 1 32 . 1 1 48 48 GLY N N 48 108.285 108.285 110.285 -2.000 19668 11730 1 32 . 1 1 48 48 GLY C C 48 174.495 174.495 175.063 -0.568 19668 11731 1 32 . 1 1 48 48 GLY CA C 48 45.454 45.454 46.255 -0.801 19668 11732 1 32 . 1 1 48 48 GLY H H 48 8.323 8.323 8.010 0.313 19668 11733 1 32 . 1 1 49 49 GLU N N 49 121.070 121.070 122.874 -1.804 19668 11734 1 32 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.336 0.081 19668 11735 1 32 . 1 1 49 49 GLU C C 49 177.226 177.226 178.140 -0.914 19668 11736 1 32 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.337 -0.766 19668 11737 1 32 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.341 0.325 19668 11738 1 32 . 1 1 49 49 GLU H H 49 8.483 8.483 8.662 -0.179 19668 11739 1 32 . 1 1 50 50 VAL N N 50 121.794 121.794 115.733 6.061 19668 11740 1 32 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.719 0.062 19668 11741 1 32 . 1 1 50 50 VAL C C 50 176.860 176.860 177.820 -0.960 19668 11742 1 32 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.595 -0.515 19668 11743 1 32 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.050 1.202 19668 11744 1 32 . 1 1 50 50 VAL H H 50 8.068 8.068 7.965 0.103 19668 11745 1 32 . 1 1 51 51 LYS N N 51 120.593 120.593 118.808 1.785 19668 11746 1 32 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.408 -0.201 19668 11747 1 32 . 1 1 51 51 LYS C C 51 178.667 178.667 179.065 -0.398 19668 11748 1 32 . 1 1 51 51 LYS CA C 51 59.335 59.335 58.987 0.348 19668 11749 1 32 . 1 1 51 51 LYS CB C 51 32.258 32.258 32.007 0.251 19668 11750 1 32 . 1 1 51 51 LYS H H 51 8.253 8.253 7.454 0.799 19668 11751 1 32 . 1 1 52 52 LYS N N 52 117.572 117.572 120.196 -2.624 19668 11752 1 32 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.067 0.101 19668 11753 1 32 . 1 1 52 52 LYS C C 52 179.248 179.248 178.790 0.458 19668 11754 1 32 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.181 -0.167 19668 11755 1 32 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.398 -0.217 19668 11756 1 32 . 1 1 52 52 LYS H H 52 7.629 7.629 7.420 0.209 19668 11757 1 32 . 1 1 53 53 VAL N N 53 119.059 119.059 118.662 0.397 19668 11758 1 32 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.630 0.162 19668 11759 1 32 . 1 1 53 53 VAL C C 53 177.987 177.987 177.752 0.235 19668 11760 1 32 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.622 -0.591 19668 11761 1 32 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.343 0.028 19668 11762 1 32 . 1 1 53 53 VAL H H 53 7.638 7.638 7.847 -0.209 19668 11763 1 32 . 1 1 54 54 GLU N N 54 120.388 120.388 118.866 1.522 19668 11764 1 32 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.913 -0.069 19668 11765 1 32 . 1 1 54 54 GLU C C 54 179.624 179.624 178.810 0.814 19668 11766 1 32 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.996 0.245 19668 11767 1 32 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.226 0.592 19668 11768 1 32 . 1 1 54 54 GLU H H 54 8.603 8.603 7.721 0.882 19668 11769 1 32 . 1 1 55 55 GLU N N 55 118.533 118.533 118.651 -0.118 19668 11770 1 32 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.068 0.021 19668 11771 1 32 . 1 1 55 55 GLU C C 55 179.158 179.158 178.776 0.382 19668 11772 1 32 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.865 -0.531 19668 11773 1 32 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.224 0.113 19668 11774 1 32 . 1 1 55 55 GLU H H 55 7.904 7.904 7.686 0.218 19668 11775 1 32 . 1 1 56 56 GLU N N 56 120.258 120.258 119.040 1.218 19668 11776 1 32 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.027 0.073 19668 11777 1 32 . 1 1 56 56 GLU C C 56 179.867 179.867 179.143 0.724 19668 11778 1 32 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.273 0.390 19668 11779 1 32 . 1 1 56 56 GLU CB C 56 30.050 30.050 28.988 1.062 19668 11780 1 32 . 1 1 56 56 GLU H H 56 7.902 7.902 7.511 0.391 19668 11781 1 32 . 1 1 57 57 VAL N N 57 121.168 121.168 119.984 1.184 19668 11782 1 32 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.583 -0.015 19668 11783 1 32 . 1 1 57 57 VAL C C 57 176.994 176.994 177.523 -0.529 19668 11784 1 32 . 1 1 57 57 VAL CA C 57 66.896 66.896 64.720 2.176 19668 11785 1 32 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.456 0.071 19668 11786 1 32 . 1 1 57 57 VAL H H 57 8.613 8.613 7.530 1.083 19668 11787 1 32 . 1 1 58 58 LYS N N 58 120.234 120.234 118.137 2.097 19668 11788 1 32 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.969 0.233 19668 11789 1 32 . 1 1 58 58 LYS C C 58 179.131 179.131 178.958 0.173 19668 11790 1 32 . 1 1 58 58 LYS CA C 58 59.587 59.587 58.968 0.619 19668 11791 1 32 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.768 0.523 19668 11792 1 32 . 1 1 58 58 LYS H H 58 7.810 7.810 7.490 0.320 19668 11793 1 32 . 1 1 59 59 LYS N N 59 118.301 118.301 118.792 -0.491 19668 11794 1 32 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.019 0.074 19668 11795 1 32 . 1 1 59 59 LYS C C 59 179.281 179.281 178.551 0.730 19668 11796 1 32 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.157 0.271 19668 11797 1 32 . 1 1 59 59 LYS CB C 59 32.379 32.379 32.065 0.314 19668 11798 1 32 . 1 1 59 59 LYS H H 59 7.876 7.876 7.429 0.447 19668 11799 1 32 . 1 1 60 60 LEU N N 60 121.224 121.224 120.180 1.044 19668 11800 1 32 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.027 0.207 19668 11801 1 32 . 