data_25757 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25757 _Entry.PDB_ID 2N6A 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 25757 _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 9 9 ILE N N 9 116.733 116.733 119.320 -2.587 25757 2 1 1 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.423 -0.666 25757 3 1 1 . 1 1 9 9 ILE C C 9 177.828 177.828 177.460 0.368 25757 4 1 1 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.274 3.330 25757 5 1 1 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.388 0.210 25757 6 1 1 . 1 1 9 9 ILE H H 9 7.366 7.366 8.105 -0.739 25757 7 1 1 . 1 1 10 10 ALA N N 10 121.080 121.080 123.799 -2.719 25757 8 1 1 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.096 -0.021 25757 9 1 1 . 1 1 10 10 ALA C C 10 180.921 180.921 179.009 1.912 25757 10 1 1 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.394 0.209 25757 11 1 1 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.487 0.497 25757 12 1 1 . 1 1 10 10 ALA H H 10 8.039 8.039 8.383 -0.344 25757 13 1 1 . 1 1 11 11 GLU N N 11 119.580 119.580 118.227 1.353 25757 14 1 1 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.954 0.135 25757 15 1 1 . 1 1 11 11 GLU C C 11 179.561 179.561 178.933 0.628 25757 16 1 1 . 1 1 11 11 GLU CA C 11 59.885 59.885 58.915 0.970 25757 17 1 1 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.511 0.952 25757 18 1 1 . 1 1 11 11 GLU H H 11 7.741 7.741 8.819 -1.078 25757 19 1 1 . 1 1 12 12 PHE N N 12 118.509 118.509 119.983 -1.474 25757 20 1 1 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.546 0.280 25757 21 1 1 . 1 1 12 12 PHE C C 12 179.000 179.000 178.509 0.491 25757 22 1 1 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.949 0.215 25757 23 1 1 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.328 -0.218 25757 24 1 1 . 1 1 12 12 PHE H H 12 8.470 8.470 7.071 1.399 25757 25 1 1 . 1 1 13 13 LYS N N 13 123.523 123.523 119.336 4.187 25757 26 1 1 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.099 -0.073 25757 27 1 1 . 1 1 13 13 LYS C C 13 179.260 179.260 179.544 -0.284 25757 28 1 1 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.760 0.404 25757 29 1 1 . 1 1 13 13 LYS CB C 13 31.833 31.833 31.889 -0.056 25757 30 1 1 . 1 1 13 13 LYS H H 13 9.171 9.171 8.381 0.790 25757 31 1 1 . 1 1 14 14 GLU N N 14 120.415 120.415 119.385 1.030 25757 32 1 1 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.288 -0.193 25757 33 1 1 . 1 1 14 14 GLU C C 14 179.851 179.851 178.793 1.058 25757 34 1 1 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.069 0.517 25757 35 1 1 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.577 -0.016 25757 36 1 1 . 1 1 14 14 GLU H H 14 7.822 7.822 8.439 -0.617 25757 37 1 1 . 1 1 15 15 ALA N N 15 122.143 122.143 122.635 -0.492 25757 38 1 1 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.199 -0.069 25757 39 1 1 . 1 1 15 15 ALA C C 15 178.222 178.222 178.862 -0.640 25757 40 1 1 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.180 0.010 25757 41 1 1 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.769 -0.267 25757 42 1 1 . 1 1 15 15 ALA H H 15 8.244 8.244 7.987 0.257 25757 43 1 1 . 1 1 16 16 PHE N N 16 119.809 119.809 117.562 2.247 25757 44 1 1 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.109 -0.097 25757 45 1 1 . 1 1 16 16 PHE C C 16 177.444 177.444 176.415 1.029 25757 46 1 1 . 1 1 16 16 PHE CA C 16 62.064 62.064 59.627 2.437 25757 47 1 1 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.495 -1.063 25757 48 1 1 . 1 1 16 16 PHE H H 16 8.891 8.891 8.304 0.587 25757 49 1 1 . 1 1 17 17 SER N N 17 112.631 112.631 117.318 -4.687 25757 50 1 1 . 1 1 17 17 SER HA H 17 4.034 4.034 3.897 0.137 25757 51 1 1 . 1 1 17 17 SER C C 17 174.675 174.675 176.200 -1.525 25757 52 1 1 . 1 1 17 17 SER CA C 17 61.507 61.507 61.693 -0.186 25757 53 1 1 . 1 1 17 17 SER CB C 17 63.414 63.414 63.529 -0.115 25757 54 1 1 . 1 1 17 17 SER H H 17 7.910 7.910 8.411 -0.501 25757 55 1 1 . 1 1 18 18 LEU N N 18 120.614 120.614 117.891 2.723 25757 56 1 1 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.253 -0.241 25757 57 1 1 . 1 1 18 18 LEU C C 18 177.366 177.366 178.001 -0.635 25757 58 1 1 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.272 0.114 25757 59 1 1 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.896 -0.301 25757 60 1 1 . 1 1 18 18 LEU H H 18 7.423 7.423 8.044 -0.621 25757 61 1 1 . 1 1 19 19 PHE N N 19 114.602 114.602 119.421 -4.819 25757 62 1 1 . 1 1 19 19 PHE C C 19 176.961 176.961 176.392 0.569 25757 63 1 1 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.524 -1.040 25757 64 1 1 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.280 1.489 25757 65 1 1 . 1 1 19 19 PHE H H 19 7.254 7.254 7.296 -0.042 25757 66 1 1 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.584 -0.009 25757 67 1 1 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.275 -1.627 25757 68 1 1 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.749 -0.739 25757 69 1 1 . 1 1 23 23 GLY N N 23 108.244 108.244 108.055 0.189 25757 70 1 1 . 1 1 23 23 GLY C C 23 175.188 175.188 174.961 0.227 25757 71 1 1 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.183 1.220 25757 72 1 1 . 1 1 23 23 GLY H H 23 7.555 7.555 8.243 -0.688 25757 73 1 1 . 1 1 24 24 ASP N N 24 120.667 120.667 119.962 0.705 25757 74 1 1 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.628 -0.159 25757 75 1 1 . 1 1 24 24 ASP C C 24 177.457 177.457 177.869 -0.412 25757 76 1 1 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.499 0.293 25757 77 1 1 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.705 -1.189 25757 78 1 1 . 1 1 24 24 ASP H H 24 8.397 8.397 8.274 0.123 25757 79 1 1 . 1 1 25 25 GLY N N 25 112.989 112.989 108.801 4.188 25757 80 1 1 . 1 1 25 25 GLY C C 25 173.639 173.639 173.402 0.237 25757 81 1 1 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.225 0.276 25757 82 1 1 . 1 1 25 25 GLY H H 25 10.592 10.592 8.185 2.407 25757 83 1 1 . 1 1 26 26 THR N N 26 112.948 112.948 112.759 0.189 25757 84 1 1 . 1 1 26 26 THR HA H 26 5.282 5.282 5.070 0.212 25757 85 1 1 . 1 1 26 26 THR C C 26 172.853 172.853 172.687 0.166 25757 86 1 1 . 1 1 26 26 THR CA C 26 59.817 59.817 61.525 -1.708 25757 87 1 1 . 1 1 26 26 THR CB C 26 72.465 72.465 71.413 1.052 25757 88 1 1 . 1 1 26 26 THR H H 26 8.121 8.121 8.290 -0.169 25757 89 1 1 . 1 1 27 27 ILE N N 27 127.195 127.195 122.824 4.371 25757 90 1 1 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.776 0.137 25757 91 1 1 . 1 1 27 27 ILE C C 27 176.091 176.091 174.747 1.344 25757 92 1 1 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.304 0.461 25757 93 1 1 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.921 -2.216 25757 94 1 1 . 1 1 27 27 ILE H H 27 9.867 9.867 8.591 1.276 25757 95 1 1 . 1 1 28 28 THR N N 28 116.655 116.655 119.626 -2.971 25757 96 1 1 . 1 1 28 28 THR HA H 28 4.790 4.790 4.817 -0.027 25757 97 1 1 . 1 1 28 28 THR C C 28 176.696 176.696 176.349 0.347 25757 98 1 1 . 1 1 28 28 THR CA C 28 59.590 59.590 59.240 0.350 25757 99 1 1 . 1 1 28 28 THR CB C 28 72.457 72.457 70.463 1.994 25757 100 1 1 . 1 1 28 28 THR H H 28 8.457 8.457 8.300 0.157 25757 101 1 1 . 1 1 29 29 THR N N 29 111.878 111.878 115.175 -3.297 25757 102 1 1 . 1 1 29 29 THR HA H 29 4.188 4.188 3.975 0.213 25757 103 1 1 . 1 1 29 29 THR C C 29 177.399 177.399 176.233 1.166 25757 104 1 1 . 1 1 29 29 THR CA C 29 66.386 66.386 66.163 0.223 25757 105 1 1 . 1 1 29 29 THR CB C 29 67.726 67.726 68.683 -0.957 25757 106 1 1 . 1 1 29 29 THR H H 29 9.211 9.211 8.945 0.266 25757 107 1 1 . 1 1 30 30 LYS N N 30 121.140 121.140 121.689 -0.549 25757 108 1 1 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.938 0.139 25757 109 1 1 . 1 1 30 30 LYS C C 30 179.793 179.793 178.671 1.122 25757 110 1 1 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.418 -0.126 25757 111 1 1 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.014 0.433 25757 112 1 1 . 1 1 30 30 LYS H H 30 7.580 7.580 7.640 -0.060 25757 113 1 1 . 1 1 31 31 GLU N N 31 121.865 121.865 119.516 2.349 25757 114 1 1 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.873 0.121 25757 115 1 1 . 1 1 31 31 GLU C C 31 179.355 179.355 178.850 0.505 25757 116 1 1 . 1 1 31 31 GLU CA C 31 59.633 59.633 60.045 -0.413 25757 117 1 1 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.416 0.436 25757 118 1 1 . 1 1 31 31 GLU H H 31 7.708 7.708 7.607 0.101 25757 119 1 1 . 1 1 32 32 LEU N N 32 120.597 120.597 117.380 3.217 25757 120 1 1 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.903 0.213 25757 121 1 1 . 1 1 32 32 LEU C C 32 178.885 178.885 179.052 -0.167 25757 122 1 1 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.224 0.137 25757 123 1 1 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.962 2.074 25757 124 1 1 . 1 1 32 32 LEU H H 32 8.688 8.688 7.627 1.061 25757 125 1 1 . 1 1 33 33 GLY N N 33 104.837 104.837 107.638 -2.801 25757 126 1 1 . 1 1 33 33 GLY C C 33 175.123 175.123 176.088 -0.965 25757 127 1 1 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.511 0.737 25757 128 1 1 . 1 1 33 33 GLY H H 33 8.694 8.694 8.519 0.175 25757 129 1 1 . 1 1 34 34 THR N N 34 117.631 117.631 118.591 -0.960 25757 130 1 1 . 1 1 34 34 THR HA H 34 3.899 3.899 4.034 -0.135 25757 131 1 1 . 1 1 34 34 THR C C 34 176.951 176.951 176.579 0.372 25757 132 1 1 . 1 1 34 34 THR CA C 34 67.234 67.234 66.511 0.723 25757 133 1 1 . 1 1 34 34 THR CB C 34 68.863 68.863 68.514 0.349 25757 134 1 1 . 1 1 34 34 THR H H 34 7.960 7.960 7.997 -0.037 25757 135 1 1 . 1 1 35 35 VAL N N 35 121.659 121.659 122.004 -0.345 25757 136 1 1 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.635 -0.118 25757 137 1 1 . 1 1 35 35 VAL C C 35 178.265 178.265 177.136 1.129 25757 138 1 1 . 1 1 35 35 VAL CA C 35 66.675 66.675 65.343 1.332 25757 139 1 1 . 1 1 35 35 VAL CB C 35 31.293 31.293 30.602 0.691 25757 140 1 1 . 1 1 35 35 VAL H H 35 7.358 7.358 8.154 -0.796 25757 141 1 1 . 1 1 36 36 MET N N 36 117.456 117.456 115.932 1.524 25757 142 1 1 . 1 1 36 36 MET C C 36 179.088 179.088 178.659 0.429 25757 143 1 1 . 1 1 36 36 MET CA C 36 60.477 60.477 58.401 2.076 25757 144 1 1 . 1 1 36 36 MET CB C 36 32.443 32.443 32.968 -0.525 25757 145 1 1 . 1 1 36 36 MET H H 36 8.194 8.194 8.006 0.188 25757 146 1 1 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.850 0.297 25757 147 1 1 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.117 0.233 25757 148 1 1 . 1 1 38 38 SER HA H 38 4.085 4.085 4.340 -0.255 25757 149 1 1 . 1 1 38 38 SER C C 38 173.788 173.788 174.367 -0.579 25757 150 1 1 . 1 1 38 38 SER CA C 38 61.617 61.617 59.912 1.705 25757 151 1 1 . 1 1 38 38 SER CB C 38 62.943 62.943 63.146 -0.203 25757 152 1 1 . 1 1 39 39 LEU N N 39 119.003 119.003 120.234 -1.231 25757 153 1 1 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.458 0.036 25757 154 1 1 . 1 1 39 39 LEU C C 39 176.470 176.470 177.251 -0.781 25757 155 1 1 . 1 1 39 39 LEU CA C 39 53.679 53.679 52.974 0.705 25757 156 1 1 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.167 0.347 25757 157 1 1 . 1 1 39 39 LEU H H 39 7.230 7.230 7.341 -0.111 25757 158 1 1 . 1 1 40 40 GLY N N 40 105.026 105.026 107.646 -2.620 25757 159 1 1 . 1 1 40 40 GLY C C 40 174.322 174.322 173.878 0.444 25757 160 1 1 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.430 0.785 25757 161 1 1 . 1 1 40 40 GLY H H 40 7.698 7.698 7.756 -0.058 25757 162 1 1 . 1 1 41 41 GLN N N 41 117.929 117.929 118.796 -0.867 25757 163 1 1 . 1 1 41 41 GLN C C 41 174.557 174.557 174.429 0.128 25757 164 1 1 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.919 -0.075 25757 165 1 1 . 1 1 41 41 GLN H H 41 7.866 7.866 7.550 0.316 25757 166 1 1 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.572 0.164 25757 167 1 1 . 1 1 43 43 PRO C C 43 177.805 177.805 175.973 1.832 25757 168 1 1 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.901 -0.396 25757 169 1 1 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.529 -0.367 25757 170 1 1 . 1 1 44 44 THR N N 44 113.167 113.167 114.191 -1.024 25757 171 1 1 . 1 1 44 44 THR HA H 44 4.684 4.684 4.566 0.118 25757 172 1 1 . 1 1 44 44 THR C C 44 175.139 175.139 175.772 -0.633 25757 173 1 1 . 1 1 44 44 THR CA C 44 60.556 60.556 59.848 0.708 25757 174 1 1 . 1 1 44 44 THR CB C 44 71.064 71.064 71.766 -0.702 25757 175 1 1 . 1 1 44 44 THR H H 44 8.798 8.798 7.621 1.177 25757 176 1 1 . 1 1 45 45 GLU N N 45 120.673 120.673 120.755 -0.082 25757 177 1 1 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.985 0.006 25757 178 1 1 . 1 1 45 45 GLU C C 45 178.940 178.940 178.724 0.216 25757 179 1 1 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.935 -0.034 25757 180 1 1 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.284 -0.255 25757 181 1 1 . 1 1 45 45 GLU H H 45 8.812 8.812 8.966 -0.154 25757 182 1 1 . 1 1 46 46 ALA N N 46 120.576 120.576 121.337 -0.761 25757 183 1 1 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.068 -0.101 25757 184 1 1 . 1 1 46 46 ALA C C 46 180.290 180.290 179.743 0.547 25757 185 1 1 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.265 -0.346 25757 186 1 1 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.311 -0.150 25757 187 1 1 . 1 1 46 46 ALA H H 46 8.276 8.276 8.420 -0.144 25757 188 1 1 . 1 1 47 47 GLU N N 47 116.104 116.104 118.640 -2.536 25757 189 1 1 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.040 -0.040 25757 190 1 1 . 1 1 47 47 GLU C C 47 180.224 180.224 179.171 1.053 25757 191 1 1 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.425 -0.494 25757 192 1 1 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.360 0.629 25757 193 1 1 . 1 1 47 47 GLU H H 47 7.425 7.425 7.811 -0.387 25757 194 1 1 . 1 1 48 48 LEU N N 48 120.425 120.425 120.066 0.359 25757 195 1 1 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.955 0.095 25757 196 1 1 . 1 1 48 48 LEU C C 48 178.551 178.551 179.067 -0.516 25757 197 1 1 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.138 -0.299 25757 198 1 1 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.395 1.174 25757 199 1 1 . 1 1 48 48 LEU H H 48 8.121 8.121 7.775 0.346 25757 200 1 1 . 1 1 49 49 GLN N N 49 118.372 118.372 118.711 -0.339 25757 201 1 1 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.793 -0.031 25757 202 1 1 . 1 1 49 49 GLN C C 49 178.567 178.567 177.993 0.574 25757 203 1 1 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.401 -0.538 25757 204 1 1 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.453 -0.211 25757 205 1 1 . 1 1 49 49 GLN H H 49 8.302 8.302 8.440 -0.138 25757 206 1 1 . 1 1 50 50 ASP N N 50 119.992 119.992 120.277 -0.285 25757 207 1 1 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.382 -0.022 25757 208 1 1 . 1 1 50 50 ASP C C 50 178.600 178.600 178.420 0.180 25757 209 1 1 . 1 1 50 50 ASP CA C 50 57.703 57.703 56.946 0.757 25757 210 1 1 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.815 -0.348 25757 211 1 1 . 1 1 50 50 ASP H H 50 8.150 8.150 8.244 -0.094 25757 212 1 1 . 1 1 51 51 MET N N 51 119.238 119.238 119.072 0.166 25757 213 1 1 . 1 1 51 51 MET HA H 51 3.981 3.981 3.977 0.004 25757 214 1 1 . 1 1 51 51 MET C C 51 179.006 179.006 178.936 0.070 25757 215 1 1 . 