1 1 60 60 LEU C C 60 178.636 178.636 178.337 0.299 19668 11802 1 32 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.547 0.610 19668 11803 1 32 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.110 0.524 19668 11804 1 32 . 1 1 60 60 LEU H H 60 7.893 7.893 7.671 0.222 19668 11805 1 32 . 1 1 61 61 GLU N N 61 118.660 118.660 118.307 0.353 19668 11806 1 32 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.072 -0.273 19668 11807 1 32 . 1 1 61 61 GLU C C 61 179.094 179.094 178.542 0.552 19668 11808 1 32 . 1 1 61 61 GLU CA C 61 60.272 60.272 58.971 1.301 19668 11809 1 32 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.618 1.385 19668 11810 1 32 . 1 1 61 61 GLU H H 61 8.644 8.644 7.845 0.799 19668 11811 1 32 . 1 1 62 62 GLU N N 62 117.555 117.555 119.270 -1.715 19668 11812 1 32 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.000 -0.004 19668 11813 1 32 . 1 1 62 62 GLU C C 62 178.940 178.940 178.829 0.111 19668 11814 1 32 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.444 -0.276 19668 11815 1 32 . 1 1 62 62 GLU CB C 62 29.547 29.547 28.975 0.572 19668 11816 1 32 . 1 1 62 62 GLU H H 62 7.995 7.995 7.767 0.228 19668 11817 1 32 . 1 1 63 63 GLU N N 63 119.097 119.097 118.802 0.295 19668 11818 1 32 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.109 -0.080 19668 11819 1 32 . 1 1 63 63 GLU C C 63 179.890 179.890 178.797 1.093 19668 11820 1 32 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.957 0.384 19668 11821 1 32 . 1 1 63 63 GLU CB C 63 29.667 29.667 28.937 0.730 19668 11822 1 32 . 1 1 63 63 GLU H H 63 7.983 7.983 7.929 0.054 19668 11823 1 32 . 1 1 64 64 ILE N N 64 118.247 118.247 117.962 0.285 19668 11824 1 32 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.885 -0.165 19668 11825 1 32 . 1 1 64 64 ILE C C 64 177.858 177.858 177.424 0.434 19668 11826 1 32 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.093 0.403 19668 11827 1 32 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.495 0.486 19668 11828 1 32 . 1 1 64 64 ILE H H 64 8.261 8.261 7.217 1.044 19668 11829 1 32 . 1 1 65 65 LYS N N 65 118.693 118.693 118.135 0.558 19668 11830 1 32 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.182 -0.084 19668 11831 1 32 . 1 1 65 65 LYS C C 65 177.244 177.244 177.534 -0.290 19668 11832 1 32 . 1 1 65 65 LYS CA C 65 58.653 58.653 57.807 0.846 19668 11833 1 32 . 1 1 65 65 LYS CB C 65 32.705 32.705 31.935 0.770 19668 11834 1 32 . 1 1 65 65 LYS H H 65 7.661 7.661 7.547 0.114 19668 11835 1 32 . 1 1 66 66 LYS N N 66 116.933 116.933 116.970 -0.037 19668 11836 1 32 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.118 0.220 19668 11837 1 32 . 1 1 66 66 LYS C C 66 176.011 176.011 177.317 -1.306 19668 11838 1 32 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.882 -1.423 19668 11839 1 32 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.775 0.356 19668 11840 1 32 . 1 1 66 66 LYS H H 66 7.261 7.261 7.532 -0.271 19668 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 64 1.705 -0.529 1.633 19668 2 1 1 "Average Difference" HA 73 0.143 -0.018 0.143 19668 3 1 1 "Average Difference" C 64 0.644 -0.253 0.597 19668 4 1 1 "Average Difference" CA 65 0.673 -0.091 0.672 19668 5 1 1 "Average Difference" CB 56 0.481 -0.238 0.422 19668 6 1 1 "Average Difference" HN 64 0.491 -0.343 0.354 19668 7 1 2 "Average Difference" N 64 1.843 -0.302 1.832 19668 8 1 2 "Average Difference" HA 73 0.167 -0.046 0.162 19668 9 1 2 "Average Difference" C 64 0.725 -0.224 0.695 19668 10 1 2 "Average Difference" CA 65 0.740 -0.055 0.743 19668 11 1 2 "Average Difference" CB 56 0.507 -0.253 0.443 19668 12 1 2 "Average Difference" HN 64 0.485 -0.304 0.380 19668 13 1 3 "Average Difference" N 64 1.740 -0.410 1.705 19668 14 1 3 "Average Difference" HA 73 0.175 -0.034 0.173 19668 15 1 3 "Average Difference" C 64 0.665 -0.249 0.621 19668 16 1 3 "Average Difference" CA 65 0.641 -0.051 0.644 19668 17 1 3 "Average Difference" CB 56 0.495 -0.249 0.433 19668 18 1 3 "Average Difference" HN 64 0.494 -0.329 0.372 19668 19 1 4 "Average Difference" N 64 1.964 -0.386 1.941 19668 20 1 4 "Average Difference" HA 73 0.178 -0.059 0.170 19668 21 1 4 "Average Difference" C 64 0.677 -0.243 0.636 19668 22 1 4 "Average Difference" CA 65 0.774 0.000 0.780 19668 23 1 4 "Average Difference" CB 56 0.505 -0.265 0.434 19668 24 1 4 "Average Difference" HN 64 0.512 -0.303 0.415 19668 25 1 5 "Average Difference" N 64 1.722 -0.466 1.670 19668 26 1 5 "Average Difference" HA 73 0.156 -0.018 0.156 19668 27 1 5 "Average Difference" C 64 0.722 -0.280 0.670 19668 28 1 5 "Average Difference" CA 65 0.711 -0.095 0.710 19668 29 1 5 "Average Difference" CB 56 0.535 -0.266 0.468 19668 30 1 5 "Average Difference" HN 64 0.494 -0.288 0.405 19668 31 1 6 "Average Difference" N 64 1.861 -0.218 1.863 19668 32 1 6 "Average Difference" HA 73 0.179 -0.054 0.172 19668 33 1 6 "Average Difference" C 64 0.793 -0.308 0.737 19668 34 1 6 "Average Difference" CA 65 0.719 -0.186 0.700 19668 35 1 6 "Average Difference" CB 56 0.452 -0.212 0.402 19668 36 1 6 "Average Difference" HN 64 0.513 -0.351 0.376 19668 37 1 7 "Average Difference" N 64 1.717 -0.328 1.698 19668 38 1 7 "Average Difference" HA 73 0.171 -0.036 0.168 19668 39 1 7 "Average Difference" C 64 0.700 -0.233 0.666 19668 40 1 7 "Average Difference" CA 65 0.580 -0.064 0.581 19668 41 1 7 "Average Difference" CB 56 0.577 -0.277 0.511 19668 42 1 7 "Average Difference" HN 64 0.493 -0.271 0.415 19668 43 1 8 "Average Difference" N 64 1.708 -0.287 1.697 19668 44 1 8 "Average Difference" HA 73 0.178 -0.044 0.173 19668 45 1 8 "Average Difference" C 64 0.776 -0.281 0.729 19668 46 1 8 "Average Difference" CA 65 0.702 -0.052 0.706 19668 47 1 8 "Average Difference" CB 56 0.469 -0.196 0.430 19668 48 1 8 "Average Difference" HN 64 0.523 -0.329 0.410 19668 49 1 9 "Average Difference" N 64 1.802 -0.293 1.792 19668 50 1 9 "Average Difference" HA 73 0.150 -0.022 0.149 19668 51 1 9 "Average Difference" C 64 0.737 -0.286 0.685 19668 52 1 9 "Average Difference" CA 65 0.678 -0.040 0.682 19668 53 1 9 "Average Difference" CB 56 0.540 -0.261 0.477 19668 54 1 9 "Average Difference" HN 64 0.496 -0.327 0.376 19668 55 1 10 "Average Difference" N 64 1.517 -0.285 1.502 19668 56 1 10 "Average Difference" HA 73 0.193 -0.042 0.190 19668 57 1 10 "Average Difference" C 64 0.682 -0.229 0.647 19668 58 1 10 "Average Difference" CA 65 0.701 -0.106 0.698 19668 59 1 10 "Average Difference" CB 56 0.516 -0.257 0.452 19668 60 1 10 "Average Difference" HN 64 0.495 -0.300 0.396 19668 61 1 11 "Average Difference" N 64 1.635 -0.251 1.628 19668 62 1 11 "Average Difference" HA 73 0.174 -0.049 0.169 19668 63 1 11 "Average Difference" C 64 0.727 -0.246 0.690 19668 64 1 11 "Average Difference" CA 65 0.672 -0.126 0.665 19668 65 1 11 "Average Difference" CB 56 0.538 -0.270 0.470 19668 66 1 11 "Average Difference" HN 64 0.504 -0.297 0.411 19668 67 1 12 "Average Difference" N 64 1.662 -0.215 1.661 19668 68 1 12 "Average Difference" HA 73 0.164 -0.043 0.159 19668 69 1 12 "Average Difference" C 64 0.669 -0.257 0.623 19668 70 1 12 "Average Difference" CA 65 0.643 -0.100 0.640 19668 71 1 12 "Average Difference" CB 56 0.507 -0.263 0.438 19668 72 1 12 "Average Difference" HN 64 0.494 -0.294 0.400 19668 73 1 13 "Average Difference" N 64 1.845 -0.517 1.785 19668 74 1 13 "Average Difference" HA 73 0.160 -0.012 0.161 19668 75 1 13 "Average Difference" C 64 0.719 -0.251 0.679 19668 76 1 13 "Average Difference" CA 65 0.696 -0.184 0.677 19668 77 1 13 "Average Difference" CB 56 0.495 -0.276 0.415 19668 78 1 13 "Average Difference" HN 64 0.491 -0.331 0.366 19668 79 1 14 "Average Difference" N 64 1.872 -0.408 1.841 19668 80 1 14 "Average Difference" HA 73 0.177 -0.047 0.172 19668 81 1 14 "Average Difference" C 64 0.764 -0.280 0.716 19668 82 1 14 "Average Difference" CA 65 0.720 -0.095 0.720 19668 83 1 14 "Average Difference" CB 56 0.484 -0.251 0.418 19668 84 1 14 "Average Difference" HN 64 0.500 -0.304 0.400 19668 85 1 15 "Average Difference" N 64 1.566 -0.266 1.555 19668 86 1 15 "Average Difference" HA 73 0.150 -0.024 0.149 19668 87 1 15 "Average Difference" C 64 0.662 -0.245 0.620 19668 88 1 15 "Average Difference" CA 65 0.812 -0.025 0.818 19668 89 1 15 "Average Difference" CB 56 0.554 -0.257 0.495 19668 90 1 15 "Average Difference" HN 64 0.513 -0.287 0.429 19668 91 1 16 "Average Difference" N 64 1.656 -0.284 1.644 19668 92 1 16 "Average Difference" HA 73 0.164 -0.023 0.163 19668 93 1 16 "Average Difference" C 64 0.725 -0.288 0.670 19668 94 1 16 "Average Difference" CA 65 0.686 -0.146 0.675 19668 95 1 16 "Average Difference" CB 56 0.511 -0.269 0.438 19668 96 1 16 "Average Difference" HN 64 0.507 -0.300 0.411 19668 97 1 17 "Average Difference" N 64 1.393 -0.282 1.374 19668 98 1 17 "Average Difference" HA 73 0.180 -0.054 0.173 19668 99 1 17 "Average Difference" C 64 0.638 -0.159 0.622 19668 100 1 17 "Average Difference" CA 65 0.608 -0.123 0.600 19668 101 1 17 "Average Difference" CB 56 0.501 -0.228 0.450 19668 102 1 17 "Average Difference" HN 64 0.492 -0.299 0.394 19668 103 1 18 "Average Difference" N 64 1.678 -0.305 1.663 19668 104 1 18 "Average Difference" HA 73 0.195 -0.066 0.185 19668 105 1 18 "Average Difference" C 64 0.695 -0.229 0.661 19668 106 1 18 "Average Difference" CA 65 0.746 -0.063 0.749 19668 107 1 18 "Average Difference" CB 56 0.513 -0.231 0.462 19668 108 1 18 "Average Difference" HN 64 0.496 -0.339 0.365 19668 109 1 19 "Average Difference" N 64 1.805 -0.398 1.775 19668 110 1 19 "Average Difference" HA 73 0.174 -0.059 0.164 19668 111 1 19 "Average Difference" C 64 0.694 -0.214 0.665 19668 112 1 19 "Average Difference" CA 65 0.699 -0.051 0.702 19668 113 1 19 "Average Difference" CB 56 0.508 -0.283 0.426 19668 114 1 19 "Average Difference" HN 64 0.515 -0.339 0.392 19668 115 1 20 "Average Difference" N 64 1.751 -0.313 1.737 19668 116 1 20 "Average Difference" HA 73 0.170 -0.043 0.166 19668 117 1 20 "Average Difference" C 64 0.692 -0.291 0.633 19668 118 1 20 "Average Difference" CA 65 0.648 -0.055 0.651 19668 119 1 20 "Average Difference" CB 56 0.517 -0.252 0.455 19668 120 1 20 "Average Difference" HN 64 0.509 -0.323 0.397 19668 121 1 21 "Average Difference" N 64 1.371 -0.311 1.346 19668 122 1 21 "Average Difference" HA 73 0.158 -0.032 0.156 19668 123 1 21 "Average Difference" C 64 0.719 -0.222 0.689 19668 124 1 21 "Average Difference" CA 65 0.669 -0.066 0.671 19668 125 1 21 "Average Difference" CB 56 0.492 -0.212 0.448 19668 126 1 21 "Average Difference" HN 64 0.508 -0.295 0.417 19668 127 1 22 "Average Difference" N 64 1.627 -0.359 1.599 19668 128 1 22 "Average Difference" HA 73 0.152 -0.035 0.149 19668 129 1 22 "Average Difference" C 64 0.754 -0.282 0.705 19668 130 1 22 "Average Difference" CA 65 0.683 -0.145 0.673 19668 131 1 22 "Average Difference" CB 56 0.544 -0.268 0.478 19668 132 1 22 "Average Difference" HN 64 0.512 -0.332 0.393 