1 1 51 51 MET CA C 51 59.443 59.443 59.592 -0.149 25757 216 1 1 . 1 1 51 51 MET CB C 51 33.380 33.380 32.765 0.615 25757 217 1 1 . 1 1 51 51 MET H H 51 7.844 7.844 7.973 -0.129 25757 218 1 1 . 1 1 52 52 ILE N N 52 118.161 118.161 118.455 -0.294 25757 219 1 1 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.703 -0.225 25757 220 1 1 . 1 1 52 52 ILE C C 52 177.847 177.847 178.850 -1.003 25757 221 1 1 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.192 0.803 25757 222 1 1 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.685 0.438 25757 223 1 1 . 1 1 52 52 ILE H H 52 7.686 7.686 8.306 -0.620 25757 224 1 1 . 1 1 53 53 ASN N N 53 117.884 117.884 117.679 0.205 25757 225 1 1 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.487 -0.122 25757 226 1 1 . 1 1 53 53 ASN C C 53 177.515 177.515 177.841 -0.326 25757 227 1 1 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.927 0.280 25757 228 1 1 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.668 -0.590 25757 229 1 1 . 1 1 53 53 ASN H H 53 8.713 8.713 8.309 0.404 25757 230 1 1 . 1 1 54 54 GLU N N 54 116.178 116.178 117.598 -1.420 25757 231 1 1 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.360 -0.371 25757 232 1 1 . 1 1 54 54 GLU C C 54 177.557 177.557 177.520 0.037 25757 233 1 1 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.694 1.296 25757 234 1 1 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.435 0.028 25757 235 1 1 . 1 1 54 54 GLU H H 54 7.530 7.530 8.062 -0.532 25757 236 1 1 . 1 1 55 55 VAL N N 55 107.164 107.164 111.371 -4.207 25757 237 1 1 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.330 0.192 25757 238 1 1 . 1 1 55 55 VAL C C 55 175.602 175.602 174.373 1.229 25757 239 1 1 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.552 -0.200 25757 240 1 1 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.644 0.959 25757 241 1 1 . 1 1 55 55 VAL H H 55 7.175 7.175 7.644 -0.469 25757 242 1 1 . 1 1 56 56 ASP N N 56 122.126 122.126 121.429 0.697 25757 243 1 1 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.101 -0.502 25757 244 1 1 . 1 1 56 56 ASP C C 56 176.182 176.182 175.908 0.274 25757 245 1 1 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.626 0.180 25757 246 1 1 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.316 -2.046 25757 247 1 1 . 1 1 56 56 ASP H H 56 7.569 7.569 7.402 0.167 25757 248 1 1 . 1 1 57 57 ALA N N 57 103.782 103.782 128.850 -25.068 25757 249 1 1 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.215 -0.035 25757 250 1 1 . 1 1 57 57 ALA C C 57 178.584 178.584 177.961 0.623 25757 251 1 1 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.421 0.923 25757 252 1 1 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.918 -0.394 25757 253 1 1 . 1 1 57 57 ALA H H 57 8.515 8.515 8.547 -0.032 25757 254 1 1 . 1 1 58 58 ASP N N 58 113.602 113.602 118.127 -4.525 25757 255 1 1 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.648 -0.062 25757 256 1 1 . 1 1 58 58 ASP C C 58 177.756 177.756 176.878 0.878 25757 257 1 1 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.093 -1.331 25757 258 1 1 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.335 -1.657 25757 259 1 1 . 1 1 58 58 ASP H H 58 8.130 8.130 8.423 -0.293 25757 260 1 1 . 1 1 59 59 GLY N N 59 109.195 109.195 109.450 -0.255 25757 261 1 1 . 1 1 59 59 GLY C C 59 175.139 175.139 174.653 0.486 25757 262 1 1 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.320 1.944 25757 263 1 1 . 1 1 59 59 GLY H H 59 7.694 7.694 8.287 -0.593 25757 264 1 1 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.805 -0.200 25757 265 1 1 . 1 1 61 61 GLY N N 61 113.316 113.316 109.305 4.011 25757 266 1 1 . 1 1 61 61 GLY C C 61 173.234 173.234 173.285 -0.051 25757 267 1 1 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.357 0.341 25757 268 1 1 . 1 1 61 61 GLY H H 61 10.633 10.633 8.589 2.044 25757 269 1 1 . 1 1 62 62 THR N N 62 108.892 108.892 110.197 -1.305 25757 270 1 1 . 1 1 62 62 THR HA H 62 4.736 4.736 4.819 -0.083 25757 271 1 1 . 1 1 62 62 THR C C 62 173.091 173.091 173.364 -0.273 25757 272 1 1 . 1 1 62 62 THR CA C 62 59.617 59.617 59.839 -0.222 25757 273 1 1 . 1 1 62 62 THR CB C 62 72.004 72.004 72.432 -0.428 25757 274 1 1 . 1 1 62 62 THR H H 62 7.673 7.673 7.934 -0.261 25757 275 1 1 . 1 1 63 63 ILE N N 63 123.324 123.324 124.217 -0.893 25757 276 1 1 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.666 0.463 25757 277 1 1 . 1 1 63 63 ILE C C 63 175.652 175.652 175.326 0.326 25757 278 1 1 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.823 -0.337 25757 279 1 1 . 1 1 63 63 ILE CB C 63 39.957 39.957 39.932 0.025 25757 280 1 1 . 1 1 63 63 ILE H H 63 8.907 8.907 8.704 0.203 25757 281 1 1 . 1 1 64 64 ASP N N 64 128.253 128.253 127.668 0.585 25757 282 1 1 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.899 0.422 25757 283 1 1 . 1 1 64 64 ASP C C 64 176.431 176.431 177.434 -1.003 25757 284 1 1 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.504 -1.173 25757 285 1 1 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.668 -0.615 25757 286 1 1 . 1 1 64 64 ASP H H 64 8.864 8.864 9.074 -0.210 25757 287 1 1 . 1 1 65 65 PHE N N 65 118.583 118.583 119.613 -1.030 25757 288 1 1 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.247 -0.387 25757 289 1 1 . 1 1 65 65 PHE C C 65 173.458 173.458 175.264 -1.806 25757 290 1 1 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.564 0.235 25757 291 1 1 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.043 -1.163 25757 292 1 1 . 1 1 65 65 PHE H H 65 8.962 8.962 8.968 -0.006 25757 293 1 1 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.344 -0.226 25757 294 1 1 . 1 1 66 66 PRO C C 66 180.038 180.038 178.536 1.502 25757 295 1 1 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.544 1.146 25757 296 1 1 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.093 -0.416 25757 297 1 1 . 1 1 67 67 GLU N N 67 118.402 118.402 118.996 -0.594 25757 298 1 1 . 1 1 67 67 GLU C C 67 178.737 178.737 178.734 0.003 25757 299 1 1 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.877 -0.869 25757 300 1 1 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.198 0.487 25757 301 1 1 . 1 1 67 67 GLU H H 67 7.953 7.953 8.623 -0.670 25757 302 1 1 . 1 1 68 68 PHE N N 68 123.421 123.421 120.340 3.081 25757 303 1 1 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.130 -0.158 25757 304 1 1 . 1 1 68 68 PHE C C 68 177.184 177.184 177.012 0.172 25757 305 1 1 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.127 0.211 25757 306 1 1 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.957 1.012 25757 307 1 1 . 1 1 68 68 PHE H H 68 8.928 8.928 7.486 1.442 25757 308 1 1 . 1 1 69 69 LEU N N 69 119.284 119.284 119.440 -0.156 25757 309 1 1 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.592 -0.257 25757 310 1 1 . 1 1 69 69 LEU C C 69 178.987 178.987 178.577 0.410 25757 311 1 1 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.648 -0.786 25757 312 1 1 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.760 -0.928 25757 313 1 1 . 1 1 69 69 LEU H H 69 8.374 8.374 7.653 0.721 25757 314 1 1 . 1 1 70 70 THR N N 70 116.017 116.017 114.327 1.690 25757 315 1 1 . 1 1 70 70 THR HA H 70 4.338 4.338 3.783 0.555 25757 316 1 1 . 1 1 70 70 THR C C 70 176.169 176.169 176.464 -0.295 25757 317 1 1 . 1 1 70 70 THR CA C 70 66.700 66.700 66.539 0.161 25757 318 1 1 . 1 1 70 70 THR CB C 70 68.379 68.379 68.501 -0.122 25757 319 1 1 . 1 1 70 70 THR H H 70 7.493 7.493 8.225 -0.732 25757 320 1 1 . 1 1 71 71 MET N N 71 121.915 121.915 122.284 -0.369 25757 321 1 1 . 1 1 71 71 MET HA H 71 3.718 3.718 3.937 -0.219 25757 322 1 1 . 1 1 71 71 MET C C 71 178.190 178.190 178.222 -0.032 25757 323 1 1 . 1 1 71 71 MET CA C 71 59.335 59.335 59.163 0.171 25757 324 1 1 . 1 1 71 71 MET CB C 71 33.894 33.894 32.415 1.479 25757 325 1 1 . 1 1 71 71 MET H H 71 7.924 7.924 7.860 0.064 25757 326 1 1 . 1 1 72 72 MET N N 72 116.973 116.973 115.862 1.111 25757 327 1 1 . 1 1 72 72 MET HA H 72 3.968 3.968 4.247 -0.279 25757 328 1 1 . 1 1 72 72 MET C C 72 178.211 178.211 178.187 0.024 25757 329 1 1 . 1 1 72 72 MET CA C 72 56.059 56.059 58.321 -2.262 25757 330 1 1 . 1 1 72 72 MET CB C 72 31.639 31.639 31.707 -0.068 25757 331 1 1 . 1 1 72 72 MET H H 72 8.276 8.276 7.892 0.384 25757 332 1 1 . 1 1 73 73 ALA N N 73 122.499 122.499 122.360 0.139 25757 333 1 1 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.910 0.040 25757 334 1 1 . 1 1 73 73 ALA C C 73 180.231 180.231 178.844 1.387 25757 335 1 1 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.897 0.056 25757 336 1 1 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.825 0.207 25757 337 1 1 . 1 1 73 73 ALA H H 73 8.240 8.240 8.209 0.031 25757 338 1 1 . 1 1 74 74 ARG N N 74 116.098 116.098 118.991 -2.893 25757 339 1 1 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.992 0.000 25757 340 1 1 . 1 1 74 74 ARG C C 74 178.567 178.567 178.449 0.118 25757 341 1 1 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.056 -0.231 25757 342 1 1 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.215 -0.140 25757 343 1 1 . 1 1 74 74 ARG H H 74 7.420 7.420 7.574 -0.154 25757 344 1 1 . 1 1 75 75 LYS N N 75 119.046 119.046 120.195 -1.149 25757 345 1 1 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.005 0.038 25757 346 1 1 . 1 1 75 75 LYS C C 75 179.045 179.045 178.938 0.107 25757 347 1 1 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.849 -0.960 25757 348 1 1 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.467 0.299 25757 349 1 1 . 1 1 75 75 LYS H H 75 7.862 7.862 8.226 -0.364 25757 350 1 1 . 1 1 76 76 MET N N 76 116.772 116.772 119.211 -2.439 25757 351 1 1 . 1 1 76 76 MET H H 76 8.099 8.099 7.899 0.200 25757 352 1 1 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.602 0.032 25757 353 1 1 . 1 1 78 78 ASP C C 78 176.395 176.395 176.608 -0.213 25757 354 1 1 . 1 1 78 78 ASP CA C 78 54.644 54.644 55.114 -0.470 25757 355 1 1 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.593 -0.119 25757 356 1 1 . 1 1 79 79 THR N N 79 113.904 113.904 114.991 -1.087 25757 357 1 1 . 1 1 79 79 THR HA H 79 4.215 4.215 4.054 0.161 25757 358 1 1 . 1 1 79 79 THR C C 79 174.204 174.204 174.497 -0.293 25757 359 1 1 . 1 1 79 79 THR CA C 79 62.264 62.264 64.151 -1.887 25757 360 1 1 . 1 1 79 79 THR CB C 79 69.884 69.884 69.158 0.726 25757 361 1 1 . 1 1 79 79 THR H H 79 8.039 8.039 8.485 -0.446 25757 362 1 1 . 1 1 80 80 ASP N N 80 123.572 123.572 117.404 6.168 25757 363 1 1 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.865 -0.145 25757 364 1 1 . 1 1 80 80 ASP C C 80 176.221 176.221 175.253 0.968 25757 365 1 1 . 1 1 80 80 ASP CA C 80 54.315 54.315 53.363 0.952 25757 366 1 1 . 1 1 80 80 ASP CB C 80 41.427 41.427 43.205 -1.778 25757 367 1 1 . 1 1 80 80 ASP H H 80 8.441 8.441 7.910 0.531 25757 368 1 1 . 1 1 81 81 SER N N 81 117.879 117.879 115.598 2.281 25757 369 1 1 . 1 1 81 81 SER HA H 81 3.925 3.925 4.558 -0.633 25757 370 1 1 . 1 1 81 81 SER C C 81 175.264 175.264 175.491 -0.227 25757 371 1 1 . 1 1 81 81 SER CA C 81 58.860 58.860 58.706 0.154 25757 372 1 1 . 1 1 81 81 SER CB C 81 63.790 63.790 63.797 -0.007 25757 373 1 1 . 1 1 81 81 SER H H 81 8.503 8.503 8.586 -0.083 25757 374 1 1 . 1 1 82 82 GLU N N 82 123.206 123.206 122.340 0.866 25757 375 1 1 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.985 0.073 25757 376 1 1 . 1 1 82 82 GLU C C 82 178.378 178.378 178.546 -0.168 25757 377 1 1 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.375 -0.789 25757 378 1 1 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.609 -0.006 25757 379 1 1 . 1 1 82 82 GLU H H 82 8.563 8.563 8.636 -0.073 25757 380 1 1 . 1 1 83 83 GLU N N 83 119.262 119.262 118.203 1.059 25757 381 1 1 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.993 -0.036 25757 382 1 1 . 1 1 83 83 GLU C C 83 178.606 178.606 179.274 -0.668 25757 383 1 1 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.729 -0.060 25757 384 1 1 . 1 1 83 83 GLU CB C 83 29.355 29.355 28.835 0.520 25757 385 1 1 . 1 1 83 83 GLU H H 83 7.728 7.728 8.571 -0.843 25757 386 1 1 . 1 1 84 84 GLU N N 84 118.432 118.432 119.332 -0.900 25757 387 1 1 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.065 0.042 25757 388 1 1 . 1 1 84 84 GLU C C 84 179.436 179.436 179.270 0.166 25757 389 1 1 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.576 -0.073 25757 390 1 1 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.223 -0.116 25757 391 1 1 . 1 1 84 84 GLU H H 84 8.346 8.346 8.390 -0.044 25757 392 1 1 . 1 1 85 85 ILE N N 85 120.925 120.925 120.022 0.903 25757 393 1 1 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.754 -0.006 25757 394 1 1 . 1 1 85 85 ILE C C 85 177.661 177.661 178.042 -0.381 25757 395 1 1 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.486 0.004 25757 396 1 1 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.844 -0.413 25757 397 1 1 . 1 1 85 85 ILE H H 85 7.821 7.821 8.294 -0.473 25757 398 1 1 . 1 1 86 86 ARG N N 86 121.916 121.916 119.065 2.851 25757 399 1 1 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.123 0.013 25757 400 1 1 . 1 1 86 86 ARG C C 86 179.208 179.208 178.777 0.431 25757 401 1 1 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.508 0.863 25757 402 1 1 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.445 0.652 25757 403 1 1 . 1 1 86 86 ARG H H 86 8.432 8.432 8.361 0.071 25757 404 1 1 . 1 1 87 87 GLU N N 87 118.261 118.261 119.555 -1.294 25757 405 1 1 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.968 0.144 25757 406 1 1 . 1 1 87 87 GLU C C 87 178.516 178.516 178.730 -0.214 25757 407 1 1 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.276 -0.251 25757 408 1 1 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.197 -0.027 25757 409 1 1 . 1 1 87 87 GLU H H 87 8.225 8.225 8.244 -0.019 25757 410 1 1 . 1 1 88 88 ALA N N 88 121.009 121.009 122.774 -1.765 25757 411 1 1 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.530 0.297 25757 412 1 1 . 1 1 88 88 ALA C C 88 177.947 177.947 178.218 -0.271 25757 413 1 1 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.945 -0.084 25757 414 1 1 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.294 -0.339 25757 415 1 1 . 1 1 88 88 ALA H H 88 7.789 7.789 8.057 -0.268 25757 416 1 1 . 1 1 89 89 PHE N N 89 117.164 117.164 118.627 -1.463 25757 417 1 1 . 1 1 89 89 PHE C C 89 176.134 176.134 177.394 -1.260 25757 418 1 1 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.468 2.182 25757 419 1 1 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.746 0.147 25757 420 1 1 . 1 1 89 89 PHE H H 89 8.337 8.337 7.607 0.730 25757 421 1 1 . 1 1 90 90 ARG N N 90 114.900 114.900 117.919 -3.019 25757 422 1 1 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.684 0.230 25757 423 1 1 . 1 1 90 90 ARG C C 90 178.296 178.296 177.476 0.820 25757 424 1 1 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.900 0.179 25757 425 1 1 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.573 -0.480 25757 426 1 1 . 1 1 90 90 ARG H H 90 7.681 7.681 7.708 -0.027 25757 427 1 1 . 1 1 91 91 VAL N N 91 116.927 116.927 115.270 1.657 25757 428 1 1 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.821 -0.214 25757 429 1 1 . 1 1 91 91 VAL C C 91 177.964 177.964 177.139 0.825 25757 430 1 1 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.808 0.152 25757 431 1 1 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.775 -0.156 25757 432 1 1 . 1 1 91 91 VAL H H 91 7.405 7.405 7.482 -0.077 25757 433 1 1 . 1 1 92 92 PHE N N 92 119.026 119.026 117.640 1.386 25757 434 1 1 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.321 0.041 25757 435 1 1 . 1 1 92 92 PHE C C 92 177.639 177.639 176.308 1.331 25757 436 1 1 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.252 -0.531 25757 437 1 1 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.745 -0.318 25757 438 1 1 . 1 1 92 92 PHE H H 92 7.886 7.886 7.476 0.410 25757 439 1 1 . 1 1 93 93 ASP N N 93 118.238 118.238 119.566 -1.328 25757 440 1 1 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.995 -0.533 25757 441 1 1 . 1 1 93 93 ASP C C 93 176.979 176.979 177.184 -0.205 25757 442 1 1 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.427 -1.279 25757 443 1 1 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.725 -1.577 25757 444 1 1 . 1 1 93 93 ASP H H 93 8.009 8.009 7.404 0.605 25757 445 1 1 . 1 1 94 94 LYS N N 94 125.792 125.792 126.009 -0.217 25757 446 1 1 . 1 1 94 94 LYS C C 94 178.213 178.213 177.261 0.952 25757 447 1 1 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.568 0.750 25757 448 1 1 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.192 -1.164 25757 449 1 1 . 1 1 94 94 LYS H H 94 7.428 7.428 8.256 -0.828 25757 450 1 1 . 1 1 95 95 ASP N N 95 113.833 113.833 117.861 -4.028 25757 451 1 1 . 1 1 95 95 ASP C C 95 177.718 177.718 177.052 0.666 25757 452 1 1 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.600 -1.655 25757 453 1 1 . 1 1 95 95 ASP CB C 95 39.743 39.743 41.000 -1.257 25757 454 1 1 . 1 1 95 95 ASP H H 95 8.159 8.159 7.909 0.250 25757 455 1 1 . 1 1 96 96 GLY N N 96 109.414 109.414 107.546 1.868 25757 456 1 1 . 1 1 96 96 GLY C C 96 175.093 175.093 174.793 0.300 25757 457 1 1 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.906 1.348 25757 458 1 1 . 1 1 96 96 GLY H H 96 7.848 7.848 8.497 -0.649 25757 459 1 1 . 1 1 97 97 ASN N N 97 119.590 119.590 117.721 1.869 25757 460 1 1 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.513 0.099 25757 461 1 1 . 1 1 97 97 ASN C C 97 175.937 175.937 176.588 -0.651 25757 462 1 1 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.189 -0.301 25757 463 1 1 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.105 -0.785 25757 464 1 1 . 1 1 97 97 ASN H H 97 8.338 8.338 7.901 0.437 25757 465 1 1 . 1 1 98 98 GLY N N 98 112.940 112.940 107.841 5.099 25757 466 1 1 . 1 1 98 98 GLY C C 98 172.429 172.429 172.607 -0.178 25757 467 1 1 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.012 0.080 25757 468 1 1 . 1 1 98 98 GLY H H 98 10.695 10.695 8.879 1.816 25757 469 1 1 . 1 1 99 99 TYR N N 99 115.544 115.544 117.668 -2.124 25757 470 1 1 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.569 -0.482 25757 471 1 1 . 1 1 99 99 TYR C C 99 174.859 174.859 174.841 0.018 25757 472 1 1 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.590 -0.572 25757 473 1 1 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.361 0.992 25757 474 1 1 . 1 1 99 99 TYR H H 99 7.597 7.597 8.124 -0.527 25757 475 1 1 . 1 1 100 100 ILE N N 100 127.078 127.078 123.454 3.624 25757 476 1 1 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.901 -0.112 25757 477 1 1 . 1 1 100 100 ILE C C 100 175.387 175.387 175.966 -0.579 25757 478 1 1 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.449 0.557 25757 479 1 1 . 1 1 100 100 ILE CB C 100 38.790 38.790 40.762 -1.972 25757 480 1 1 . 1 1 100 100 ILE H H 100 10.267 10.267 9.321 0.946 25757 481 1 1 . 1 1 101 101 SER N N 101 124.102 124.102 122.118 1.984 25757 482 1 1 . 1 1 101 101 SER HA H 101 4.417 4.417 5.322 -0.905 25757 483 1 1 . 1 1 101 101 SER C C 101 175.360 175.360 175.370 -0.010 25757 484 1 1 . 1 1 101 101 SER CA C 101 56.036 56.036 56.093 -0.057 25757 485 1 1 . 1 1 101 101 SER CB C 101 66.896 66.896 65.543 1.353 25757 486 1 1 . 1 1 101 101 SER H H 101 8.985 8.985 8.792 0.193 25757 487 1 1 . 1 1 102 102 ALA N N 102 122.780 122.780 127.650 -4.870 25757 488 1 1 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.921 -0.177 25757 489 1 1 . 1 1 102 102 ALA C C 102 179.175 179.175 178.729 0.446 25757 490 1 1 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.858 0.432 25757 491 1 1 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.582 -0.555 25757 492 1 1 . 1 1 102 102 ALA H H 102 9.269 9.269 9.079 0.190 25757 493 1 1 . 1 1 103 103 ALA N N 103 118.513 118.513 121.404 -2.891 25757 494 1 1 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.769 0.242 25757 495 1 1 . 1 1 103 103 ALA C C 103 181.521 181.521 179.501 2.020 25757 496 1 1 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.130 0.224 25757 497 1 1 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.072 0.219 25757 498 1 1 . 1 1 103 103 ALA H H 103 8.321 8.321 8.347 -0.026 25757 499 1 1 . 1 1 104 104 GLU N N 104 119.550 119.550 119.687 -0.137 25757 500 1 1 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.045 -0.039 25757 501 1 1 . 1 1 104 104 GLU C C 104 179.750 179.750 179.100 0.650 25757 502 1 1 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.478 -0.309 25757 503 1 1 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.216 -0.001 25757 504 1 1 . 1 1 104 104 GLU H H 104 7.867 7.867 8.016 -0.149 25757 505 1 1 . 1 1 105 105 LEU N N 105 122.688 122.688 120.143 2.545 25757 506 1 1 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.766 0.152 25757 507 1 1 . 1 1 105 105 LEU C C 105 178.233 178.233 178.663 -0.430 25757 508 1 1 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.260 -0.526 25757 509 1 1 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.658 0.362 25757 510 1 1 . 1 1 105 105 LEU H H 105 8.746 8.746 7.803 0.943 25757 511 1 1 . 1 1 106 106 ARG N N 106 118.835 118.835 118.284 0.551 25757 512 1 1 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.680 -0.030 25757 513 1 1 . 1 1 106 106 ARG C C 106 178.742 178.742 178.604 0.138 25757 514 1 1 . 1 1 106 106 ARG CA C 106 59.963 59.963 60.298 -0.335 25757 515 1 1 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.977 0.069 25757 516 1 1 . 1 1 106 106 ARG H H 106 8.684 8.684 8.363 0.321 25757 517 1 1 . 1 1 107 107 HIS N N 107 119.258 119.258 119.092 0.166 25757 518 1 1 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.279 -0.012 25757 519 1 1 . 1 1 107 107 HIS C C 107 177.244 177.244 178.211 -0.967 25757 520 1 1 . 1 1 107 107 HIS CA C 107 60.152 60.152 59.203 0.949 25757 521 1 1 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.687 0.888 25757 522 1 1 . 1 1 107 107 HIS H H 107 7.691 7.691 8.343 -0.652 25757 523 1 1 . 1 1 108 108 VAL N N 108 118.996 118.996 120.567 -1.571 25757 524 1 1 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.720 -0.282 25757 525 1 1 . 1 1 108 108 VAL C C 108 177.998 177.998 178.233 -0.235 25757 526 1 1 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.956 -0.525 25757 527 1 1 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.493 -0.069 25757 528 1 1 . 1 1 108 108 VAL H H 108 7.599 7.599 8.230 -0.631 25757 529 1 1 . 1 1 109 109 MET N N 109 114.880 114.880 118.338 -3.458 25757 530 1 1 . 1 1 109 109 MET C C 109 179.119 179.119 178.588 0.531 25757 531 1 1 . 1 1 109 109 MET CA C 109 56.979 56.979 58.865 -1.886 25757 532 1 1 . 1 1 109 109 MET CB C 109 29.253 29.253 32.125 -2.872 25757 533 1 1 . 1 1 109 109 MET H H 109 7.911 7.911 8.293 -0.382 25757 534 1 1 . 1 1 110 110 THR N N 110 116.943 116.943 114.235 2.708 25757 535 1 1 . 1 1 110 110 THR HA H 110 4.229 4.229 3.875 0.354 25757 536 1 1 . 1 1 110 110 THR C C 110 178.506 178.506 176.743 1.763 25757 537 1 1 . 1 1 110 110 THR CA C 110 66.573 66.573 66.303 0.270 25757 538 1 1 . 1 1 110 110 THR CB C 110 68.575 68.575 68.618 -0.043 25757 539 1 1 . 1 1 110 110 THR H H 110 8.353 8.353 8.651 -0.298 25757 540 1 1 . 1 1 111 111 ASN N N 111 123.829 123.829 120.442 3.387 25757 541 1 1 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.402 -0.040 25757 542 1 1 . 1 1 111 111 ASN C C 111 177.197 177.197 178.167 -0.970 25757 543 1 1 . 1 1 111 111 ASN CA C 111 55.959 55.959 56.285 -0.326 25757 544 1 1 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.506 -1.283 25757 545 1 1 . 1 1 111 111 ASN H H 111 8.053 8.053 8.243 -0.190 25757 546 1 1 . 1 1 112 112 LEU N N 112 119.036 119.036 117.848 1.188 25757 547 1 1 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.036 0.134 25757 548 1 1 . 1 1 112 112 LEU C C 112 176.377 176.377 176.885 -0.508 25757 549 1 1 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.700 -1.195 25757 550 1 1 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.376 -0.016 25757 551 1 1 . 1 1 112 112 LEU H H 112 7.794 7.794 7.580 0.214 25757 552 1 1 . 1 1 113 113 GLY N N 113 106.045 106.045 104.034 2.011 25757 553 1 1 . 1 1 113 113 GLY C C 113 174.248 174.248 174.024 0.224 25757 554 1 1 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.658 0.649 25757 555 1 1 . 1 1 113 113 GLY H H 113 7.741 7.741 7.550 0.191 25757 556 1 1 . 1 1 114 114 GLU N N 114 120.556 120.556 121.644 -1.088 25757 557 1 1 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.409 -0.099 25757 558 1 1 . 1 1 114 114 GLU C C 114 174.993 174.993 176.015 -1.022 25757 559 1 1 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.193 0.444 25757 560 1 1 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.950 1.267 25757 561 1 1 . 1 1 114 114 GLU H H 114 7.980 7.980 8.217 -0.237 25757 562 1 1 . 1 1 115 115 LYS N N 115 124.986 124.986 126.265 -1.279 25757 563 1 1 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.073 0.261 25757 564 1 1 . 1 1 115 115 LYS C C 115 175.285 175.285 175.704 -0.419 25757 565 1 1 . 1 1 115 115 LYS CA C 115 55.581 55.581 57.226 -1.645 25757 566 1 1 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.742 -0.769 25757 567 1 1 . 1 1 115 115 LYS H H 115 8.613 8.613 8.256 0.357 25757 568 1 1 . 1 1 116 116 LEU N N 116 125.243 125.243 126.156 -0.913 25757 569 1 1 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.538 0.150 25757 570 1 1 . 1 1 116 116 LEU C C 116 178.365 178.365 176.352 2.013 25757 571 1 1 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.211 0.137 25757 572 1 1 . 1 1 116 116 LEU CB C 116 44.289 44.289 45.080 -0.791 25757 573 1 1 . 1 1 116 116 LEU H H 116 8.066 8.066 8.287 -0.221 25757 574 1 1 . 1 1 117 117 THR N N 117 114.324 114.324 113.668 0.656 25757 575 1 1 . 1 1 117 117 THR HA H 117 4.713 4.713 4.550 0.163 25757 576 1 1 . 1 1 117 117 THR C C 117 175.539 175.539 175.126 0.413 25757 577 1 1 . 1 1 117 117 THR CA C 117 60.756 60.756 59.569 1.187 25757 578 1 1 . 1 1 117 117 THR CB C 117 71.144 71.144 70.621 0.523 25757 579 1 1 . 1 1 117 117 THR H H 117 9.228 9.228 7.874 1.354 25757 580 1 1 . 1 1 118 118 ASP N N 118 121.016 121.016 122.068 -1.052 25757 581 1 1 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.288 -0.133 25757 582 1 1 . 1 1 118 118 ASP H H 118 8.919 8.919 8.690 0.229 25757 583 1 1 . 1 1 119 119 GLU N N 119 121.016 121.016 118.839 2.177 25757 584 1 1 . 1 1 119 119 GLU C C 119 179.204 179.204 178.756 0.448 25757 585 1 1 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.208 -1.137 25757 586 1 1 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.466 -0.422 25757 587 1 1 . 1 1 119 119 GLU H H 119 8.919 8.919 8.623 0.296 25757 588 1 1 . 1 1 120 120 GLU N N 120 120.566 120.566 119.961 0.605 25757 589 1 1 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.959 0.042 25757 590 1 1 . 1 1 120 120 GLU C C 120 180.329 180.329 178.935 1.394 25757 591 1 1 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.273 -0.181 25757 592 1 1 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.299 1.339 25757 593 1 1 . 1 1 120 120 GLU H H 120 7.732 7.732 7.394 0.338 25757 594 1 1 . 1 1 121 121 VAL N N 121 121.875 121.875 119.068 2.807 25757 595 1 1 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.572 -0.107 25757 596 1 1 . 1 1 121 121 VAL C C 121 177.477 177.477 178.015 -0.538 25757 597 1 1 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.310 0.861 25757 598 1 1 . 1 1 121 121 VAL CB C 121 31.434 31.434 30.613 0.821 25757 599 1 1 . 1 1 121 121 VAL H H 121 8.104 8.104 7.511 0.593 25757 600 1 1 . 1 1 122 122 ASP N N 122 120.566 120.566 119.936 0.630 25757 601 1 1 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.230 0.105 25757 602 1 1 . 1 1 122 122 ASP C C 122 179.298 179.298 178.341 0.957 25757 603 1 1 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.738 0.101 25757 604 1 1 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.817 -0.505 25757 605 1 1 . 1 1 122 122 ASP H H 122 8.089 8.089 8.151 -0.062 25757 606 1 1 . 1 1 123 123 GLU N N 123 119.821 119.821 119.637 0.184 25757 607 1 1 . 1 1 123 123 GLU HA H 123 4.049 4.049 3.960 0.089 25757 608 1 1 . 1 1 123 123 GLU C C 123 178.749 178.749 178.829 -0.080 25757 609 1 1 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.269 0.049 25757 610 1 1 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.680 -0.294 25757 611 1 1 . 1 1 123 123 GLU H H 123 8.105 8.105 8.154 -0.049 25757 612 1 1 . 1 1 124 124 MET N N 124 119.288 119.288 119.921 -0.633 25757 613 1 1 . 1 1 124 124 MET C C 124 180.865 180.865 178.646 2.219 25757 614 1 1 . 1 1 124 124 MET CA C 124 60.684 60.684 59.587 1.097 25757 615 1 1 . 1 1 124 124 MET CB C 124 33.141 33.141 32.531 0.610 25757 616 1 1 . 1 1 124 124 MET H H 124 7.726 7.726 7.986 -0.260 25757 617 1 1 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.961 -0.232 25757 618 1 1 . 1 1 125 125 ILE C C 125 177.341 177.341 178.091 -0.750 25757 619 1 1 . 1 1 125 125 ILE CA C 125 63.801 63.801 64.060 -0.259 25757 620 1 1 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.503 -0.938 25757 621 1 1 . 1 1 126 126 ARG N N 126 118.555 118.555 120.076 -1.521 25757 622 1 1 . 1 1 126 126 ARG C C 126 179.164 179.164 178.090 1.074 25757 623 1 1 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.096 0.828 25757 624 1 1 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.925 -0.060 25757 625 1 1 . 1 1 126 126 ARG H H 126 8.380 8.380 8.098 0.282 25757 626 1 1 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.338 -0.413 25757 627 1 1 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.876 1.181 25757 628 1 1 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.201 0.627 25757 629 1 1 . 1 1 128 128 ALA N N 128 116.764 116.764 120.636 -3.872 25757 630 1 1 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.144 0.273 25757 631 1 1 . 1 1 128 128 ALA C C 128 177.885 177.885 177.164 0.721 25757 632 1 1 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.035 -1.080 25757 633 1 1 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.796 2.771 25757 634 1 1 . 1 1 128 128 ALA H H 128 7.152 7.152 8.168 -1.016 25757 635 1 1 . 1 1 129 129 ASP N N 129 117.762 117.762 118.229 -0.467 25757 636 1 1 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.138 -0.661 25757 637 1 1 . 