19668 133 1 23 "Average Difference" N 64 1.671 -0.505 1.606 19668 134 1 23 "Average Difference" HA 73 0.165 -0.027 0.164 19668 135 1 23 "Average Difference" C 64 0.678 -0.264 0.629 19668 136 1 23 "Average Difference" CA 65 0.623 -0.050 0.626 19668 137 1 23 "Average Difference" CB 56 0.525 -0.215 0.484 19668 138 1 23 "Average Difference" HN 64 0.497 -0.337 0.367 19668 139 1 24 "Average Difference" N 64 1.442 -0.399 1.397 19668 140 1 24 "Average Difference" HA 73 0.155 -0.021 0.155 19668 141 1 24 "Average Difference" C 64 0.685 -0.244 0.645 19668 142 1 24 "Average Difference" CA 65 0.598 -0.080 0.598 19668 143 1 24 "Average Difference" CB 56 0.504 -0.255 0.439 19668 144 1 24 "Average Difference" HN 64 0.484 -0.311 0.373 19668 145 1 25 "Average Difference" N 64 1.757 -0.512 1.694 19668 146 1 25 "Average Difference" HA 73 0.152 -0.048 0.145 19668 147 1 25 "Average Difference" C 64 0.754 -0.313 0.691 19668 148 1 25 "Average Difference" CA 65 0.680 -0.056 0.683 19668 149 1 25 "Average Difference" CB 56 0.476 -0.254 0.406 19668 150 1 25 "Average Difference" HN 64 0.505 -0.322 0.392 19668 151 1 26 "Average Difference" N 64 1.528 -0.274 1.516 19668 152 1 26 "Average Difference" HA 73 0.175 -0.036 0.173 19668 153 1 26 "Average Difference" C 64 0.702 -0.264 0.656 19668 154 1 26 "Average Difference" CA 65 0.691 -0.138 0.682 19668 155 1 26 "Average Difference" CB 56 0.517 -0.228 0.468 19668 156 1 26 "Average Difference" HN 64 0.490 -0.320 0.374 19668 157 1 27 "Average Difference" N 64 1.883 -0.589 1.803 19668 158 1 27 "Average Difference" HA 73 0.165 -0.014 0.166 19668 159 1 27 "Average Difference" C 64 0.699 -0.228 0.667 19668 160 1 27 "Average Difference" CA 65 0.697 -0.161 0.683 19668 161 1 27 "Average Difference" CB 56 0.465 -0.211 0.418 19668 162 1 27 "Average Difference" HN 64 0.508 -0.291 0.420 19668 163 1 28 "Average Difference" N 64 1.533 -0.242 1.526 19668 164 1 28 "Average Difference" HA 73 0.158 -0.042 0.153 19668 165 1 28 "Average Difference" C 64 0.672 -0.199 0.647 19668 166 1 28 "Average Difference" CA 65 0.730 -0.081 0.732 19668 167 1 28 "Average Difference" CB 56 0.515 -0.289 0.430 19668 168 1 28 "Average Difference" HN 64 0.478 -0.292 0.382 19668 169 1 29 "Average Difference" N 64 1.548 -0.295 1.532 19668 170 1 29 "Average Difference" HA 73 0.174 -0.051 0.167 19668 171 1 29 "Average Difference" C 64 0.734 -0.307 0.672 19668 172 1 29 "Average Difference" CA 65 0.667 -0.116 0.662 19668 173 1 29 "Average Difference" CB 56 0.514 -0.251 0.452 19668 174 1 29 "Average Difference" HN 64 0.495 -0.284 0.409 19668 175 1 30 "Average Difference" N 64 1.683 -0.218 1.682 19668 176 1 30 "Average Difference" HA 73 0.183 -0.037 0.180 19668 177 1 30 "Average Difference" C 64 0.656 -0.201 0.630 19668 178 1 30 "Average Difference" CA 65 0.650 -0.102 0.647 19668 179 1 30 "Average Difference" CB 56 0.488 -0.260 0.417 19668 180 1 30 "Average Difference" HN 64 0.499 -0.295 0.406 19668 181 1 31 "Average Difference" N 64 1.608 -0.309 1.590 19668 182 1 31 "Average Difference" HA 73 0.166 -0.046 0.160 19668 183 1 31 "Average Difference" C 64 0.683 -0.210 0.655 19668 184 1 31 "Average Difference" CA 65 0.671 -0.054 0.674 19668 185 1 31 "Average Difference" CB 56 0.468 -0.220 0.417 19668 186 1 31 "Average Difference" HN 64 0.504 -0.301 0.408 19668 187 1 32 "Average Difference" N 64 1.703 -0.389 1.671 19668 188 1 32 "Average Difference" HA 73 0.135 -0.023 0.134 19668 189 1 32 "Average Difference" C 64 0.722 -0.266 0.677 19668 190 1 32 "Average Difference" CA 65 0.663 -0.044 0.667 19668 191 1 32 "Average Difference" CB 56 0.499 -0.281 0.416 19668 192 1 32 "Average Difference" HN 64 0.476 -0.332 0.345 19668 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 19668 _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 SER HA H 2 4.560 4.560 4.357 0.203 19668 2 1 . 1 1 2 2 SER CA C 2 58.366 58.366 59.577 -1.211 19668 3 1 . 1 1 3 3 ARG N N 3 125.213 125.213 121.350 3.863 19668 4 1 . 1 1 3 3 ARG HA H 3 4.266 4.266 4.251 0.015 19668 5 1 . 1 1 3 3 ARG C C 3 178.381 178.381 177.786 0.595 19668 6 1 . 1 1 3 3 ARG CA C 3 58.396 58.396 58.247 0.149 19668 7 1 . 1 1 3 3 ARG CB C 3 30.655 30.655 29.625 1.031 19668 8 1 . 1 1 3 3 ARG H H 3 8.874 8.874 8.339 0.535 19668 9 1 . 1 1 4 4 VAL N N 4 119.320 119.320 120.162 -0.842 19668 10 1 . 1 1 4 4 VAL HA H 4 3.798 3.798 3.799 -0.001 19668 11 1 . 1 1 4 4 VAL C C 4 177.004 177.004 177.627 -0.623 19668 12 1 . 1 1 4 4 VAL CA C 4 65.515 65.515 65.759 -0.244 19668 13 1 . 1 1 4 4 VAL CB C 4 31.803 31.803 31.371 0.432 19668 14 1 . 1 1 4 4 VAL H H 4 8.112 8.112 7.945 0.167 19668 15 1 . 1 1 5 5 LYS N N 5 122.279 122.279 120.564 1.715 19668 16 1 . 1 1 5 5 LYS HA H 5 4.162 4.162 4.012 0.150 19668 17 1 . 1 1 5 5 LYS C C 5 178.547 178.547 178.175 0.372 19668 18 1 . 1 1 5 5 LYS CA C 5 58.758 58.758 58.876 -0.119 19668 19 1 . 1 1 5 5 LYS CB C 5 32.010 32.010 31.700 0.310 19668 20 1 . 1 1 5 5 LYS H H 5 7.847 7.847 8.039 -0.192 19668 21 1 . 1 1 6 6 ALA N N 6 120.295 120.295 121.540 -1.245 19668 22 1 . 1 1 6 6 ALA HA H 6 4.211 4.211 4.089 0.122 19668 23 1 . 1 1 6 6 ALA C C 6 180.834 180.834 179.482 1.352 19668 24 1 . 1 1 6 6 ALA CA C 6 54.903 54.903 54.984 -0.081 19668 25 1 . 1 1 6 6 ALA CB C 6 18.132 18.132 18.032 0.100 19668 26 1 . 1 1 6 6 ALA H H 6 7.975 7.975 7.820 0.155 19668 27 1 . 1 1 7 7 LEU N N 7 119.570 119.570 118.388 1.182 19668 28 1 . 