1 1 129 129 ASP C C 129 175.935 175.935 176.330 -0.395 25757 638 1 1 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.396 2.119 25757 639 1 1 . 1 1 129 129 ASP CB C 129 40.745 40.745 40.933 -0.188 25757 640 1 1 . 1 1 129 129 ASP H H 129 8.007 8.007 7.929 0.078 25757 641 1 1 . 1 1 130 130 ILE N N 130 128.249 128.249 125.360 2.889 25757 642 1 1 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.872 -0.008 25757 643 1 1 . 1 1 130 130 ILE C C 130 177.764 177.764 177.376 0.388 25757 644 1 1 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.980 -0.432 25757 645 1 1 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.270 0.378 25757 646 1 1 . 1 1 130 130 ILE H H 130 8.412 8.412 8.210 0.202 25757 647 1 1 . 1 1 131 131 ASP N N 131 116.430 116.430 117.565 -1.135 25757 648 1 1 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.579 -0.045 25757 649 1 1 . 1 1 131 131 ASP C C 131 178.313 178.313 176.730 1.583 25757 650 1 1 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.777 -0.893 25757 651 1 1 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.578 -0.616 25757 652 1 1 . 1 1 131 131 ASP H H 131 8.254 8.254 8.280 -0.026 25757 653 1 1 . 1 1 132 132 GLY N N 132 108.460 108.460 108.199 0.261 25757 654 1 1 . 1 1 132 132 GLY C C 132 175.211 175.211 174.593 0.618 25757 655 1 1 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.779 1.823 25757 656 1 1 . 1 1 132 132 GLY H H 132 7.547 7.547 7.823 -0.276 25757 657 1 1 . 1 1 133 133 ASP N N 133 120.909 120.909 119.020 1.889 25757 658 1 1 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.569 -0.106 25757 659 1 1 . 1 1 133 133 ASP C C 133 177.691 177.691 177.118 0.573 25757 660 1 1 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.423 1.391 25757 661 1 1 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.576 -0.278 25757 662 1 1 . 1 1 133 133 ASP H H 133 8.339 8.339 8.127 0.212 25757 663 1 1 . 1 1 134 134 GLY N N 134 112.704 112.704 107.399 5.305 25757 664 1 1 . 1 1 134 134 GLY C C 134 172.722 172.722 173.585 -0.863 25757 665 1 1 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.647 0.390 25757 666 1 1 . 1 1 134 134 GLY H H 134 10.396 10.396 8.129 2.267 25757 667 1 1 . 1 1 135 135 GLN N N 135 114.799 114.799 117.588 -2.789 25757 668 1 1 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.218 -0.354 25757 669 1 1 . 1 1 135 135 GLN C C 135 174.760 174.760 174.997 -0.237 25757 670 1 1 . 1 1 135 135 GLN CA C 135 53.321 53.321 53.990 -0.669 25757 671 1 1 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.044 -0.979 25757 672 1 1 . 1 1 135 135 GLN H H 135 7.975 7.975 8.737 -0.762 25757 673 1 1 . 1 1 136 136 VAL N N 136 125.364 125.364 124.925 0.439 25757 674 1 1 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.735 0.473 25757 675 1 1 . 1 1 136 136 VAL C C 136 175.831 175.831 175.849 -0.018 25757 676 1 1 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.192 0.625 25757 677 1 1 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.355 1.319 25757 678 1 1 . 1 1 136 136 VAL H H 136 9.169 9.169 9.112 0.057 25757 679 1 1 . 1 1 137 137 ASN N N 137 129.155 129.155 126.543 2.612 25757 680 1 1 . 1 1 137 137 ASN C C 137 174.737 174.737 175.875 -1.138 25757 681 1 1 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.714 -0.363 25757 682 1 1 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.488 -3.165 25757 683 1 1 . 1 1 137 137 ASN H H 137 9.652 9.652 8.850 0.802 25757 684 1 1 . 1 1 138 138 TYR N N 138 118.504 118.504 122.537 -4.033 25757 685 1 1 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.562 -0.283 25757 686 1 1 . 1 1 138 138 TYR C C 138 176.174 176.174 177.175 -1.001 25757 687 1 1 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.842 0.732 25757 688 1 1 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.318 -0.588 25757 689 1 1 . 1 1 138 138 TYR H H 138 8.460 8.460 8.565 -0.105 25757 690 1 1 . 1 1 139 139 GLU N N 139 118.644 118.644 118.130 0.514 25757 691 1 1 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.836 -0.288 25757 692 1 1 . 1 1 139 139 GLU C C 139 180.265 180.265 178.305 1.960 25757 693 1 1 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.180 0.306 25757 694 1 1 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.354 -0.363 25757 695 1 1 . 1 1 139 139 GLU H H 139 8.136 8.136 8.041 0.095 25757 696 1 1 . 1 1 140 140 GLU N N 140 120.030 120.030 116.658 3.372 25757 697 1 1 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.035 -0.147 25757 698 1 1 . 1 1 140 140 GLU C C 140 179.627 179.627 178.090 1.537 25757 699 1 1 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.986 0.691 25757 700 1 1 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.230 0.497 25757 701 1 1 . 1 1 140 140 GLU H H 140 8.798 8.798 8.197 0.601 25757 702 1 1 . 1 1 141 141 PHE N N 141 123.154 123.154 122.421 0.733 25757 703 1 1 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.871 -0.174 25757 704 1 1 . 1 1 141 141 PHE C C 141 176.952 176.952 177.759 -0.807 25757 705 1 1 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.578 1.474 25757 706 1 1 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.330 0.801 25757 707 1 1 . 1 1 141 141 PHE H H 141 8.633 8.633 8.097 0.536 25757 708 1 1 . 1 1 142 142 VAL N N 142 120.046 120.046 116.835 3.211 25757 709 1 1 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.677 -0.721 25757 710 1 1 . 1 1 142 142 VAL C C 142 179.627 179.627 177.484 2.143 25757 711 1 1 . 1 1 142 142 VAL CA C 142 67.243 67.243 64.257 2.986 25757 712 1 1 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.534 0.606 25757 713 1 1 . 1 1 142 142 VAL H H 142 8.894 8.894 7.915 0.979 25757 714 1 1 . 1 1 143 143 GLN N N 143 118.996 118.996 119.234 -0.238 25757 715 1 1 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.007 -0.231 25757 716 1 1 . 1 1 143 143 GLN C C 143 178.443 178.443 178.183 0.260 25757 717 1 1 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.214 0.915 25757 718 1 1 . 1 1 143 143 GLN CB C 143 27.743 27.743 27.823 -0.080 25757 719 1 1 . 1 1 143 143 GLN H H 143 7.627 7.627 7.264 0.363 25757 720 1 1 . 1 1 144 144 MET N N 144 116.361 116.361 118.198 -1.837 25757 721 1 1 . 1 1 144 144 MET HA H 144 4.169 4.169 4.020 0.149 25757 722 1 1 . 1 1 144 144 MET C C 144 178.418 178.418 176.794 1.624 25757 723 1 1 . 1 1 144 144 MET CA C 144 56.137 56.137 57.981 -1.844 25757 724 1 1 . 1 1 144 144 MET CB C 144 31.095 31.095 32.330 -1.235 25757 725 1 1 . 1 1 144 144 MET H H 144 7.179 7.179 7.156 0.023 25757 726 1 1 . 1 1 145 145 MET N N 145 115.373 115.373 112.782 2.591 25757 727 1 1 . 1 1 145 145 MET HA H 145 4.334 4.334 4.613 -0.279 25757 728 1 1 . 1 1 145 145 MET C C 145 177.217 177.217 176.338 0.879 25757 729 1 1 . 1 1 145 145 MET CA C 145 55.296 55.296 55.455 -0.159 25757 730 1 1 . 1 1 145 145 MET CB C 145 34.458 34.458 32.919 1.539 25757 731 1 1 . 1 1 145 145 MET H H 145 7.776 7.776 7.539 0.237 25757 732 1 1 . 1 1 146 146 THR N N 146 107.988 107.988 111.424 -3.436 25757 733 1 1 . 1 1 146 146 THR HA H 146 4.239 4.239 4.486 -0.247 25757 734 1 1 . 1 1 146 146 THR C C 146 175.378 175.378 175.199 0.179 25757 735 1 1 . 1 1 146 146 THR CA C 146 61.625 61.625 61.837 -0.212 25757 736 1 1 . 1 1 146 146 THR CB C 146 70.817 70.817 69.089 1.728 25757 737 1 1 . 1 1 146 146 THR H H 146 7.736 7.736 7.756 -0.020 25757 738 1 1 . 1 1 147 147 GLY N N 147 110.157 110.157 109.721 0.436 25757 739 1 1 . 1 1 147 147 GLY C C 147 174.046 174.046 173.948 0.098 25757 740 1 1 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.681 0.863 25757 741 1 1 . 1 1 147 147 GLY H H 147 7.793 7.793 7.939 -0.146 25757 742 1 1 . 1 1 150 150 THR HA H 150 4.239 4.239 4.339 -0.100 25757 743 1 1 . 1 1 150 150 THR C C 150 174.397 174.397 174.011 0.386 25757 744 1 1 . 1 1 150 150 THR CA C 150 61.260 61.260 62.978 -1.718 25757 745 1 1 . 1 1 150 150 THR CB C 150 70.358 70.358 69.438 0.920 25757 746 1 1 . 1 1 151 151 ALA N N 151 126.304 126.304 123.963 2.341 25757 747 1 1 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.668 -0.380 25757 748 1 1 . 1 1 151 151 ALA C C 151 177.678 177.678 177.286 0.392 25757 749 1 1 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.087 1.061 25757 750 1 1 . 1 1 151 151 ALA CB C 151 19.419 19.419 20.383 -0.964 25757 751 1 1 . 1 1 151 151 ALA H H 151 8.618 8.618 6.975 1.643 25757 752 1 1 . 1 1 152 152 ALA N N 152 123.861 123.861 121.280 2.581 25757 753 1 1 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.328 -0.210 25757 754 1 1 . 1 1 152 152 ALA C C 152 178.823 178.823 178.326 0.497 25757 755 1 1 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.568 1.926 25757 756 1 1 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.182 0.575 25757 757 1 1 . 1 1 152 152 ALA H H 152 8.354 8.354 8.681 -0.327 25757 758 1 1 . 1 1 153 153 GLY N N 153 109.984 109.984 107.743 2.241 25757 759 1 1 . 1 1 153 153 GLY C C 153 174.389 174.389 175.727 -1.338 25757 760 1 1 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.037 -1.906 25757 761 1 1 . 1 1 153 153 GLY H H 153 9.028 9.028 7.973 1.055 25757 762 1 1 . 1 1 154 154 SER N N 154 113.934 113.934 118.339 -4.405 25757 763 1 1 . 1 1 154 154 SER HA H 154 4.255 4.255 3.993 0.262 25757 764 1 1 . 1 1 154 154 SER C C 154 177.929 177.929 176.811 1.118 25757 765 1 1 . 1 1 154 154 SER CA C 154 59.379 59.379 62.296 -2.917 25757 766 1 1 . 1 1 154 154 SER CB C 154 64.090 64.090 62.662 1.428 25757 767 1 1 . 1 1 154 154 SER H H 154 7.962 7.962 8.127 -0.165 25757 768 1 1 . 1 1 155 155 GLY N N 155 115.337 115.337 109.127 6.210 25757 769 1 1 . 1 1 155 155 GLY C C 155 175.891 175.891 175.475 0.416 25757 770 1 1 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.732 0.914 25757 771 1 1 . 1 1 155 155 GLY H H 155 9.451 9.451 7.765 1.686 25757 772 1 1 . 1 1 156 156 TRP N N 156 119.600 119.600 122.338 -2.738 25757 773 1 1 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.282 -0.011 25757 774 1 1 . 1 1 156 156 TRP C C 156 178.947 178.947 179.107 -0.160 25757 775 1 1 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.281 -0.117 25757 776 1 1 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.051 0.552 25757 777 1 1 . 1 1 156 156 TRP H H 156 8.542 8.542 7.359 1.183 25757 778 1 1 . 1 1 157 157 ARG N N 157 118.583 118.583 119.215 -0.632 25757 779 1 1 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.096 -0.114 25757 780 1 1 . 1 1 157 157 ARG C C 157 177.894 177.894 178.205 -0.311 25757 781 1 1 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.295 0.043 25757 782 1 1 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.631 0.425 25757 783 1 1 . 1 1 157 157 ARG H H 157 7.747 7.747 8.475 -0.728 25757 784 1 1 . 1 1 158 158 LYS N N 158 117.033 117.033 120.727 -3.694 25757 785 1 1 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.999 -0.056 25757 786 1 1 . 1 1 158 158 LYS C C 158 176.973 176.973 178.835 -1.862 25757 787 1 1 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.357 0.017 25757 788 1 1 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.345 -0.054 25757 789 1 1 . 1 1 158 158 LYS H H 158 7.529 7.529 7.966 -0.437 25757 790 1 1 . 1 1 159 159 ILE N N 159 116.553 116.553 119.581 -3.028 25757 791 1 1 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.766 -0.222 25757 792 1 1 . 1 1 159 159 ILE C C 159 176.894 176.894 177.172 -0.278 25757 793 1 1 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.078 0.438 25757 794 1 1 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.005 -0.201 25757 795 1 1 . 1 1 159 159 ILE H H 159 7.348 7.348 8.187 -0.839 25757 796 1 1 . 1 1 160 160 LYS N N 160 119.278 119.278 120.626 -1.348 25757 797 1 1 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.310 -0.271 25757 798 1 1 . 1 1 160 160 LYS C C 160 178.566 178.566 179.302 -0.736 25757 799 1 1 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.983 0.390 25757 800 1 1 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.574 0.244 25757 801 1 1 . 1 1 160 160 LYS H H 160 8.225 8.225 8.057 0.168 25757 802 1 1 . 1 1 161 161 LEU N N 161 117.056 117.056 119.816 -2.760 25757 803 1 1 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.092 -0.032 25757 804 1 1 . 1 1 161 161 LEU C C 161 178.977 178.977 178.951 0.026 25757 805 1 1 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.877 0.147 25757 806 1 1 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.907 0.075 25757 807 1 1 . 1 1 161 161 LEU H H 161 8.057 8.057 8.436 -0.379 25757 808 1 1 . 1 1 162 162 ALA N N 162 121.814 121.814 122.310 -0.496 25757 809 1 1 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.406 -0.314 25757 810 1 1 . 1 1 162 162 ALA C C 162 178.374 178.374 179.902 -1.528 25757 811 1 1 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.432 0.358 25757 812 1 1 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.807 -0.482 25757 813 1 1 . 1 1 162 162 ALA H H 162 8.170 8.170 8.351 -0.181 25757 814 1 1 . 1 1 163 163 VAL N N 163 115.449 115.449 114.755 0.694 25757 815 1 1 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.891 -0.273 25757 816 1 1 . 1 1 163 163 VAL C C 163 178.362 178.362 177.609 0.753 25757 817 1 1 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.798 0.474 25757 818 1 1 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.784 0.253 25757 819 1 1 . 1 1 163 163 VAL H H 163 8.499 8.499 8.156 0.343 25757 820 1 1 . 1 1 164 164 ARG N N 164 115.775 115.775 120.729 -4.954 25757 821 1 1 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.239 -0.042 25757 822 1 1 . 1 1 164 164 ARG C C 164 178.938 178.938 178.048 0.890 25757 823 1 1 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.682 -0.999 25757 824 1 1 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.399 -0.565 25757 825 1 1 . 1 1 164 164 ARG H H 164 8.165 8.165 8.176 -0.011 25757 826 1 1 . 1 1 165 165 GLY N N 165 105.570 105.570 106.286 -0.716 25757 827 1 1 . 1 1 165 165 GLY C C 165 173.134 173.134 175.063 -1.929 25757 828 1 1 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.474 1.268 25757 829 1 1 . 1 1 165 165 GLY H H 165 8.455 8.455 8.248 0.207 25757 830 1 1 . 1 1 166 166 ALA N N 166 120.648 120.648 122.767 -2.119 25757 831 1 1 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.309 0.033 25757 832 1 1 . 1 1 166 166 ALA C C 166 176.155 176.155 177.890 -1.735 25757 833 1 1 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.156 -2.383 25757 834 1 1 . 1 1 166 166 ALA CB C 166 19.478 19.478 18.922 0.556 25757 835 1 1 . 1 1 166 166 ALA H H 166 7.826 7.826 8.095 -0.269 25757 836 1 1 . 1 1 167 167 GLN N N 167 117.315 117.315 115.630 1.685 25757 837 1 1 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.340 -0.063 25757 838 1 1 . 1 1 167 167 GLN C C 167 175.571 175.571 174.923 0.648 25757 839 1 1 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.764 1.163 25757 840 1 1 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.314 -0.129 25757 841 1 1 . 1 1 167 167 GLN H H 167 7.498 7.498 7.732 -0.234 25757 842 1 1 . 1 1 168 168 ALA N N 168 126.706 126.706 122.291 4.415 25757 843 1 1 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.388 -0.109 25757 844 1 1 . 1 1 168 168 ALA C C 168 177.227 177.227 177.404 -0.177 25757 845 1 1 . 