1 1 7 7 LEU HA H 7 4.172 4.172 4.067 0.105 19668 29 1 . 1 1 7 7 LEU C C 7 178.431 178.431 178.598 -0.167 19668 30 1 . 1 1 7 7 LEU CA C 7 57.679 57.679 57.891 -0.212 19668 31 1 . 1 1 7 7 LEU CB C 7 42.035 42.035 41.094 0.941 19668 32 1 . 1 1 7 7 LEU H H 7 7.650 7.650 7.614 0.036 19668 33 1 . 1 1 8 8 GLU N N 8 119.934 119.934 118.414 1.520 19668 34 1 . 1 1 8 8 GLU HA H 8 3.859 3.859 4.061 -0.202 19668 35 1 . 1 1 8 8 GLU C C 8 179.534 179.534 178.545 0.989 19668 36 1 . 1 1 8 8 GLU CA C 8 60.037 60.037 59.334 0.703 19668 37 1 . 1 1 8 8 GLU CB C 8 29.467 29.467 28.755 0.712 19668 38 1 . 1 1 8 8 GLU H H 8 8.411 8.411 7.853 0.558 19668 39 1 . 1 1 9 9 GLU N N 9 118.234 118.234 119.152 -0.918 19668 40 1 . 1 1 9 9 GLU HA H 9 4.060 4.060 4.071 -0.011 19668 41 1 . 1 1 9 9 GLU C C 9 179.596 179.596 178.915 0.681 19668 42 1 . 1 1 9 9 GLU CA C 9 59.330 59.330 59.293 0.037 19668 43 1 . 1 1 9 9 GLU CB C 9 29.418 29.418 29.342 0.076 19668 44 1 . 1 1 9 9 GLU H H 9 8.206 8.206 7.726 0.480 19668 45 1 . 1 1 10 10 LYS N N 10 121.042 121.042 119.069 1.973 19668 46 1 . 1 1 10 10 LYS HA H 10 4.183 4.183 4.142 0.041 19668 47 1 . 1 1 10 10 LYS C C 10 179.380 179.380 179.100 0.280 19668 48 1 . 1 1 10 10 LYS CA C 10 59.325 59.325 59.125 0.200 19668 49 1 . 1 1 10 10 LYS CB C 10 32.409 32.409 32.132 0.278 19668 50 1 . 1 1 10 10 LYS H H 10 7.931 7.931 7.555 0.376 19668 51 1 . 1 1 11 11 VAL N N 11 118.662 118.662 120.187 -1.525 19668 52 1 . 1 1 11 11 VAL HA H 11 3.814 3.814 3.848 -0.034 19668 53 1 . 1 1 11 11 VAL C C 11 178.845 178.845 178.176 0.669 19668 54 1 . 1 1 11 11 VAL CA C 11 66.988 66.988 66.239 0.749 19668 55 1 . 1 1 11 11 VAL CB C 11 31.654 31.654 31.516 0.138 19668 56 1 . 1 1 11 11 VAL H H 11 8.371 8.371 7.587 0.784 19668 57 1 . 1 1 12 12 LYS N N 12 123.188 123.188 119.716 3.472 19668 58 1 . 1 1 12 12 LYS HA H 12 4.226 4.226 3.950 0.276 19668 59 1 . 1 1 12 12 LYS C C 12 179.098 179.098 178.350 0.748 19668 60 1 . 1 1 12 12 LYS CA C 12 59.483 59.483 59.355 0.128 19668 61 1 . 1 1 12 12 LYS CB C 12 32.206 32.206 32.293 -0.087 19668 62 1 . 1 1 12 12 LYS H H 12 8.276 8.276 7.536 0.741 19668 63 1 . 1 1 13 13 ALA N N 13 121.169 121.169 121.714 -0.545 19668 64 1 . 1 1 13 13 ALA HA H 13 4.258 4.258 4.066 0.192 19668 65 1 . 1 1 13 13 ALA C C 13 180.169 180.169 179.566 0.603 19668 66 1 . 1 1 13 13 ALA CA C 13 54.636 54.636 54.844 -0.208 19668 67 1 . 1 1 13 13 ALA CB C 13 18.107 18.107 18.336 -0.229 19668 68 1 . 1 1 13 13 ALA H H 13 7.829 7.829 7.444 0.385 19668 69 1 . 1 1 14 14 LEU N N 14 118.104 118.104 118.303 -0.199 19668 70 1 . 1 1 14 14 LEU HA H 14 4.156 4.156 3.996 0.160 19668 71 1 . 1 1 14 14 LEU C C 14 177.614 177.614 177.916 -0.302 19668 72 1 . 1 1 14 14 LEU CA C 14 56.605 56.605 57.138 -0.533 19668 73 1 . 1 1 14 14 LEU CB C 14 42.795 42.795 41.947 0.848 19668 74 1 . 1 1 14 14 LEU H H 14 7.781 7.781 7.420 0.361 19668 75 1 . 1 1 15 15 GLU N N 15 120.632 120.632 118.925 1.707 19668 76 1 . 1 1 15 15 GLU HA H 15 3.367 3.367 3.385 -0.018 19668 77 1 . 1 1 15 15 GLU C C 15 178.243 178.243 178.587 -0.344 19668 78 1 . 1 1 15 15 GLU CA C 15 60.586 60.586 59.588 0.998 19668 79 1 . 1 1 15 15 GLU CB C 15 29.829 29.829 29.047 0.782 19668 80 1 . 1 1 15 15 GLU H H 15 7.873 7.873 7.313 0.560 19668 81 1 . 1 1 16 16 GLU N N 16 115.775 115.775 117.115 -1.340 19668 82 1 . 1 1 16 16 GLU HA H 16 3.959 3.959 4.001 -0.042 19668 83 1 . 1 1 16 16 GLU C C 16 179.006 179.006 178.654 0.352 19668 84 1 . 1 1 16 16 GLU CA C 16 59.092 59.092 59.066 0.026 19668 85 1 . 1 1 16 16 GLU CB C 16 29.353 29.353 29.319 0.034 19668 86 1 . 1 1 16 16 GLU H H 16 7.926 7.926 7.735 0.191 19668 87 1 . 1 1 17 17 LYS N N 17 118.801 118.801 119.214 -0.413 19668 88 1 . 1 1 17 17 LYS HA H 17 4.094 4.094 4.083 0.011 19668 89 1 . 1 1 17 17 LYS C C 17 178.853 178.853 178.579 0.274 19668 90 1 . 1 1 17 17 LYS CA C 17 58.471 58.471 58.823 -0.352 19668 91 1 . 1 1 17 17 LYS CB C 17 32.362 32.362 31.872 0.490 19668 92 1 . 1 1 17 17 LYS H H 17 7.518 7.518 7.473 0.045 19668 93 1 . 1 1 18 18 VAL N N 18 118.034 118.034 119.790 -1.756 19668 94 1 . 1 1 18 18 VAL HA H 18 3.512 3.512 3.684 -0.172 19668 95 1 . 1 1 18 18 VAL C C 18 178.362 178.362 177.997 0.365 19668 96 1 . 1 1 18 18 VAL CA C 18 66.019 66.019 65.998 0.021 19668 97 1 . 1 1 18 18 VAL CB C 18 31.649 31.649 31.504 0.145 19668 98 1 . 1 1 18 18 VAL H H 18 8.048 8.048 7.383 0.665 19668 99 1 . 1 1 19 19 LYS N N 19 118.427 118.427 118.416 0.011 19668 100 1 . 1 1 19 19 LYS HA H 19 4.010 4.010 4.121 -0.111 19668 101 1 . 1 1 19 19 LYS C C 19 177.706 177.706 177.733 -0.027 19668 102 1 . 1 1 19 19 LYS CA C 19 58.985 58.985 58.650 0.335 19668 103 1 . 1 1 19 19 LYS CB C 19 32.424 32.424 31.805 0.620 19668 104 1 . 1 1 19 19 LYS H H 19 8.008 8.008 7.477 0.531 19668 105 1 . 1 1 20 20 ALA N N 20 119.177 119.177 120.482 -1.305 19668 106 1 . 1 1 20 20 ALA HA H 20 4.316 4.316 4.293 0.023 19668 107 1 . 1 1 20 20 ALA C C 20 178.269 178.269 178.730 -0.461 19668 108 1 . 1 1 20 20 ALA CA C 20 52.631 52.631 53.357 -0.726 19668 109 1 . 1 1 20 20 ALA CB C 20 19.133 19.133 18.793 0.340 19668 110 1 . 1 1 20 20 ALA H H 20 7.259 7.259 7.469 -0.210 19668 111 1 . 1 1 21 21 LEU N N 21 118.596 118.596 116.099 2.497 19668 112 1 . 1 1 21 21 LEU HA H 21 4.261 4.261 4.215 0.046 19668 113 1 . 1 1 21 21 LEU C C 21 177.732 177.732 177.247 0.485 19668 114 1 . 1 1 21 21 LEU CA C 21 55.657 55.657 55.867 -0.210 19668 115 1 . 1 1 21 21 LEU CB C 21 43.133 43.133 42.406 0.727 19668 116 1 . 1 1 21 21 LEU H H 21 7.373 7.373 7.350 0.023 19668 117 1 . 1 1 22 22 GLY N N 22 107.926 107.926 105.435 2.491 19668 118 1 . 1 1 22 22 GLY C C 22 173.362 173.362 173.028 0.334 19668 119 1 . 1 1 22 22 GLY CA C 22 45.197 45.197 44.801 0.396 19668 120 1 . 1 1 22 22 GLY H H 22 8.144 8.144 7.461 0.683 19668 121 1 . 1 1 23 23 GLY N N 23 108.242 108.242 106.855 1.387 19668 122 1 . 1 1 23 23 GLY C C 23 174.110 174.110 173.369 0.741 19668 123 1 . 1 1 23 23 GLY CA C 23 44.684 44.684 45.053 -0.369 19668 124 1 . 1 1 23 23 GLY H H 23 8.157 8.157 8.004 0.153 19668 125 1 . 1 1 24 24 GLY N N 24 106.969 106.969 109.126 -2.157 19668 126 1 . 1 1 24 24 GLY C C 24 175.172 175.172 174.676 0.496 19668 127 1 . 1 1 24 24 GLY CA C 24 44.439 44.439 45.056 -0.617 19668 128 1 . 1 1 24 24 GLY H H 24 8.466 8.466 8.236 0.230 19668 129 1 . 1 1 25 25 GLY N N 25 108.946 108.946 110.845 -1.899 19668 130 1 . 1 1 25 25 GLY C C 25 176.321 176.321 175.179 1.142 19668 131 1 . 1 1 25 25 GLY CA C 25 47.099 47.099 45.548 1.551 19668 132 1 . 1 1 25 25 GLY H H 25 8.618 8.618 8.080 0.538 19668 133 1 . 1 1 26 26 ARG N N 26 123.559 123.559 122.665 0.894 19668 134 1 . 1 1 26 26 ARG HA H 26 4.279 4.279 4.312 -0.033 19668 135 1 . 1 1 26 26 ARG C C 26 178.076 178.076 178.269 -0.193 19668 136 1 . 1 1 26 26 ARG CA C 26 57.915 57.915 58.484 -0.569 19668 137 1 . 1 1 26 26 ARG CB C 26 29.910 29.910 30.158 -0.248 19668 138 1 . 1 1 26 26 ARG H H 26 8.789 8.789 8.374 0.415 19668 139 1 . 1 1 27 27 ILE N N 27 118.726 118.726 118.938 -0.212 19668 140 1 . 1 1 27 27 ILE HA H 27 3.786 3.786 3.844 -0.058 19668 141 1 . 1 1 27 27 ILE C C 27 177.639 177.639 178.002 -0.363 19668 142 1 . 1 1 27 27 ILE CA C 27 63.624 63.624 64.151 -0.527 19668 143 1 . 1 1 27 27 ILE CB C 27 36.955 36.955 36.978 -0.023 19668 144 1 . 1 1 27 27 ILE H H 27 7.762 7.762 8.113 -0.351 19668 145 1 . 1 1 28 28 GLU N N 28 119.843 119.843 119.171 0.673 19668 146 1 . 1 1 28 28 GLU HA H 28 4.013 4.013 4.006 0.007 19668 147 1 . 1 1 28 28 GLU C C 28 179.447 179.447 178.993 0.454 19668 148 1 . 1 1 28 28 GLU CA C 28 59.583 59.583 59.809 -0.226 19668 149 1 . 1 1 28 28 GLU CB C 28 29.060 29.060 29.156 -0.096 19668 150 1 . 1 1 28 28 GLU H H 28 7.867 7.867 8.442 -0.575 19668 151 1 . 1 1 29 29 GLU N N 29 118.447 118.447 119.325 -0.878 19668 152 1 . 1 1 29 29 GLU HA H 29 4.087 4.087 4.071 0.016 19668 153 1 . 1 1 29 29 GLU C C 29 179.310 179.310 178.953 0.357 19668 154 1 . 1 1 29 29 GLU CA C 29 59.280 59.280 58.701 0.579 19668 155 1 . 1 1 29 29 GLU CB C 29 29.336 29.336 29.194 0.142 19668 156 1 . 1 1 29 29 GLU H H 29 7.755 7.755 7.921 -0.166 19668 157 1 . 1 1 30 30 LEU N N 30 121.135 121.135 121.033 0.102 19668 158 1 . 1 1 30 30 LEU HA H 30 4.096 4.096 4.000 0.096 19668 159 1 . 1 1 30 30 LEU C C 30 178.928 178.928 178.672 0.256 19668 160 1 . 1 1 30 30 LEU CA C 30 58.105 58.105 58.247 -0.142 19668 161 1 . 1 1 30 30 LEU CB C 30 41.680 41.680 42.109 -0.429 19668 162 1 . 1 1 30 30 LEU H H 30 7.785 7.785 7.611 0.174 19668 163 1 . 1 1 31 31 LYS N N 31 119.130 119.130 117.772 1.358 19668 164 1 . 1 1 31 31 LYS HA H 31 3.870 3.870 4.094 -0.224 19668 165 1 . 1 1 31 31 LYS C C 31 179.104 179.104 178.976 0.128 19668 166 1 . 1 1 31 31 LYS CA C 31 60.716 60.716 59.396 1.320 19668 167 1 . 1 1 31 31 LYS CB C 31 32.256 32.256 31.826 0.430 19668 168 1 . 1 1 31 31 LYS H H 31 8.413 8.413 7.620 0.793 19668 169 1 . 1 1 32 32 LYS N N 32 119.200 119.200 119.526 -0.326 19668 170 1 . 1 1 32 32 LYS HA H 32 4.102 4.102 4.000 0.102 19668 171 1 . 1 1 32 32 LYS C C 32 179.420 179.420 179.007 0.413 19668 172 1 . 1 1 32 32 LYS CA C 32 59.457 59.457 59.436 0.021 19668 173 1 . 1 1 32 32 LYS CB C 32 32.266 32.266 32.160 0.106 19668 174 1 . 1 1 32 32 LYS H H 32 7.826 7.826 7.551 0.275 19668 175 1 . 1 1 33 33 LYS N N 33 120.322 120.322 119.186 1.136 19668 176 1 . 1 1 33 33 LYS HA H 33 4.163 4.163 4.050 0.113 19668 177 1 . 1 1 33 33 LYS C C 33 179.174 179.174 178.853 0.321 19668 178 1 . 1 1 33 33 LYS CA C 33 58.748 58.748 58.956 -0.208 19668 179 1 . 1 1 33 33 LYS CB C 33 31.739 31.739 32.254 -0.515 19668 180 1 . 1 1 33 33 LYS H H 33 8.003 8.003 7.518 0.485 19668 181 1 . 1 1 34 34 TYR N N 34 120.223 120.223 119.226 0.997 19668 182 1 . 1 1 34 34 TYR HA H 34 4.056 4.056 4.108 -0.052 19668 183 1 . 1 1 34 34 TYR C C 34 176.356 176.356 177.937 -1.581 19668 184 1 . 1 1 34 34 TYR CA C 34 61.055 61.055 61.633 -0.577 19668 185 1 . 1 1 34 34 TYR CB C 34 38.027 38.027 38.312 -0.285 19668 186 1 . 1 1 34 34 TYR H H 34 8.614 8.614 7.567 1.047 19668 187 1 . 1 1 35 35 GLU N N 35 118.813 118.813 117.348 1.465 19668 188 1 . 1 1 35 35 GLU HA H 35 3.725 3.725 3.943 -0.218 19668 189 1 . 1 1 35 35 GLU C C 35 179.787 179.787 178.815 0.972 19668 190 1 . 1 1 35 35 GLU CA C 35 59.439 59.439 59.885 -0.446 19668 191 1 . 1 1 35 35 GLU CB C 35 29.128 29.128 29.002 0.126 19668 192 1 . 1 1 35 35 GLU H H 35 8.103 8.103 7.898 0.205 19668 193 1 . 1 1 36 36 GLU N N 36 119.670 119.670 119.664 0.006 19668 194 1 . 1 1 36 36 GLU HA H 36 4.014 4.014 4.089 -0.075 19668 195 1 . 1 1 36 36 GLU C C 36 179.295 179.295 178.981 0.314 19668 196 1 . 1 1 36 36 GLU CA C 36 59.263 59.263 59.214 0.049 19668 197 1 . 1 1 36 36 GLU CB C 36 29.569 29.569 29.442 0.127 19668 198 1 . 1 1 36 36 GLU H H 36 8.028 8.028 7.681 0.347 19668 199 1 . 1 1 37 37 LEU N N 37 121.416 121.416 119.362 2.054 19668 200 1 . 1 1 37 37 LEU HA H 37 4.019 4.019 3.987 0.032 19668 201 1 . 