1 1 168 168 ALA CA C 168 52.066 52.066 52.430 -0.364 25757 846 1 1 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.486 0.220 25757 847 1 1 . 1 1 168 168 ALA H H 168 8.534 8.534 8.492 0.042 25757 848 1 2 . 1 1 9 9 ILE N N 9 116.733 116.733 121.292 -4.559 25757 849 1 2 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.041 -0.284 25757 850 1 2 . 1 1 9 9 ILE C C 9 177.828 177.828 176.988 0.840 25757 851 1 2 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.027 3.577 25757 852 1 2 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.463 0.135 25757 853 1 2 . 1 1 9 9 ILE H H 9 7.366 7.366 8.139 -0.773 25757 854 1 2 . 1 1 10 10 ALA N N 10 121.080 121.080 123.770 -2.690 25757 855 1 2 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.936 0.139 25757 856 1 2 . 1 1 10 10 ALA C C 10 180.921 180.921 179.334 1.587 25757 857 1 2 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.321 0.282 25757 858 1 2 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.910 0.074 25757 859 1 2 . 1 1 10 10 ALA H H 10 8.039 8.039 8.281 -0.242 25757 860 1 2 . 1 1 11 11 GLU N N 11 119.580 119.580 118.502 1.078 25757 861 1 2 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.974 0.115 25757 862 1 2 . 1 1 11 11 GLU C C 11 179.561 179.561 178.828 0.733 25757 863 1 2 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.755 0.130 25757 864 1 2 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.141 0.322 25757 865 1 2 . 1 1 11 11 GLU H H 11 7.741 7.741 8.424 -0.683 25757 866 1 2 . 1 1 12 12 PHE N N 12 118.509 118.509 117.366 1.143 25757 867 1 2 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.261 0.565 25757 868 1 2 . 1 1 12 12 PHE C C 12 179.000 179.000 178.341 0.659 25757 869 1 2 . 1 1 12 12 PHE CA C 12 60.164 60.164 60.227 -0.063 25757 870 1 2 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.900 0.210 25757 871 1 2 . 1 1 12 12 PHE H H 12 8.470 8.470 7.331 1.139 25757 872 1 2 . 1 1 13 13 LYS N N 13 123.523 123.523 118.613 4.910 25757 873 1 2 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.053 -0.027 25757 874 1 2 . 1 1 13 13 LYS C C 13 179.260 179.260 179.489 -0.229 25757 875 1 2 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.437 0.727 25757 876 1 2 . 1 1 13 13 LYS CB C 13 31.833 31.833 31.669 0.164 25757 877 1 2 . 1 1 13 13 LYS H H 13 9.171 9.171 8.277 0.894 25757 878 1 2 . 1 1 14 14 GLU N N 14 120.415 120.415 118.975 1.440 25757 879 1 2 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.188 -0.093 25757 880 1 2 . 1 1 14 14 GLU C C 14 179.851 179.851 179.224 0.627 25757 881 1 2 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.020 0.566 25757 882 1 2 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.249 0.312 25757 883 1 2 . 1 1 14 14 GLU H H 14 7.822 7.822 8.279 -0.457 25757 884 1 2 . 1 1 15 15 ALA N N 15 122.143 122.143 122.452 -0.309 25757 885 1 2 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.229 -0.099 25757 886 1 2 . 1 1 15 15 ALA C C 15 178.222 178.222 179.839 -1.617 25757 887 1 2 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.101 0.089 25757 888 1 2 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.658 -0.156 25757 889 1 2 . 1 1 15 15 ALA H H 15 8.244 8.244 8.234 0.010 25757 890 1 2 . 1 1 16 16 PHE N N 16 119.809 119.809 118.675 1.134 25757 891 1 2 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.378 -0.366 25757 892 1 2 . 1 1 16 16 PHE C C 16 177.444 177.444 177.258 0.186 25757 893 1 2 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.134 1.930 25757 894 1 2 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.478 -0.046 25757 895 1 2 . 1 1 16 16 PHE H H 16 8.891 8.891 8.457 0.434 25757 896 1 2 . 1 1 17 17 SER N N 17 112.631 112.631 114.950 -2.319 25757 897 1 2 . 1 1 17 17 SER HA H 17 4.034 4.034 4.369 -0.335 25757 898 1 2 . 1 1 17 17 SER C C 17 174.675 174.675 176.400 -1.725 25757 899 1 2 . 1 1 17 17 SER CA C 17 61.507 61.507 60.641 0.866 25757 900 1 2 . 1 1 17 17 SER CB C 17 63.414 63.414 63.398 0.016 25757 901 1 2 . 1 1 17 17 SER H H 17 7.910 7.910 8.246 -0.336 25757 902 1 2 . 1 1 18 18 LEU N N 18 120.614 120.614 122.209 -1.595 25757 903 1 2 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.062 -0.050 25757 904 1 2 . 1 1 18 18 LEU C C 18 177.366 177.366 177.326 0.040 25757 905 1 2 . 1 1 18 18 LEU CA C 18 57.386 57.386 58.108 -0.722 25757 906 1 2 . 1 1 18 18 LEU CB C 18 41.595 41.595 42.224 -0.628 25757 907 1 2 . 1 1 18 18 LEU H H 18 7.423 7.423 7.780 -0.357 25757 908 1 2 . 1 1 19 19 PHE N N 19 114.602 114.602 115.088 -0.486 25757 909 1 2 . 1 1 19 19 PHE C C 19 176.961 176.961 176.179 0.782 25757 910 1 2 . 1 1 19 19 PHE CA C 19 59.484 59.484 58.965 0.519 25757 911 1 2 . 1 1 19 19 PHE CB C 19 40.769 40.769 40.026 0.743 25757 912 1 2 . 1 1 19 19 PHE H H 19 7.254 7.254 7.680 -0.426 25757 913 1 2 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.559 0.016 25757 914 1 2 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.490 -1.842 25757 915 1 2 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.767 -0.757 25757 916 1 2 . 1 1 23 23 GLY N N 23 108.244 108.244 109.359 -1.115 25757 917 1 2 . 1 1 23 23 GLY C C 23 175.188 175.188 174.810 0.378 25757 918 1 2 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.338 1.065 25757 919 1 2 . 1 1 23 23 GLY H H 23 7.555 7.555 8.413 -0.858 25757 920 1 2 . 1 1 24 24 ASP N N 24 120.667 120.667 119.436 1.231 25757 921 1 2 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.557 -0.088 25757 922 1 2 . 1 1 24 24 ASP C C 24 177.457 177.457 177.787 -0.330 25757 923 1 2 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.330 0.462 25757 924 1 2 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.220 -0.704 25757 925 1 2 . 1 1 24 24 ASP H H 24 8.397 8.397 7.997 0.400 25757 926 1 2 . 1 1 25 25 GLY N N 25 112.989 112.989 109.084 3.905 25757 927 1 2 . 1 1 25 25 GLY C C 25 173.639 173.639 173.691 -0.052 25757 928 1 2 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.309 0.192 25757 929 1 2 . 1 1 25 25 GLY H H 25 10.592 10.592 8.153 2.438 25757 930 1 2 . 1 1 26 26 THR N N 26 112.948 112.948 113.479 -0.531 25757 931 1 2 . 1 1 26 26 THR HA H 26 5.282 5.282 5.211 0.071 25757 932 1 2 . 1 1 26 26 THR C C 26 172.853 172.853 172.705 0.148 25757 933 1 2 . 1 1 26 26 THR CA C 26 59.817 59.817 60.895 -1.078 25757 934 1 2 . 1 1 26 26 THR CB C 26 72.465 72.465 71.260 1.205 25757 935 1 2 . 1 1 26 26 THR H H 26 8.121 8.121 8.313 -0.192 25757 936 1 2 . 1 1 27 27 ILE N N 27 127.195 127.195 122.590 4.605 25757 937 1 2 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.648 0.265 25757 938 1 2 . 1 1 27 27 ILE C C 27 176.091 176.091 175.097 0.994 25757 939 1 2 . 1 1 27 27 ILE CA C 27 60.765 60.765 59.652 1.113 25757 940 1 2 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.934 -2.229 25757 941 1 2 . 1 1 27 27 ILE H H 27 9.867 9.867 8.494 1.373 25757 942 1 2 . 1 1 28 28 THR N N 28 116.655 116.655 116.192 0.463 25757 943 1 2 . 1 1 28 28 THR HA H 28 4.790 4.790 4.844 -0.054 25757 944 1 2 . 1 1 28 28 THR C C 28 176.696 176.696 176.483 0.213 25757 945 1 2 . 1 1 28 28 THR CA C 28 59.590 59.590 59.863 -0.273 25757 946 1 2 . 1 1 28 28 THR CB C 28 72.457 72.457 71.534 0.923 25757 947 1 2 . 1 1 28 28 THR H H 28 8.457 8.457 8.028 0.429 25757 948 1 2 . 1 1 29 29 THR N N 29 111.878 111.878 115.012 -3.134 25757 949 1 2 . 1 1 29 29 THR HA H 29 4.188 4.188 3.917 0.271 25757 950 1 2 . 1 1 29 29 THR C C 29 177.399 177.399 176.604 0.795 25757 951 1 2 . 1 1 29 29 THR CA C 29 66.386 66.386 66.504 -0.118 25757 952 1 2 . 1 1 29 29 THR CB C 29 67.726 67.726 67.763 -0.037 25757 953 1 2 . 1 1 29 29 THR H H 29 9.211 9.211 8.923 0.288 25757 954 1 2 . 1 1 30 30 LYS N N 30 121.140 121.140 121.949 -0.809 25757 955 1 2 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.946 0.131 25757 956 1 2 . 1 1 30 30 LYS C C 30 179.793 179.793 178.860 0.933 25757 957 1 2 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.873 -0.581 25757 958 1 2 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.811 0.636 25757 959 1 2 . 1 1 30 30 LYS H H 30 7.580 7.580 7.623 -0.043 25757 960 1 2 . 1 1 31 31 GLU N N 31 121.865 121.865 119.377 2.488 25757 961 1 2 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.089 -0.095 25757 962 1 2 . 1 1 31 31 GLU C C 31 179.355 179.355 178.756 0.599 25757 963 1 2 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.424 0.209 25757 964 1 2 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.642 0.210 25757 965 1 2 . 1 1 31 31 GLU H H 31 7.708 7.708 7.541 0.167 25757 966 1 2 . 1 1 32 32 LEU N N 32 120.597 120.597 117.381 3.216 25757 967 1 2 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.736 0.380 25757 968 1 2 . 1 1 32 32 LEU C C 32 178.885 178.885 178.923 -0.038 25757 969 1 2 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.047 0.314 25757 970 1 2 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.650 2.386 25757 971 1 2 . 1 1 32 32 LEU H H 32 8.688 8.688 7.693 0.995 25757 972 1 2 . 1 1 33 33 GLY N N 33 104.837 104.837 107.643 -2.806 25757 973 1 2 . 1 1 33 33 GLY C C 33 175.123 175.123 175.886 -0.763 25757 974 1 2 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.564 0.683 25757 975 1 2 . 1 1 33 33 GLY H H 33 8.694 8.694 8.529 0.165 25757 976 1 2 . 1 1 34 34 THR N N 34 117.631 117.631 118.977 -1.346 25757 977 1 2 . 1 1 34 34 THR HA H 34 3.899 3.899 3.933 -0.034 25757 978 1 2 . 1 1 34 34 THR C C 34 176.951 176.951 176.610 0.341 25757 979 1 2 . 1 1 34 34 THR CA C 34 67.234 67.234 66.564 0.670 25757 980 1 2 . 1 1 34 34 THR CB C 34 68.863 68.863 68.190 0.673 25757 981 1 2 . 1 1 34 34 THR H H 34 7.960 7.960 7.896 0.064 25757 982 1 2 . 1 1 35 35 VAL N N 35 121.659 121.659 121.080 0.579 25757 983 1 2 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.481 0.036 25757 984 1 2 . 1 1 35 35 VAL C C 35 178.265 178.265 177.587 0.678 25757 985 1 2 . 1 1 35 35 VAL CA C 35 66.675 66.675 65.928 0.747 25757 986 1 2 . 1 1 35 35 VAL CB C 35 31.293 31.293 30.679 0.614 25757 987 1 2 . 1 1 35 35 VAL H H 35 7.358 7.358 7.662 -0.304 25757 988 1 2 . 1 1 36 36 MET N N 36 117.456 117.456 116.327 1.129 25757 989 1 2 . 1 1 36 36 MET C C 36 179.088 179.088 178.928 0.160 25757 990 1 2 . 1 1 36 36 MET CA C 36 60.477 60.477 59.096 1.381 25757 991 1 2 . 1 1 36 36 MET CB C 36 32.443 32.443 32.625 -0.182 25757 992 1 2 . 1 1 36 36 MET H H 36 8.194 8.194 7.917 0.277 25757 993 1 2 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.935 0.212 25757 994 1 2 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.926 0.424 25757 995 1 2 . 1 1 38 38 SER HA H 38 4.085 4.085 4.179 -0.094 25757 996 1 2 . 1 1 38 38 SER C C 38 173.788 173.788 174.776 -0.988 25757 997 1 2 . 1 1 38 38 SER CA C 38 61.617 61.617 61.261 0.356 25757 998 1 2 . 1 1 38 38 SER CB C 38 62.943 62.943 63.108 -0.165 25757 999 1 2 . 1 1 39 39 LEU N N 39 119.003 119.003 118.508 0.495 25757 1000 1 2 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.405 0.089 25757 1001 1 2 . 1 1 39 39 LEU C C 39 176.470 176.470 177.605 -1.135 25757 1002 1 2 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.110 0.569 25757 1003 1 2 . 1 1 39 39 LEU CB C 39 41.514 41.514 39.967 1.547 25757 1004 1 2 . 1 1 39 39 LEU H H 39 7.230 7.230 7.521 -0.291 25757 1005 1 2 . 1 1 40 40 GLY N N 40 105.026 105.026 107.513 -2.487 25757 1006 1 2 . 1 1 40 40 GLY C C 40 174.322 174.322 174.819 -0.497 25757 1007 1 2 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.336 0.879 25757 1008 1 2 . 1 1 40 40 GLY H H 40 7.698 7.698 8.154 -0.456 25757 1009 1 2 . 1 1 41 41 GLN N N 41 117.929 117.929 120.340 -2.411 25757 1010 1 2 . 1 1 41 41 GLN C C 41 174.557 174.557 175.036 -0.479 25757 1011 1 2 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.641 1.203 25757 1012 1 2 . 1 1 41 41 GLN H H 41 7.866 7.866 7.985 -0.119 25757 1013 1 2 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.560 0.176 25757 1014 1 2 . 1 1 43 43 PRO C C 43 177.805 177.805 176.455 1.350 25757 1015 1 2 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.902 -0.397 25757 1016 1 2 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.320 -0.158 25757 1017 1 2 . 1 1 44 44 THR N N 44 113.167 113.167 114.212 -1.045 25757 1018 1 2 . 1 1 44 44 THR HA H 44 4.684 4.684 4.625 0.059 25757 1019 1 2 . 1 1 44 44 THR C C 44 175.139 175.139 175.737 -0.598 25757 1020 1 2 . 1 1 44 44 THR CA C 44 60.556 60.556 59.330 1.226 25757 1021 1 2 . 1 1 44 44 THR CB C 44 71.064 71.064 71.362 -0.298 25757 1022 1 2 . 1 1 44 44 THR H H 44 8.798 8.798 7.769 1.029 25757 1023 1 2 . 1 1 45 45 GLU N N 45 120.673 120.673 120.280 0.393 25757 1024 1 2 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.977 0.014 25757 1025 1 2 . 1 1 45 45 GLU C C 45 178.940 178.940 178.878 0.062 25757 1026 1 2 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.670 0.230 25757 1027 1 2 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.162 -0.133 25757 1028 1 2 . 1 1 45 45 GLU H H 45 8.812 8.812 8.945 -0.133 25757 1029 1 2 . 1 1 46 46 ALA N N 46 120.576 120.576 121.547 -0.971 25757 1030 1 2 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.143 -0.176 25757 1031 1 2 . 1 1 46 46 ALA C C 46 180.290 180.290 179.785 0.505 25757 1032 1 2 . 1 1 46 46 ALA CA C 46 54.919 54.919 54.934 -0.015 25757 1033 1 2 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.041 0.120 25757 1034 1 2 . 1 1 46 46 ALA H H 46 8.276 8.276 8.322 -0.047 25757 1035 1 2 . 1 1 47 47 GLU N N 47 116.104 116.104 119.148 -3.044 25757 1036 1 2 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.036 -0.036 25757 1037 1 2 . 1 1 47 47 GLU C C 47 180.224 180.224 179.082 1.142 25757 1038 1 2 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.466 -0.535 25757 1039 1 2 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.436 0.552 25757 1040 1 2 . 1 1 47 47 GLU H H 47 7.425 7.425 7.840 -0.415 25757 1041 1 2 . 1 1 48 48 LEU N N 48 120.425 120.425 119.402 1.023 25757 1042 1 2 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.931 0.119 25757 1043 1 2 . 1 1 48 48 LEU C C 48 178.551 178.551 179.267 -0.716 25757 1044 1 2 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.131 -0.292 25757 1045 1 2 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.313 1.256 25757 1046 1 2 . 1 1 48 48 LEU H H 48 8.121 8.121 7.951 0.170 25757 1047 1 2 . 1 1 49 49 GLN N N 49 118.372 118.372 118.327 0.045 25757 1048 1 2 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.923 -0.161 25757 1049 1 2 . 1 1 49 49 GLN C C 49 178.567 178.567 178.292 0.275 25757 1050 1 2 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.786 0.077 25757 1051 1 2 . 1 1 49 49 GLN CB C 49 28.242 28.242 27.998 0.244 25757 1052 1 2 . 1 1 49 49 GLN H H 49 8.302 8.302 8.188 0.114 25757 1053 1 2 . 1 1 50 50 ASP N N 50 119.992 119.992 120.269 -0.277 25757 1054 1 2 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.353 0.007 25757 1055 1 2 . 1 1 50 50 ASP C C 50 178.600 178.600 178.450 0.150 25757 1056 1 2 . 1 1 50 50 ASP CA C 50 57.703 57.703 56.858 0.845 25757 1057 1 2 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.747 -0.280 25757 1058 1 2 . 1 1 50 50 ASP H H 50 8.150 8.150 8.206 -0.056 25757 1059 1 2 . 1 1 51 51 MET N N 51 119.238 119.238 119.239 -0.001 25757 1060 1 2 . 1 1 51 51 MET HA H 51 3.981 3.981 4.008 -0.027 25757 1061 1 2 . 1 1 51 51 MET C C 51 179.006 179.006 178.756 0.250 25757 1062 1 2 . 1 1 51 51 MET CA C 51 59.443 59.443 59.335 0.108 25757 1063 1 2 . 1 1 51 51 MET CB C 51 33.380 33.380 32.840 0.541 25757 1064 1 2 . 1 1 51 51 MET H H 51 7.844 7.844 7.924 -0.080 25757 1065 1 2 . 1 1 52 52 ILE N N 52 118.161 118.161 117.866 0.295 25757 1066 1 2 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.666 -0.188 25757 1067 1 2 . 1 1 52 52 ILE C C 52 177.847 177.847 178.777 -0.930 25757 1068 1 2 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.414 0.581 25757 1069 1 2 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.589 0.534 25757 1070 1 2 . 1 1 52 52 ILE H H 52 7.686 7.686 8.229 -0.543 25757 1071 1 2 . 1 1 53 53 ASN N N 53 117.884 117.884 117.823 0.061 25757 1072 1 2 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.479 -0.114 25757 1073 1 2 . 1 1 53 53 ASN C C 53 177.515 177.515 177.289 0.226 25757 1074 1 2 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.566 0.641 25757 1075 1 2 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.665 -0.587 25757 1076 1 2 . 1 1 53 53 ASN H H 53 8.713 8.713 8.305 0.409 25757 1077 1 2 . 1 1 54 54 GLU N N 54 116.178 116.178 117.657 -1.479 25757 1078 1 2 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.330 -0.341 25757 1079 1 2 . 1 1 54 54 GLU C C 54 177.557 177.557 176.894 0.663 25757 1080 1 2 . 1 1 54 54 GLU CA C 54 58.990 58.990 58.103 0.887 25757 1081 1 2 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.822 -0.359 25757 1082 1 2 . 1 1 54 54 GLU H H 54 7.530 7.530 8.011 -0.481 25757 1083 1 2 . 1 1 55 55 VAL N N 55 107.164 107.164 110.529 -3.365 25757 1084 1 2 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.406 0.116 25757 1085 1 2 . 1 1 55 55 VAL C C 55 175.602 175.602 173.931 1.671 25757 1086 1 2 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.081 0.271 25757 1087 1 2 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.758 0.845 25757 1088 1 2 . 1 1 55 55 VAL H H 55 7.175 7.175 7.611 -0.436 25757 1089 1 2 . 1 1 56 56 ASP N N 56 122.126 122.126 120.273 1.853 25757 1090 1 2 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.215 -0.616 25757 1091 1 2 . 1 1 56 56 ASP C C 56 176.182 176.182 175.733 0.449 25757 1092 1 2 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.580 0.226 25757 1093 1 2 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.656 -2.386 25757 1094 1 2 . 1 1 56 56 ASP H H 56 7.569 7.569 7.427 0.142 25757 1095 1 2 . 1 1 57 57 ALA N N 57 103.782 103.782 128.606 -24.824 25757 1096 1 2 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.375 -0.195 25757 1097 1 2 . 1 1 57 57 ALA C C 57 178.584 178.584 177.958 0.626 25757 1098 1 2 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.096 1.248 25757 1099 1 2 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.581 -0.057 25757 1100 1 2 . 1 1 57 57 ALA H H 57 8.515 8.515 8.533 -0.018 25757 1101 1 2 . 1 1 58 58 ASP N N 58 113.602 113.602 120.154 -6.552 25757 1102 1 2 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.546 0.040 25757 1103 1 2 . 1 1 58 58 ASP C C 58 177.756 177.756 177.251 0.505 25757 1104 1 2 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.795 -2.033 25757 1105 1 2 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.175 -1.496 25757 1106 1 2 . 1 1 58 58 ASP H H 58 8.130 8.130 8.099 0.031 25757 1107 1 2 . 1 1 59 59 GLY N N 59 109.195 109.195 107.914 1.281 25757 1108 1 2 . 1 1 59 59 GLY C C 59 175.139 175.139 174.460 0.679 25757 1109 1 2 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.107 2.157 25757 1110 1 2 . 1 1 59 59 GLY H H 59 7.694 7.694 8.730 -1.036 25757 1111 1 2 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.818 -0.213 25757 1112 1 2 . 1 1 61 61 GLY N N 61 113.316 113.316 109.637 3.679 25757 1113 1 2 . 1 1 61 61 GLY C C 61 173.234 173.234 173.117 0.117 25757 1114 1 2 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.290 -0.592 25757 1115 1 2 . 1 1 61 61 GLY H H 61 10.633 10.633 8.492 2.141 25757 1116 1 2 . 1 1 62 62 THR N N 62 108.892 108.892 109.477 -0.585 25757 1117 1 2 . 1 1 62 62 THR HA H 62 4.736 4.736 4.981 -0.245 25757 1118 1 2 . 1 1 62 62 THR C C 62 173.091 173.091 173.507 -0.416 25757 1119 1 2 . 1 1 62 62 THR CA C 62 59.617 59.617 59.656 -0.039 25757 1120 1 2 . 1 1 62 62 THR CB C 62 72.004 72.004 72.578 -0.574 25757 1121 1 2 . 1 1 62 62 THR H H 62 7.673 7.673 7.674 -0.001 25757 1122 1 2 . 1 1 63 63 ILE N N 63 123.324 123.324 124.129 -0.805 25757 1123 1 2 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.758 0.371 25757 1124 1 2 . 1 1 63 63 ILE C C 63 175.652 175.652 175.389 0.263 25757 1125 1 2 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.566 -0.081 25757 1126 1 2 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.002 -0.045 25757 1127 1 2 . 1 1 63 63 ILE H H 63 8.907 8.907 8.902 0.005 25757 1128 1 2 . 1 1 64 64 ASP N N 64 128.253 128.253 128.621 -0.368 25757 1129 1 2 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.743 0.578 25757 1130 1 2 . 1 1 64 64 ASP C C 64 176.431 176.431 177.915 -1.484 25757 1131 1 2 . 1 1 64 64 ASP CA C 64 52.331 52.331 54.557 -2.226 25757 1132 1 2 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.660 -0.607 25757 1133 1 2 . 1 1 64 64 ASP H H 64 8.864 8.864 9.173 -0.309 25757 1134 1 2 . 1 1 65 65 PHE N N 65 118.583 118.583 120.908 -2.325 25757 1135 1 2 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.553 -0.693 25757 1136 1 2 . 1 1 65 65 PHE C C 65 173.458 173.458 174.771 -1.313 25757 1137 1 2 . 1 1 65 65 PHE CA C 65 63.799 63.799 62.612 1.187 25757 1138 1 2 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.983 -1.103 25757 1139 1 2 . 1 1 65 65 PHE H H 65 8.962 8.962 8.745 0.217 25757 1140 1 2 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.616 0.502 25757 1141 1 2 . 1 1 66 66 PRO C C 66 180.038 180.038 178.625 1.413 25757 1142 1 2 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.853 1.837 25757 1143 1 2 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.878 -0.201 25757 1144 1 2 . 1 1 67 67 GLU N N 67 118.402 118.402 119.791 -1.389 25757 1145 1 2 . 1 1 67 67 GLU C C 67 178.737 178.737 178.806 -0.069 25757 1146 1 2 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.640 -0.632 25757 1147 1 2 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.096 0.589 25757 1148 1 2 . 1 1 67 67 GLU H H 67 7.953 7.953 7.953 -0.000 25757 1149 1 2 . 1 1 68 68 PHE N N 68 123.421 123.421 120.002 3.419 25757 1150 1 2 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.182 -0.210 25757 1151 1 2 . 1 1 68 68 PHE C C 68 177.184 177.184 177.608 -0.424 25757 1152 1 2 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.105 0.233 25757 1153 1 2 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.134 0.835 25757 1154 1 2 . 1 1 68 68 PHE H H 68 8.928 8.928 7.660 1.268 25757 1155 1 2 . 1 1 69 69 LEU N N 69 119.284 119.284 118.943 0.341 25757 1156 1 2 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.562 -0.227 25757 1157 1 2 . 1 1 69 69 LEU C C 69 178.987 178.987 179.272 -0.285 25757 1158 1 2 . 1 1 69 69 LEU CA C 69 57.862 57.862 57.894 -0.032 25757 1159 1 2 . 1 1 69 69 LEU CB C 69 40.832 40.832 40.091 0.741 25757 1160 1 2 . 1 1 69 69 LEU H H 69 8.374 8.374 7.505 0.869 25757 1161 1 2 . 1 1 70 70 THR N N 70 116.017 116.017 115.338 0.679 25757 1162 1 2 . 1 1 70 70 THR HA H 70 4.338 4.338 3.778 0.560 25757 1163 1 2 . 1 1 70 70 THR C C 70 176.169 176.169 176.724 -0.555 25757 1164 1 2 . 1 1 70 70 THR CA C 70 66.700 66.700 66.653 0.048 25757 1165 1 2 . 1 1 70 70 THR CB C 70 68.379 68.379 68.656 -0.277 25757 1166 1 2 . 1 1 70 70 THR H H 70 7.493 7.493 8.059 -0.566 25757 1167 1 2 . 1 1 71 71 MET N N 71 121.915 121.915 121.797 0.118 25757 1168 1 2 . 1 1 71 71 MET HA H 71 3.718 3.718 3.920 -0.202 25757 1169 1 2 . 1 1 71 71 MET C C 71 178.190 178.190 177.539 0.651 25757 1170 1 2 . 1 1 71 71 MET CA C 71 59.335 59.335 58.397 0.938 25757 1171 1 2 . 1 1 71 71 MET CB C 71 33.894 33.894 32.179 1.715 25757 1172 1 2 . 1 1 71 71 MET H H 71 7.924 7.924 7.895 0.029 25757 1173 1 2 . 1 1 72 72 MET N N 72 116.973 116.973 117.366 -0.393 25757 1174 1 2 . 1 1 72 72 MET HA H 72 3.968 3.968 3.992 -0.024 25757 1175 1 2 . 1 1 72 72 MET C C 72 178.211 178.211 178.576 -0.365 25757 1176 1 2 . 1 1 72 72 MET CA C 72 56.059 56.059 59.150 -3.091 25757 1177 1 2 . 1 1 72 72 MET CB C 72 31.639 31.639 32.409 -0.770 25757 1178 1 2 . 1 1 72 72 MET H H 72 8.276 8.276 8.015 0.261 25757 1179 1 2 . 1 1 73 73 ALA N N 73 122.499 122.499 122.295 0.204 25757 1180 1 2 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.841 0.109 25757 1181 1 2 . 1 1 73 73 ALA C C 73 180.231 180.231 179.462 0.769 25757 1182 1 2 . 1 1 73 73 ALA CA C 73 54.953 54.953 55.130 -0.177 25757 1183 1 2 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.728 0.304 25757 1184 1 2 . 1 1 73 73 ALA H H 73 8.240 8.240 8.498 -0.258 25757 1185 1 2 . 1 1 74 74 ARG N N 74 116.098 116.098 118.644 -2.546 25757 1186 1 2 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.998 -0.006 25757 1187 1 2 . 1 1 74 74 ARG C C 74 178.567 178.567 178.623 -0.056 25757 1188 1 2 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.463 0.362 25757 1189 1 2 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.640 0.436 25757 1190 1 2 . 1 1 74 74 ARG H H 74 7.420 7.420 7.988 -0.568 25757 1191 1 2 . 1 1 75 75 LYS N N 75 119.046 119.046 121.104 -2.058 25757 1192 1 2 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.098 -0.055 25757 1193 1 2 . 1 1 75 75 LYS C C 75 179.045 179.045 178.556 0.489 25757 1194 1 2 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.452 -0.563 25757 1195 1 2 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.695 0.071 25757 1196 1 2 . 1 1 75 75 LYS H H 75 7.862 7.862 8.285 -0.423 25757 1197 1 2 . 1 1 76 76 MET N N 76 116.772 116.772 119.299 -2.527 25757 1198 1 2 . 1 1 76 76 MET H H 76 8.099 8.099 8.304 -0.205 25757 1199 1 2 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.830 -0.196 25757 1200 1 2 . 1 1 78 78 ASP C C 78 176.395 176.395 175.317 1.078 25757 1201 1 2 . 1 1 78 78 ASP CA C 78 54.644 54.644 53.397 1.247 25757 1202 1 2 . 1 1 78 78 ASP CB C 78 41.474 41.474 42.048 -0.575 25757 1203 1 2 . 1 1 79 79 THR N N 79 113.904 113.904 114.586 -0.682 25757 1204 1 2 . 1 1 79 79 THR HA H 79 4.215 4.215 4.213 0.002 25757 1205 1 2 . 1 1 79 79 THR C C 79 174.204 174.204 174.572 -0.368 25757 1206 1 2 . 1 1 79 79 THR CA C 79 62.264 62.264 63.177 -0.913 25757 1207 1 2 . 1 1 79 79 THR CB C 79 69.884 69.884 69.424 0.460 25757 1208 1 2 . 1 1 79 79 THR H H 79 8.039 8.039 8.536 -0.497 25757 1209 1 2 . 1 1 80 80 ASP N N 80 123.572 123.572 121.837 1.735 25757 1210 1 2 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.580 0.140 25757 1211 1 2 . 1 1 80 80 ASP C C 80 176.221 176.221 176.534 -0.313 25757 1212 1 2 . 1 1 80 80 ASP CA C 80 54.315 54.315 55.428 -1.113 25757 1213 1 2 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.486 0.941 25757 1214 1 2 . 1 1 80 80 ASP H H 80 8.441 8.441 8.038 0.403 25757 1215 1 2 . 1 1 81 81 SER N N 81 117.879 117.879 118.799 -0.920 25757 1216 1 2 . 1 1 81 81 SER HA H 81 3.925 3.925 4.483 -0.558 25757 1217 1 2 . 1 1 81 81 SER C C 81 175.264 175.264 175.947 -0.683 25757 1218 1 2 . 1 1 81 81 SER CA C 81 58.860 58.860 59.221 -0.361 25757 1219 1 2 . 1 1 81 81 SER CB C 81 63.790 63.790 64.406 -0.616 25757 1220 1 2 . 1 1 81 81 SER H H 81 8.503 8.503 8.272 0.231 25757 1221 1 2 . 1 1 82 82 GLU N N 82 123.206 123.206 123.599 -0.393 25757 1222 1 2 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.017 0.041 25757 1223 1 2 . 1 1 82 82 GLU C C 82 178.378 178.378 178.621 -0.243 25757 1224 1 2 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.930 -0.344 25757 1225 1 2 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.044 0.559 25757 1226 1 2 . 1 1 82 82 GLU H H 82 8.563 8.563 8.985 -0.422 25757 1227 1 2 . 1 1 83 83 GLU N N 83 119.262 119.262 118.463 0.799 25757 1228 1 2 . 1 1 83 83 GLU HA H 83 3.957 3.957 4.008 -0.051 25757 1229 1 2 . 1 1 83 83 GLU C C 83 178.606 178.606 178.591 0.015 25757 1230 1 2 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.882 -0.213 25757 1231 1 2 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.138 0.217 25757 1232 1 2 . 1 1 83 83 GLU H H 83 7.728 7.728 8.670 -0.942 25757 1233 1 2 . 1 1 84 84 GLU N N 84 118.432 118.432 119.954 -1.522 25757 1234 1 2 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.048 0.059 25757 1235 1 2 . 1 1 84 84 GLU C C 84 179.436 179.436 178.977 0.459 25757 1236 1 2 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.201 0.302 25757 1237 1 2 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.569 -0.462 25757 1238 1 2 . 1 1 84 84 GLU H H 84 8.346 8.346 8.084 0.262 25757 1239 1 2 . 1 1 85 85 ILE N N 85 120.925 120.925 120.342 0.583 25757 1240 1 2 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.789 -0.041 25757 1241 1 2 . 1 1 85 85 ILE C C 85 177.661 177.661 178.270 -0.609 25757 1242 1 2 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.594 -0.104 25757 1243 1 2 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.829 -0.398 25757 1244 1 2 . 1 1 85 85 ILE H H 85 7.821 7.821 8.213 -0.392 25757 1245 1 2 . 1 1 86 86 ARG N N 86 121.916 121.916 118.939 2.977 25757 1246 1 2 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.769 0.367 25757 1247 1 2 . 1 1 86 86 ARG C C 86 179.208 179.208 178.960 0.248 25757 1248 1 2 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.652 0.719 25757 1249 1 2 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.831 0.267 25757 1250 1 2 . 1 1 86 86 ARG H H 86 8.432 8.432 8.266 0.166 25757 1251 1 2 . 1 1 87 87 GLU N N 87 118.261 118.261 118.549 -0.288 25757 1252 1 2 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.908 0.204 25757 1253 1 2 . 1 1 87 87 GLU C C 87 178.516 178.516 178.644 -0.128 25757 1254 1 2 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.341 -0.316 25757 1255 1 2 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.283 -0.113 25757 1256 1 2 . 1 1 87 87 GLU H H 87 8.225 8.225 8.287 -0.062 25757 1257 1 2 . 1 1 88 88 ALA N N 88 121.009 121.009 122.649 -1.640 25757 1258 1 2 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.465 0.362 25757 1259 1 2 . 1 1 88 88 ALA C C 88 177.947 177.947 178.144 -0.197 25757 1260 1 2 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.845 0.016 25757 1261 1 2 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.256 -0.301 25757 1262 1 2 . 1 1 88 88 ALA H H 88 7.789 7.789 8.018 -0.229 25757 1263 1 2 . 1 1 89 89 PHE N N 89 117.164 117.164 118.398 -1.234 25757 1264 1 2 . 1 1 89 89 PHE C C 89 176.134 176.134 177.384 -1.250 25757 1265 1 2 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.592 2.058 25757 1266 1 2 . 1 1 89 89 PHE CB C 89 38.893 38.893 39.030 -0.137 25757 1267 1 2 . 1 1 89 89 PHE H H 89 8.337 8.337 7.457 0.880 25757 1268 1 2 . 1 1 90 90 ARG N N 90 114.900 114.900 117.467 -2.567 25757 1269 1 2 . 1 1 90 90 ARG HA H 90 3.914 3.914 4.071 -0.157 25757 1270 1 2 . 1 1 90 90 ARG C C 90 178.296 178.296 177.570 0.726 25757 1271 1 2 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.785 1.294 25757 1272 1 2 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.254 -0.161 25757 1273 1 2 . 