1 1 37 37 LEU C C 37 178.277 178.277 178.981 -0.703 19668 202 1 . 1 1 37 37 LEU CA C 37 57.840 57.840 57.880 -0.040 19668 203 1 . 1 1 37 37 LEU CB C 37 41.629 41.629 41.459 0.170 19668 204 1 . 1 1 37 37 LEU H H 37 8.176 8.176 7.396 0.780 19668 205 1 . 1 1 38 38 LYS N N 38 118.998 118.998 118.317 0.681 19668 206 1 . 1 1 38 38 LYS HA H 38 3.660 3.660 3.955 -0.295 19668 207 1 . 1 1 38 38 LYS C C 38 178.923 178.923 179.019 -0.096 19668 208 1 . 1 1 38 38 LYS CA C 38 60.400 60.400 59.854 0.546 19668 209 1 . 1 1 38 38 LYS CB C 38 32.062 32.062 32.081 -0.019 19668 210 1 . 1 1 38 38 LYS H H 38 8.260 8.260 7.599 0.661 19668 211 1 . 1 1 39 39 LYS N N 39 118.070 118.070 118.463 -0.393 19668 212 1 . 1 1 39 39 LYS HA H 39 4.080 4.080 4.047 0.033 19668 213 1 . 1 1 39 39 LYS C C 39 178.687 178.687 178.921 -0.234 19668 214 1 . 1 1 39 39 LYS CA C 39 58.936 58.936 59.459 -0.523 19668 215 1 . 1 1 39 39 LYS CB C 39 32.149 32.149 32.135 0.014 19668 216 1 . 1 1 39 39 LYS H H 39 7.380 7.380 7.642 -0.262 19668 217 1 . 1 1 40 40 LYS N N 40 118.894 118.894 119.637 -0.743 19668 218 1 . 1 1 40 40 LYS HA H 40 4.059 4.059 4.088 -0.028 19668 219 1 . 1 1 40 40 LYS C C 40 179.758 179.758 179.036 0.722 19668 220 1 . 1 1 40 40 LYS CA C 40 59.062 59.062 59.374 -0.312 19668 221 1 . 1 1 40 40 LYS CB C 40 32.388 32.388 32.287 0.101 19668 222 1 . 1 1 40 40 LYS H H 40 7.919 7.919 7.415 0.504 19668 223 1 . 1 1 41 41 ILE N N 41 118.270 118.270 118.485 -0.215 19668 224 1 . 1 1 41 41 ILE HA H 41 3.697 3.697 3.771 -0.074 19668 225 1 . 1 1 41 41 ILE C C 41 178.211 178.211 177.362 0.849 19668 226 1 . 1 1 41 41 ILE CA C 41 64.714 64.714 64.575 0.139 19668 227 1 . 1 1 41 41 ILE CB C 41 37.839 37.839 37.777 0.062 19668 228 1 . 1 1 41 41 ILE H H 41 8.199 8.199 7.463 0.736 19668 229 1 . 1 1 42 42 GLU N N 42 120.117 120.117 117.724 2.393 19668 230 1 . 1 1 42 42 GLU HA H 42 4.091 4.091 4.052 0.039 19668 231 1 . 1 1 42 42 GLU C C 42 178.736 178.736 177.575 1.161 19668 232 1 . 1 1 42 42 GLU CA C 42 58.880 58.880 58.776 0.104 19668 233 1 . 1 1 42 42 GLU CB C 42 29.391 29.391 29.902 -0.511 19668 234 1 . 1 1 42 42 GLU H H 42 7.738 7.738 7.548 0.190 19668 235 1 . 1 1 43 43 GLU N N 43 117.194 117.194 116.653 0.541 19668 236 1 . 1 1 43 43 GLU HA H 43 4.299 4.299 4.194 0.106 19668 237 1 . 1 1 43 43 GLU C C 43 177.658 177.658 177.301 0.357 19668 238 1 . 1 1 43 43 GLU CA C 43 56.793 56.793 57.047 -0.254 19668 239 1 . 1 1 43 43 GLU CB C 43 29.933 29.933 30.229 -0.296 19668 240 1 . 1 1 43 43 GLU H H 43 7.698 7.698 7.546 0.152 19668 241 1 . 1 1 44 44 LEU N N 44 120.812 120.812 120.425 0.387 19668 242 1 . 1 1 44 44 LEU HA H 44 4.239 4.239 4.176 0.063 19668 243 1 . 1 1 44 44 LEU C C 44 178.682 178.682 177.180 1.502 19668 244 1 . 1 1 44 44 LEU CA C 44 56.496 56.496 55.476 1.020 19668 245 1 . 1 1 44 44 LEU CB C 44 42.647 42.647 42.230 0.417 19668 246 1 . 1 1 44 44 LEU H H 44 7.593 7.593 7.379 0.214 19668 247 1 . 1 1 45 45 GLY N N 45 108.681 108.681 110.607 -1.926 19668 248 1 . 1 1 45 45 GLY C C 45 174.957 174.957 174.099 0.858 19668 249 1 . 1 1 45 45 GLY CA C 45 46.086 46.086 45.113 0.973 19668 250 1 . 1 1 45 45 GLY H H 45 8.234 8.234 8.423 -0.189 19668 251 1 . 1 1 46 46 GLY N N 46 108.057 108.057 108.340 -0.283 19668 252 1 . 1 1 46 46 GLY C C 46 174.777 174.777 173.848 0.929 19668 253 1 . 1 1 46 46 GLY CA C 46 45.364 45.364 44.746 0.618 19668 254 1 . 1 1 46 46 GLY H H 46 8.182 8.182 7.934 0.248 19668 255 1 . 1 1 47 47 GLY N N 47 108.494 108.494 107.627 0.867 19668 256 1 . 1 1 47 47 GLY C C 47 174.572 174.572 174.329 0.243 19668 257 1 . 1 1 47 47 GLY CA C 47 45.155 45.155 44.882 0.272 19668 258 1 . 1 1 47 47 GLY H H 47 8.087 8.087 8.066 0.021 19668 259 1 . 1 1 48 48 GLY N N 48 108.285 108.285 108.873 -0.588 19668 260 1 . 1 1 48 48 GLY C C 48 174.495 174.495 174.785 -0.290 19668 261 1 . 1 1 48 48 GLY CA C 48 45.454 45.454 45.500 -0.046 19668 262 1 . 1 1 48 48 GLY H H 48 8.323 8.323 8.354 -0.031 19668 263 1 . 1 1 49 49 GLU N N 49 121.070 121.070 121.253 -0.183 19668 264 1 . 1 1 49 49 GLU HA H 49 4.417 4.417 4.423 -0.006 19668 265 1 . 1 1 49 49 GLU C C 49 177.226 177.226 178.063 -0.837 19668 266 1 . 1 1 49 49 GLU CA C 49 56.571 56.571 57.075 -0.504 19668 267 1 . 1 1 49 49 GLU CB C 49 29.666 29.666 29.857 -0.191 19668 268 1 . 1 1 49 49 GLU H H 49 8.483 8.483 8.243 0.240 19668 269 1 . 1 1 50 50 VAL N N 50 121.794 121.794 117.711 4.083 19668 270 1 . 1 1 50 50 VAL HA H 50 3.781 3.781 3.704 0.077 19668 271 1 . 1 1 50 50 VAL C C 50 176.860 176.860 177.448 -0.588 19668 272 1 . 1 1 50 50 VAL CA C 50 65.080 65.080 65.674 -0.594 19668 273 1 . 1 1 50 50 VAL CB C 50 32.253 32.253 31.257 0.996 19668 274 1 . 1 1 50 50 VAL H H 50 8.068 8.068 7.985 0.083 19668 275 1 . 1 1 51 51 LYS N N 51 120.593 120.593 118.834 1.759 19668 276 1 . 1 1 51 51 LYS HA H 51 4.207 4.207 4.266 -0.059 19668 277 1 . 1 1 51 51 LYS C C 51 178.667 178.667 178.845 -0.178 19668 278 1 . 1 1 51 51 LYS CA C 51 59.335 59.335 59.066 0.269 19668 279 1 . 1 1 51 51 LYS CB C 51 32.258 32.258 31.742 0.516 19668 280 1 . 1 1 51 51 LYS H H 51 8.253 8.253 8.169 0.084 19668 281 1 . 1 1 52 52 LYS N N 52 117.572 117.572 119.803 -2.231 19668 282 1 . 1 1 52 52 LYS HA H 52 4.168 4.168 4.077 0.091 19668 283 1 . 1 1 52 52 LYS C C 52 179.248 179.248 178.761 0.487 19668 284 1 . 1 1 52 52 LYS CA C 52 59.014 59.014 59.221 -0.207 19668 285 1 . 1 1 52 52 LYS CB C 52 32.180 32.180 32.229 -0.048 19668 286 1 . 