1 1 90 90 ARG H H 90 7.681 7.681 7.814 -0.133 25757 1274 1 2 . 1 1 91 91 VAL N N 91 116.927 116.927 115.544 1.383 25757 1275 1 2 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.938 -0.331 25757 1276 1 2 . 1 1 91 91 VAL C C 91 177.964 177.964 177.171 0.793 25757 1277 1 2 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.706 1.254 25757 1278 1 2 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.181 0.438 25757 1279 1 2 . 1 1 91 91 VAL H H 91 7.405 7.405 7.566 -0.161 25757 1280 1 2 . 1 1 92 92 PHE N N 92 119.026 119.026 116.870 2.156 25757 1281 1 2 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.333 0.029 25757 1282 1 2 . 1 1 92 92 PHE C C 92 177.639 177.639 175.789 1.850 25757 1283 1 2 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.294 -0.573 25757 1284 1 2 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.816 -0.390 25757 1285 1 2 . 1 1 92 92 PHE H H 92 7.886 7.886 7.477 0.409 25757 1286 1 2 . 1 1 93 93 ASP N N 93 118.238 118.238 118.706 -0.468 25757 1287 1 2 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.997 -0.535 25757 1288 1 2 . 1 1 93 93 ASP C C 93 176.979 176.979 176.458 0.521 25757 1289 1 2 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.681 -0.533 25757 1290 1 2 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.190 -2.041 25757 1291 1 2 . 1 1 93 93 ASP H H 93 8.009 8.009 7.490 0.519 25757 1292 1 2 . 1 1 94 94 LYS N N 94 125.792 125.792 125.117 0.675 25757 1293 1 2 . 1 1 94 94 LYS C C 94 178.213 178.213 177.875 0.338 25757 1294 1 2 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.885 0.433 25757 1295 1 2 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.534 -1.506 25757 1296 1 2 . 1 1 94 94 LYS H H 94 7.428 7.428 8.100 -0.672 25757 1297 1 2 . 1 1 95 95 ASP N N 95 113.833 113.833 115.749 -1.916 25757 1298 1 2 . 1 1 95 95 ASP C C 95 177.718 177.718 177.465 0.253 25757 1299 1 2 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.139 -1.194 25757 1300 1 2 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.477 -0.734 25757 1301 1 2 . 1 1 95 95 ASP H H 95 8.159 8.159 7.940 0.219 25757 1302 1 2 . 1 1 96 96 GLY N N 96 109.414 109.414 108.054 1.360 25757 1303 1 2 . 1 1 96 96 GLY C C 96 175.093 175.093 175.228 -0.135 25757 1304 1 2 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.794 1.460 25757 1305 1 2 . 1 1 96 96 GLY H H 96 7.848 7.848 8.153 -0.305 25757 1306 1 2 . 1 1 97 97 ASN N N 97 119.590 119.590 118.030 1.560 25757 1307 1 2 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.554 0.058 25757 1308 1 2 . 1 1 97 97 ASN C C 97 175.937 175.937 176.677 -0.740 25757 1309 1 2 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.436 -0.548 25757 1310 1 2 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.285 -0.965 25757 1311 1 2 . 1 1 97 97 ASN H H 97 8.338 8.338 8.655 -0.317 25757 1312 1 2 . 1 1 98 98 GLY N N 98 112.940 112.940 107.565 5.375 25757 1313 1 2 . 1 1 98 98 GLY C C 98 172.429 172.429 172.693 -0.264 25757 1314 1 2 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.009 0.083 25757 1315 1 2 . 1 1 98 98 GLY H H 98 10.695 10.695 8.737 1.958 25757 1316 1 2 . 1 1 99 99 TYR N N 99 115.544 115.544 118.197 -2.653 25757 1317 1 2 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.337 -0.250 25757 1318 1 2 . 1 1 99 99 TYR C C 99 174.859 174.859 174.750 0.109 25757 1319 1 2 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.362 -1.344 25757 1320 1 2 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.089 1.264 25757 1321 1 2 . 1 1 99 99 TYR H H 99 7.597 7.597 8.439 -0.842 25757 1322 1 2 . 1 1 100 100 ILE N N 100 127.078 127.078 125.716 1.362 25757 1323 1 2 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.619 0.170 25757 1324 1 2 . 1 1 100 100 ILE C C 100 175.387 175.387 176.059 -0.672 25757 1325 1 2 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.225 -0.219 25757 1326 1 2 . 1 1 100 100 ILE CB C 100 38.790 38.790 38.817 -0.027 25757 1327 1 2 . 1 1 100 100 ILE H H 100 10.267 10.267 9.391 0.876 25757 1328 1 2 . 1 1 101 101 SER N N 101 124.102 124.102 123.592 0.510 25757 1329 1 2 . 1 1 101 101 SER HA H 101 4.417 4.417 5.114 -0.697 25757 1330 1 2 . 1 1 101 101 SER C C 101 175.360 175.360 175.223 0.137 25757 1331 1 2 . 1 1 101 101 SER CA C 101 56.036 56.036 56.899 -0.863 25757 1332 1 2 . 1 1 101 101 SER CB C 101 66.896 66.896 65.198 1.698 25757 1333 1 2 . 1 1 101 101 SER H H 101 8.985 8.985 8.310 0.675 25757 1334 1 2 . 1 1 102 102 ALA N N 102 122.780 122.780 124.064 -1.284 25757 1335 1 2 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.973 -0.229 25757 1336 1 2 . 1 1 102 102 ALA C C 102 179.175 179.175 178.611 0.564 25757 1337 1 2 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.496 0.794 25757 1338 1 2 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.267 -0.240 25757 1339 1 2 . 1 1 102 102 ALA H H 102 9.269 9.269 9.113 0.156 25757 1340 1 2 . 1 1 103 103 ALA N N 103 118.513 118.513 121.258 -2.745 25757 1341 1 2 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.961 0.050 25757 1342 1 2 . 1 1 103 103 ALA C C 103 181.521 181.521 179.342 2.179 25757 1343 1 2 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.291 0.063 25757 1344 1 2 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.276 0.015 25757 1345 1 2 . 1 1 103 103 ALA H H 103 8.321 8.321 8.357 -0.036 25757 1346 1 2 . 1 1 104 104 GLU N N 104 119.550 119.550 119.481 0.069 25757 1347 1 2 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.001 0.005 25757 1348 1 2 . 1 1 104 104 GLU C C 104 179.750 179.750 179.294 0.456 25757 1349 1 2 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.899 -0.730 25757 1350 1 2 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.269 -0.054 25757 1351 1 2 . 1 1 104 104 GLU H H 104 7.867 7.867 8.374 -0.507 25757 1352 1 2 . 1 1 105 105 LEU N N 105 122.688 122.688 119.904 2.784 25757 1353 1 2 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.857 0.061 25757 1354 1 2 . 1 1 105 105 LEU C C 105 178.233 178.233 178.704 -0.471 25757 1355 1 2 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.132 -0.398 25757 1356 1 2 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.631 0.389 25757 1357 1 2 . 1 1 105 105 LEU H H 105 8.746 8.746 7.769 0.977 25757 1358 1 2 . 1 1 106 106 ARG N N 106 118.835 118.835 118.278 0.557 25757 1359 1 2 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.795 -0.144 25757 1360 1 2 . 1 1 106 106 ARG C C 106 178.742 178.742 178.833 -0.091 25757 1361 1 2 . 1 1 106 106 ARG CA C 106 59.963 59.963 60.201 -0.238 25757 1362 1 2 . 1 1 106 106 ARG CB C 106 30.046 30.046 30.009 0.037 25757 1363 1 2 . 1 1 106 106 ARG H H 106 8.684 8.684 8.282 0.402 25757 1364 1 2 . 1 1 107 107 HIS N N 107 119.258 119.258 119.149 0.109 25757 1365 1 2 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.298 -0.031 25757 1366 1 2 . 1 1 107 107 HIS C C 107 177.244 177.244 177.891 -0.647 25757 1367 1 2 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.925 1.227 25757 1368 1 2 . 1 1 107 107 HIS CB C 107 30.575 30.575 30.278 0.297 25757 1369 1 2 . 1 1 107 107 HIS H H 107 7.691 7.691 8.214 -0.523 25757 1370 1 2 . 1 1 108 108 VAL N N 108 118.996 118.996 120.488 -1.492 25757 1371 1 2 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.706 -0.268 25757 1372 1 2 . 1 1 108 108 VAL C C 108 177.998 177.998 178.506 -0.508 25757 1373 1 2 . 1 1 108 108 VAL CA C 108 66.431 66.431 67.099 -0.668 25757 1374 1 2 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.602 -0.178 25757 1375 1 2 . 1 1 108 108 VAL H H 108 7.599 7.599 8.272 -0.673 25757 1376 1 2 . 1 1 109 109 MET N N 109 114.880 114.880 116.291 -1.411 25757 1377 1 2 . 1 1 109 109 MET C C 109 179.119 179.119 178.830 0.289 25757 1378 1 2 . 1 1 109 109 MET CA C 109 56.979 56.979 58.221 -1.242 25757 1379 1 2 . 1 1 109 109 MET CB C 109 29.253 29.253 32.174 -2.921 25757 1380 1 2 . 1 1 109 109 MET H H 109 7.911 7.911 8.315 -0.404 25757 1381 1 2 . 1 1 110 110 THR N N 110 116.943 116.943 116.718 0.225 25757 1382 1 2 . 1 1 110 110 THR HA H 110 4.229 4.229 4.116 0.113 25757 1383 1 2 . 1 1 110 110 THR C C 110 178.506 178.506 176.039 2.467 25757 1384 1 2 . 1 1 110 110 THR CA C 110 66.573 66.573 66.683 -0.110 25757 1385 1 2 . 1 1 110 110 THR CB C 110 68.575 68.575 68.616 -0.041 25757 1386 1 2 . 1 1 110 110 THR H H 110 8.353 8.353 8.156 0.197 25757 1387 1 2 . 1 1 111 111 ASN N N 111 123.829 123.829 119.975 3.854 25757 1388 1 2 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.384 -0.022 25757 1389 1 2 . 1 1 111 111 ASN C C 111 177.197 177.197 177.393 -0.196 25757 1390 1 2 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.936 0.023 25757 1391 1 2 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.427 -1.204 25757 1392 1 2 . 1 1 111 111 ASN H H 111 8.053 8.053 8.296 -0.243 25757 1393 1 2 . 1 1 112 112 LEU N N 112 119.036 119.036 116.521 2.515 25757 1394 1 2 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.353 -0.183 25757 1395 1 2 . 1 1 112 112 LEU C C 112 176.377 176.377 178.215 -1.838 25757 1396 1 2 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.974 -1.468 25757 1397 1 2 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.933 -0.573 25757 1398 1 2 . 1 1 112 112 LEU H H 112 7.794 7.794 7.794 0.000 25757 1399 1 2 . 1 1 113 113 GLY N N 113 106.045 106.045 105.210 0.835 25757 1400 1 2 . 1 1 113 113 GLY C C 113 174.248 174.248 174.700 -0.452 25757 1401 1 2 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.634 0.673 25757 1402 1 2 . 1 1 113 113 GLY H H 113 7.741 7.741 7.724 0.017 25757 1403 1 2 . 1 1 114 114 GLU N N 114 120.556 120.556 121.728 -1.172 25757 1404 1 2 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.118 0.192 25757 1405 1 2 . 1 1 114 114 GLU C C 114 174.993 174.993 176.115 -1.122 25757 1406 1 2 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.606 -1.969 25757 1407 1 2 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.714 1.503 25757 1408 1 2 . 1 1 114 114 GLU H H 114 7.980 7.980 8.094 -0.114 25757 1409 1 2 . 1 1 115 115 LYS N N 115 124.986 124.986 126.306 -1.320 25757 1410 1 2 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.184 0.150 25757 1411 1 2 . 1 1 115 115 LYS C C 115 175.285 175.285 175.587 -0.302 25757 1412 1 2 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.819 -1.238 25757 1413 1 2 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.602 -0.629 25757 1414 1 2 . 1 1 115 115 LYS H H 115 8.613 8.613 8.282 0.331 25757 1415 1 2 . 1 1 116 116 LEU N N 116 125.243 125.243 126.830 -1.587 25757 1416 1 2 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.828 -0.140 25757 1417 1 2 . 1 1 116 116 LEU C C 116 178.365 178.365 176.560 1.805 25757 1418 1 2 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.096 0.252 25757 1419 1 2 . 1 1 116 116 LEU CB C 116 44.289 44.289 45.574 -1.285 25757 1420 1 2 . 1 1 116 116 LEU H H 116 8.066 8.066 8.208 -0.142 25757 1421 1 2 . 1 1 117 117 THR N N 117 114.324 114.324 115.810 -1.486 25757 1422 1 2 . 1 1 117 117 THR HA H 117 4.713 4.713 4.626 0.087 25757 1423 1 2 . 1 1 117 117 THR C C 117 175.539 175.539 174.138 1.401 25757 1424 1 2 . 1 1 117 117 THR CA C 117 60.756 60.756 60.145 0.611 25757 1425 1 2 . 1 1 117 117 THR CB C 117 71.144 71.144 71.065 0.079 25757 1426 1 2 . 1 1 117 117 THR H H 117 9.228 9.228 8.119 1.109 25757 1427 1 2 . 1 1 118 118 ASP N N 118 121.016 121.016 121.221 -0.205 25757 1428 1 2 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.222 -0.067 25757 1429 1 2 . 1 1 118 118 ASP H H 118 8.919 8.919 8.782 0.137 25757 1430 1 2 . 1 1 119 119 GLU N N 119 121.016 121.016 117.931 3.085 25757 1431 1 2 . 1 1 119 119 GLU C C 119 179.204 179.204 179.005 0.199 25757 1432 1 2 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.467 -1.397 25757 1433 1 2 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.072 -0.028 25757 1434 1 2 . 1 1 119 119 GLU H H 119 8.919 8.919 8.922 -0.003 25757 1435 1 2 . 1 1 120 120 GLU N N 120 120.566 120.566 120.234 0.332 25757 1436 1 2 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.968 0.033 25757 1437 1 2 . 1 1 120 120 GLU C C 120 180.329 180.329 178.887 1.442 25757 1438 1 2 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.276 -0.185 25757 1439 1 2 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.519 1.119 25757 1440 1 2 . 1 1 120 120 GLU H H 120 7.732 7.732 7.689 0.043 25757 1441 1 2 . 1 1 121 121 VAL N N 121 121.875 121.875 119.394 2.481 25757 1442 1 2 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.587 -0.122 25757 1443 1 2 . 1 1 121 121 VAL C C 121 177.477 177.477 178.425 -0.948 25757 1444 1 2 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.589 0.582 25757 1445 1 2 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.131 0.303 25757 1446 1 2 . 1 1 121 121 VAL H H 121 8.104 8.104 7.482 0.622 25757 1447 1 2 . 1 1 122 122 ASP N N 122 120.566 120.566 119.136 1.430 25757 1448 1 2 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.372 -0.037 25757 1449 1 2 . 1 1 122 122 ASP C C 122 179.298 179.298 178.833 0.465 25757 1450 1 2 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.548 0.291 25757 1451 1 2 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.259 0.053 25757 1452 1 2 . 1 1 122 122 ASP H H 122 8.089 8.089 8.260 -0.171 25757 1453 1 2 . 1 1 123 123 GLU N N 123 119.821 119.821 120.854 -1.033 25757 1454 1 2 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.052 -0.003 25757 1455 1 2 . 1 1 123 123 GLU C C 123 178.749 178.749 178.727 0.022 25757 1456 1 2 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.480 -0.162 25757 1457 1 2 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.757 -0.371 25757 1458 1 2 . 1 1 123 123 GLU H H 123 8.105 8.105 7.885 0.220 25757 1459 1 2 . 1 1 124 124 MET N N 124 119.288 119.288 118.049 1.239 25757 1460 1 2 . 1 1 124 124 MET C C 124 180.865 180.865 179.029 1.836 25757 1461 1 2 . 1 1 124 124 MET CA C 124 60.684 60.684 59.052 1.632 25757 1462 1 2 . 1 1 124 124 MET CB C 124 33.141 33.141 32.036 1.105 25757 1463 1 2 . 1 1 124 124 MET H H 124 7.726 7.726 8.136 -0.410 25757 1464 1 2 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.032 -0.303 25757 1465 1 2 . 1 1 125 125 ILE C C 125 177.341 177.341 177.925 -0.584 25757 1466 1 2 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.326 0.475 25757 1467 1 2 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.998 -1.433 25757 1468 1 2 . 1 1 126 126 ARG N N 126 118.555 118.555 119.536 -0.981 25757 1469 1 2 . 1 1 126 126 ARG C C 126 179.164 179.164 178.130 1.034 25757 1470 1 2 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.311 0.613 25757 1471 1 2 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.248 -0.383 25757 1472 1 2 . 1 1 126 126 ARG H H 126 8.380 8.380 7.963 0.417 25757 1473 1 2 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.358 -0.433 25757 1474 1 2 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.678 1.379 25757 1475 1 2 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.301 0.527 25757 1476 1 2 . 1 1 128 128 ALA N N 128 116.764 116.764 119.628 -2.864 25757 1477 1 2 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.259 0.158 25757 1478 1 2 . 