1 1 52 52 LYS H H 52 7.629 7.629 7.595 0.034 19668 287 1 . 1 1 53 53 VAL N N 53 119.059 119.059 118.961 0.098 19668 288 1 . 1 1 53 53 VAL HA H 53 3.792 3.792 3.772 0.020 19668 289 1 . 1 1 53 53 VAL C C 53 177.987 177.987 177.898 0.089 19668 290 1 . 1 1 53 53 VAL CA C 53 66.031 66.031 66.027 0.004 19668 291 1 . 1 1 53 53 VAL CB C 53 31.371 31.371 31.366 0.005 19668 292 1 . 1 1 53 53 VAL H H 53 7.638 7.638 7.587 0.051 19668 293 1 . 1 1 54 54 GLU N N 54 120.388 120.388 119.286 1.102 19668 294 1 . 1 1 54 54 GLU HA H 54 3.844 3.844 3.928 -0.084 19668 295 1 . 1 1 54 54 GLU C C 54 179.624 179.624 178.899 0.725 19668 296 1 . 1 1 54 54 GLU CA C 54 60.241 60.241 59.834 0.407 19668 297 1 . 1 1 54 54 GLU CB C 54 29.818 29.818 29.208 0.610 19668 298 1 . 1 1 54 54 GLU H H 54 8.603 8.603 7.674 0.929 19668 299 1 . 1 1 55 55 GLU N N 55 118.533 118.533 119.007 -0.474 19668 300 1 . 1 1 55 55 GLU HA H 55 4.089 4.089 4.056 0.033 19668 301 1 . 1 1 55 55 GLU C C 55 179.158 179.158 178.893 0.265 19668 302 1 . 1 1 55 55 GLU CA C 55 59.334 59.334 59.254 0.080 19668 303 1 . 1 1 55 55 GLU CB C 55 29.337 29.337 29.509 -0.172 19668 304 1 . 1 1 55 55 GLU H H 55 7.904 7.904 7.610 0.294 19668 305 1 . 1 1 56 56 GLU N N 56 120.258 120.258 119.277 0.981 19668 306 1 . 1 1 56 56 GLU HA H 56 4.100 4.100 4.029 0.071 19668 307 1 . 1 1 56 56 GLU C C 56 179.867 179.867 179.120 0.747 19668 308 1 . 1 1 56 56 GLU CA C 56 59.663 59.663 59.083 0.580 19668 309 1 . 1 1 56 56 GLU CB C 56 30.050 30.050 29.373 0.677 19668 310 1 . 1 1 56 56 GLU H H 56 7.902 7.902 7.529 0.373 19668 311 1 . 1 1 57 57 VAL N N 57 121.168 121.168 120.059 1.109 19668 312 1 . 1 1 57 57 VAL HA H 57 3.568 3.568 3.554 0.014 19668 313 1 . 1 1 57 57 VAL C C 57 176.994 176.994 177.173 -0.179 19668 314 1 . 1 1 57 57 VAL CA C 57 66.896 66.896 65.193 1.703 19668 315 1 . 1 1 57 57 VAL CB C 57 31.527 31.527 31.649 -0.122 19668 316 1 . 1 1 57 57 VAL H H 57 8.613 8.613 7.500 1.113 19668 317 1 . 1 1 58 58 LYS N N 58 120.234 120.234 118.710 1.524 19668 318 1 . 1 1 58 58 LYS HA H 58 4.202 4.202 3.964 0.238 19668 319 1 . 1 1 58 58 LYS C C 58 179.131 179.131 178.692 0.439 19668 320 1 . 1 1 58 58 LYS CA C 58 59.587 59.587 59.396 0.191 19668 321 1 . 1 1 58 58 LYS CB C 58 32.291 32.291 31.826 0.465 19668 322 1 . 1 1 58 58 LYS H H 58 7.810 7.810 7.531 0.279 19668 323 1 . 1 1 59 59 LYS N N 59 118.301 118.301 118.598 -0.297 19668 324 1 . 1 1 59 59 LYS HA H 59 4.093 4.093 4.056 0.037 19668 325 1 . 1 1 59 59 LYS C C 59 179.281 179.281 178.414 0.867 19668 326 1 . 1 1 59 59 LYS CA C 59 59.428 59.428 59.017 0.411 19668 327 1 . 1 1 59 59 LYS CB C 59 32.379 32.379 31.966 0.414 19668 328 1 . 1 1 59 59 LYS H H 59 7.876 7.876 7.409 0.467 19668 329 1 . 1 1 60 60 LEU N N 60 121.224 121.224 120.452 0.772 19668 330 1 . 1 1 60 60 LEU HA H 60 4.234 4.234 4.004 0.230 19668 331 1 . 1 1 60 60 LEU C C 60 178.636 178.636 178.731 -0.095 19668 332 1 . 1 1 60 60 LEU CA C 60 58.157 58.157 57.798 0.359 19668 333 1 . 1 1 60 60 LEU CB C 60 41.634 41.634 41.284 0.350 19668 334 1 . 1 1 60 60 LEU H H 60 7.893 7.893 7.600 0.293 19668 335 1 . 1 1 61 61 GLU N N 61 118.660 118.660 118.028 0.632 19668 336 1 . 1 1 61 61 GLU HA H 61 3.799 3.799 4.066 -0.267 19668 337 1 . 1 1 61 61 GLU C C 61 179.094 179.094 178.746 0.348 19668 338 1 . 1 1 61 61 GLU CA C 61 60.272 60.272 59.067 1.204 19668 339 1 . 1 1 61 61 GLU CB C 61 30.003 30.003 28.668 1.335 19668 340 1 . 1 1 61 61 GLU H H 61 8.644 8.644 7.811 0.833 19668 341 1 . 1 1 62 62 GLU N N 62 117.555 117.555 119.567 -2.012 19668 342 1 . 1 1 62 62 GLU HA H 62 3.996 3.996 4.012 -0.016 19668 343 1 . 1 1 62 62 GLU C C 62 178.940 178.940 179.070 -0.130 19668 344 1 . 1 1 62 62 GLU CA C 62 59.168 59.168 59.350 -0.182 19668 345 1 . 1 1 62 62 GLU CB C 62 29.547 29.547 29.239 0.308 19668 346 1 . 1 1 62 62 GLU H H 62 7.995 7.995 7.573 0.422 19668 347 1 . 1 1 63 63 GLU N N 63 119.097 119.097 118.291 0.806 19668 348 1 . 1 1 63 63 GLU HA H 63 4.029 4.029 4.139 -0.110 19668 349 1 . 1 1 63 63 GLU C C 63 179.890 179.890 179.008 0.882 19668 350 1 . 1 1 63 63 GLU CA C 63 59.341 59.341 58.738 0.603 19668 351 1 . 1 1 63 63 GLU CB C 63 29.667 29.667 29.067 0.600 19668 352 1 . 1 1 63 63 GLU H H 63 7.983 7.983 7.721 0.262 19668 353 1 . 1 1 64 64 ILE N N 64 118.247 118.247 118.769 -0.522 19668 354 1 . 1 1 64 64 ILE HA H 64 3.720 3.720 3.826 -0.106 19668 355 1 . 1 1 64 64 ILE C C 64 177.858 177.858 177.964 -0.106 19668 356 1 . 1 1 64 64 ILE CA C 64 64.496 64.496 64.317 0.179 19668 357 1 . 1 1 64 64 ILE CB C 64 37.981 37.981 37.501 0.480 19668 358 1 . 1 1 64 64 ILE H H 64 8.261 8.261 7.257 1.004 19668 359 1 . 1 1 65 65 LYS N N 65 118.693 118.693 118.787 -0.094 19668 360 1 . 1 1 65 65 LYS HA H 65 4.098 4.098 4.159 -0.061 19668 361 1 . 1 1 65 65 LYS C C 65 177.244 177.244 177.737 -0.493 19668 362 1 . 1 1 65 65 LYS CA C 65 58.653 58.653 58.363 0.290 19668 363 1 . 1 1 65 65 LYS CB C 65 32.705 32.705 32.193 0.512 19668 364 1 . 1 1 65 65 LYS H H 65 7.661 7.661 7.598 0.063 19668 365 1 . 1 1 66 66 LYS N N 66 116.933 116.933 117.360 -0.427 19668 366 1 . 1 1 66 66 LYS HA H 66 4.338 4.338 4.137 0.201 19668 367 1 . 1 1 66 66 LYS C C 66 176.011 176.011 177.088 -1.077 19668 368 1 . 1 1 66 66 LYS CA C 66 56.459 56.459 57.747 -1.288 19668 369 1 . 1 1 66 66 LYS CB C 66 33.131 33.131 32.826 0.305 19668 370 1 . 1 1 66 66 LYS H H 66 7.261 7.261 7.608 -0.347 19668 stop_ save_