1 1 128 128 ALA C C 128 177.885 177.885 176.482 1.403 25757 1479 1 2 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.533 -0.578 25757 1480 1 2 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.810 2.757 25757 1481 1 2 . 1 1 128 128 ALA H H 128 7.152 7.152 7.727 -0.575 25757 1482 1 2 . 1 1 129 129 ASP N N 129 117.762 117.762 117.564 0.198 25757 1483 1 2 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.258 -0.781 25757 1484 1 2 . 1 1 129 129 ASP C C 129 175.935 175.935 176.650 -0.715 25757 1485 1 2 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.082 2.433 25757 1486 1 2 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.921 -1.176 25757 1487 1 2 . 1 1 129 129 ASP H H 129 8.007 8.007 7.708 0.299 25757 1488 1 2 . 1 1 130 130 ILE N N 130 128.249 128.249 124.627 3.622 25757 1489 1 2 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.830 0.034 25757 1490 1 2 . 1 1 130 130 ILE C C 130 177.764 177.764 177.397 0.367 25757 1491 1 2 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.902 -0.354 25757 1492 1 2 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.349 0.299 25757 1493 1 2 . 1 1 130 130 ILE H H 130 8.412 8.412 7.917 0.495 25757 1494 1 2 . 1 1 131 131 ASP N N 131 116.430 116.430 116.536 -0.106 25757 1495 1 2 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.608 -0.074 25757 1496 1 2 . 1 1 131 131 ASP C C 131 178.313 178.313 177.159 1.154 25757 1497 1 2 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.896 -1.012 25757 1498 1 2 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.955 -0.993 25757 1499 1 2 . 1 1 131 131 ASP H H 131 8.254 8.254 8.317 -0.063 25757 1500 1 2 . 1 1 132 132 GLY N N 132 108.460 108.460 109.007 -0.547 25757 1501 1 2 . 1 1 132 132 GLY C C 132 175.211 175.211 174.727 0.484 25757 1502 1 2 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.141 1.462 25757 1503 1 2 . 1 1 132 132 GLY H H 132 7.547 7.547 7.914 -0.367 25757 1504 1 2 . 1 1 133 133 ASP N N 133 120.909 120.909 119.456 1.453 25757 1505 1 2 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.560 -0.097 25757 1506 1 2 . 1 1 133 133 ASP C C 133 177.691 177.691 177.713 -0.022 25757 1507 1 2 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.707 1.107 25757 1508 1 2 . 1 1 133 133 ASP CB C 133 40.298 40.298 39.973 0.325 25757 1509 1 2 . 1 1 133 133 ASP H H 133 8.339 8.339 8.352 -0.013 25757 1510 1 2 . 1 1 134 134 GLY N N 134 112.704 112.704 107.748 4.956 25757 1511 1 2 . 1 1 134 134 GLY C C 134 172.722 172.722 173.685 -0.963 25757 1512 1 2 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.520 0.517 25757 1513 1 2 . 1 1 134 134 GLY H H 134 10.396 10.396 7.908 2.488 25757 1514 1 2 . 1 1 135 135 GLN N N 135 114.799 114.799 118.386 -3.587 25757 1515 1 2 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.101 -0.237 25757 1516 1 2 . 1 1 135 135 GLN C C 135 174.760 174.760 174.912 -0.152 25757 1517 1 2 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.735 -1.414 25757 1518 1 2 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.065 -1.000 25757 1519 1 2 . 1 1 135 135 GLN H H 135 7.975 7.975 8.690 -0.715 25757 1520 1 2 . 1 1 136 136 VAL N N 136 125.364 125.364 125.136 0.228 25757 1521 1 2 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.638 0.570 25757 1522 1 2 . 1 1 136 136 VAL C C 136 175.831 175.831 175.492 0.339 25757 1523 1 2 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.635 0.182 25757 1524 1 2 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.058 0.616 25757 1525 1 2 . 1 1 136 136 VAL H H 136 9.169 9.169 9.255 -0.086 25757 1526 1 2 . 1 1 137 137 ASN N N 137 129.155 129.155 123.977 5.178 25757 1527 1 2 . 1 1 137 137 ASN C C 137 174.737 174.737 175.630 -0.893 25757 1528 1 2 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.568 0.783 25757 1529 1 2 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.304 -2.981 25757 1530 1 2 . 1 1 137 137 ASN H H 137 9.652 9.652 8.439 1.213 25757 1531 1 2 . 1 1 138 138 TYR N N 138 118.504 118.504 122.396 -3.892 25757 1532 1 2 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.608 -0.329 25757 1533 1 2 . 1 1 138 138 TYR C C 138 176.174 176.174 176.860 -0.686 25757 1534 1 2 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.476 1.098 25757 1535 1 2 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.085 -0.355 25757 1536 1 2 . 1 1 138 138 TYR H H 138 8.460 8.460 8.623 -0.163 25757 1537 1 2 . 1 1 139 139 GLU N N 139 118.644 118.644 117.176 1.468 25757 1538 1 2 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.696 -0.148 25757 1539 1 2 . 1 1 139 139 GLU C C 139 180.265 180.265 178.574 1.691 25757 1540 1 2 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.826 0.660 25757 1541 1 2 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.474 0.517 25757 1542 1 2 . 1 1 139 139 GLU H H 139 8.136 8.136 8.772 -0.636 25757 1543 1 2 . 1 1 140 140 GLU N N 140 120.030 120.030 117.343 2.687 25757 1544 1 2 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.073 -0.185 25757 1545 1 2 . 1 1 140 140 GLU C C 140 179.627 179.627 177.943 1.684 25757 1546 1 2 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.959 0.718 25757 1547 1 2 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.337 0.390 25757 1548 1 2 . 1 1 140 140 GLU H H 140 8.798 8.798 8.450 0.348 25757 1549 1 2 . 1 1 141 141 PHE N N 141 123.154 123.154 121.234 1.920 25757 1550 1 2 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.986 -0.289 25757 1551 1 2 . 1 1 141 141 PHE C C 141 176.952 176.952 177.895 -0.943 25757 1552 1 2 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.641 1.411 25757 1553 1 2 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.700 0.431 25757 1554 1 2 . 1 1 141 141 PHE H H 141 8.633 8.633 7.810 0.823 25757 1555 1 2 . 1 1 142 142 VAL N N 142 120.046 120.046 117.399 2.647 25757 1556 1 2 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.601 -0.645 25757 1557 1 2 . 1 1 142 142 VAL C C 142 179.627 179.627 177.300 2.327 25757 1558 1 2 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.413 1.830 25757 1559 1 2 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.035 0.105 25757 1560 1 2 . 1 1 142 142 VAL H H 142 8.894 8.894 8.167 0.727 25757 1561 1 2 . 1 1 143 143 GLN N N 143 118.996 118.996 119.991 -0.995 25757 1562 1 2 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.969 -0.193 25757 1563 1 2 . 1 1 143 143 GLN C C 143 178.443 178.443 177.756 0.687 25757 1564 1 2 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.168 0.961 25757 1565 1 2 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.161 -0.418 25757 1566 1 2 . 1 1 143 143 GLN H H 143 7.627 7.627 7.709 -0.082 25757 1567 1 2 . 1 1 144 144 MET N N 144 116.361 116.361 118.014 -1.653 25757 1568 1 2 . 1 1 144 144 MET HA H 144 4.169 4.169 4.084 0.085 25757 1569 1 2 . 1 1 144 144 MET C C 144 178.418 178.418 176.961 1.457 25757 1570 1 2 . 1 1 144 144 MET CA C 144 56.137 56.137 57.695 -1.558 25757 1571 1 2 . 1 1 144 144 MET CB C 144 31.095 31.095 32.435 -1.340 25757 1572 1 2 . 1 1 144 144 MET H H 144 7.179 7.179 7.205 -0.026 25757 1573 1 2 . 1 1 145 145 MET N N 145 115.373 115.373 116.837 -1.464 25757 1574 1 2 . 1 1 145 145 MET HA H 145 4.334 4.334 4.542 -0.208 25757 1575 1 2 . 1 1 145 145 MET C C 145 177.217 177.217 175.666 1.551 25757 1576 1 2 . 1 1 145 145 MET CA C 145 55.296 55.296 55.246 0.050 25757 1577 1 2 . 1 1 145 145 MET CB C 145 34.458 34.458 34.111 0.347 25757 1578 1 2 . 1 1 145 145 MET H H 145 7.776 7.776 7.622 0.154 25757 1579 1 2 . 1 1 146 146 THR N N 146 107.988 107.988 112.956 -4.968 25757 1580 1 2 . 1 1 146 146 THR HA H 146 4.239 4.239 4.427 -0.188 25757 1581 1 2 . 1 1 146 146 THR C C 146 175.378 175.378 174.871 0.507 25757 1582 1 2 . 1 1 146 146 THR CA C 146 61.625 61.625 61.671 -0.046 25757 1583 1 2 . 1 1 146 146 THR CB C 146 70.817 70.817 68.332 2.485 25757 1584 1 2 . 1 1 146 146 THR H H 146 7.736 7.736 7.721 0.015 25757 1585 1 2 . 1 1 147 147 GLY N N 147 110.157 110.157 110.209 -0.052 25757 1586 1 2 . 1 1 147 147 GLY C C 147 174.046 174.046 174.126 -0.080 25757 1587 1 2 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.749 0.795 25757 1588 1 2 . 1 1 147 147 GLY H H 147 7.793 7.793 8.153 -0.360 25757 1589 1 2 . 1 1 150 150 THR HA H 150 4.239 4.239 4.506 -0.267 25757 1590 1 2 . 1 1 150 150 THR C C 150 174.397 174.397 173.700 0.697 25757 1591 1 2 . 1 1 150 150 THR CA C 150 61.260 61.260 61.250 0.010 25757 1592 1 2 . 1 1 150 150 THR CB C 150 70.358 70.358 68.733 1.625 25757 1593 1 2 . 1 1 151 151 ALA N N 151 126.304 126.304 125.093 1.211 25757 1594 1 2 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.668 -0.380 25757 1595 1 2 . 1 1 151 151 ALA C C 151 177.678 177.678 176.491 1.187 25757 1596 1 2 . 1 1 151 151 ALA CA C 151 52.148 52.148 50.243 1.905 25757 1597 1 2 . 1 1 151 151 ALA CB C 151 19.419 19.419 21.042 -1.623 25757 1598 1 2 . 1 1 151 151 ALA H H 151 8.618 8.618 7.610 1.008 25757 1599 1 2 . 1 1 152 152 ALA N N 152 123.861 123.861 122.064 1.797 25757 1600 1 2 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.401 -0.283 25757 1601 1 2 . 1 1 152 152 ALA C C 152 178.823 178.823 178.390 0.433 25757 1602 1 2 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.623 1.871 25757 1603 1 2 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.291 0.466 25757 1604 1 2 . 1 1 152 152 ALA H H 152 8.354 8.354 8.698 -0.344 25757 1605 1 2 . 1 1 153 153 GLY N N 153 109.984 109.984 107.889 2.095 25757 1606 1 2 . 1 1 153 153 GLY C C 153 174.389 174.389 175.762 -1.373 25757 1607 1 2 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.150 -2.019 25757 1608 1 2 . 1 1 153 153 GLY H H 153 9.028 9.028 8.491 0.537 25757 1609 1 2 . 1 1 154 154 SER N N 154 113.934 113.934 117.756 -3.822 25757 1610 1 2 . 1 1 154 154 SER HA H 154 4.255 4.255 4.138 0.117 25757 1611 1 2 . 1 1 154 154 SER C C 154 177.929 177.929 176.608 1.321 25757 1612 1 2 . 1 1 154 154 SER CA C 154 59.379 59.379 61.859 -2.480 25757 1613 1 2 . 1 1 154 154 SER CB C 154 64.090 64.090 62.514 1.576 25757 1614 1 2 . 1 1 154 154 SER H H 154 7.962 7.962 8.112 -0.150 25757 1615 1 2 . 1 1 155 155 GLY N N 155 115.337 115.337 109.374 5.963 25757 1616 1 2 . 1 1 155 155 GLY C C 155 175.891 175.891 175.641 0.250 25757 1617 1 2 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.952 0.694 25757 1618 1 2 . 1 1 155 155 GLY H H 155 9.451 9.451 7.783 1.668 25757 1619 1 2 . 1 1 156 156 TRP N N 156 119.600 119.600 121.919 -2.319 25757 1620 1 2 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.279 -0.008 25757 1621 1 2 . 1 1 156 156 TRP C C 156 178.947 178.947 178.802 0.145 25757 1622 1 2 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.133 0.031 25757 1623 1 2 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.195 0.408 25757 1624 1 2 . 1 1 156 156 TRP H H 156 8.542 8.542 7.326 1.216 25757 1625 1 2 . 1 1 157 157 ARG N N 157 118.583 118.583 120.154 -1.571 25757 1626 1 2 . 1 1 157 157 ARG HA H 157 3.982 3.982 3.927 0.055 25757 1627 1 2 . 1 1 157 157 ARG C C 157 177.894 177.894 178.393 -0.499 25757 1628 1 2 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.127 -0.789 25757 1629 1 2 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.122 -0.065 25757 1630 1 2 . 1 1 157 157 ARG H H 157 7.747 7.747 8.633 -0.886 25757 1631 1 2 . 1 1 158 158 LYS N N 158 117.033 117.033 119.925 -2.892 25757 1632 1 2 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.059 -0.116 25757 1633 1 2 . 1 1 158 158 LYS C C 158 176.973 176.973 178.873 -1.900 25757 1634 1 2 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.108 0.266 25757 1635 1 2 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.049 0.242 25757 1636 1 2 . 1 1 158 158 LYS H H 158 7.529 7.529 8.075 -0.546 25757 1637 1 2 . 1 1 159 159 ILE N N 159 116.553 116.553 120.361 -3.808 25757 1638 1 2 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.731 -0.187 25757 1639 1 2 . 1 1 159 159 ILE C C 159 176.894 176.894 176.982 -0.088 25757 1640 1 2 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.239 0.277 25757 1641 1 2 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.991 -0.187 25757 1642 1 2 . 1 1 159 159 ILE H H 159 7.348 7.348 8.223 -0.875 25757 1643 1 2 . 1 1 160 160 LYS N N 160 119.278 119.278 120.337 -1.059 25757 1644 1 2 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.315 -0.276 25757 1645 1 2 . 1 1 160 160 LYS C C 160 178.566 178.566 179.221 -0.655 25757 1646 1 2 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.917 0.457 25757 1647 1 2 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.548 0.270 25757 1648 1 2 . 1 1 160 160 LYS H H 160 8.225 8.225 8.089 0.136 25757 1649 1 2 . 1 1 161 161 LEU N N 161 117.056 117.056 120.294 -3.238 25757 1650 1 2 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.105 -0.045 25757 1651 1 2 . 1 1 161 161 LEU C C 161 178.977 178.977 178.827 0.150 25757 1652 1 2 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.258 -0.235 25757 1653 1 2 . 1 1 161 161 LEU CB C 161 41.982 41.982 42.046 -0.064 25757 1654 1 2 . 1 1 161 161 LEU H H 161 8.057 8.057 8.339 -0.282 25757 1655 1 2 . 1 1 162 162 ALA N N 162 121.814 121.814 122.022 -0.208 25757 1656 1 2 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.105 -0.013 25757 1657 1 2 . 1 1 162 162 ALA C C 162 178.374 178.374 179.643 -1.269 25757 1658 1 2 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.420 0.369 25757 1659 1 2 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.578 -0.253 25757 1660 1 2 . 1 1 162 162 ALA H H 162 8.170 8.170 8.336 -0.166 25757 1661 1 2 . 1 1 163 163 VAL N N 163 115.449 115.449 116.608 -1.159 25757 1662 1 2 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.842 -0.224 25757 1663 1 2 . 1 1 163 163 VAL C C 163 178.362 178.362 177.717 0.645 25757 1664 1 2 . 1 1 163 163 VAL CA C 163 66.272 66.272 64.950 1.322 25757 1665 1 2 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.971 1.066 25757 1666 1 2 . 1 1 163 163 VAL H H 163 8.499 8.499 8.234 0.265 25757 1667 1 2 . 1 1 164 164 ARG N N 164 115.775 115.775 121.217 -5.442 25757 1668 1 2 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.229 -0.032 25757 1669 1 2 . 1 1 164 164 ARG C C 164 178.938 178.938 179.152 -0.214 25757 1670 1 2 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.406 -0.723 25757 1671 1 2 . 1 1 164 164 ARG CB C 164 29.834 29.834 29.843 -0.009 25757 1672 1 2 . 1 1 164 164 ARG H H 164 8.165 8.165 8.162 0.003 25757 1673 1 2 . 1 1 165 165 GLY N N 165 105.570 105.570 107.067 -1.497 25757 1674 1 2 . 1 1 165 165 GLY C C 165 173.134 173.134 175.161 -2.027 25757 1675 1 2 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.545 0.197 25757 1676 1 2 . 1 1 165 165 GLY H H 165 8.455 8.455 8.441 0.014 25757 1677 1 2 . 1 1 166 166 ALA N N 166 120.648 120.648 122.463 -1.815 25757 1678 1 2 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.124 0.218 25757 1679 1 2 . 1 1 166 166 ALA C C 166 176.155 176.155 177.961 -1.806 25757 1680 1 2 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.614 -1.841 25757 1681 1 2 . 1 1 166 166 ALA CB C 166 19.478 19.478 18.974 0.503 25757 1682 1 2 . 1 1 166 166 ALA H H 166 7.826 7.826 7.777 0.049 25757 1683 1 2 . 1 1 167 167 GLN N N 167 117.315 117.315 118.556 -1.241 25757 1684 1 2 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.271 0.006 25757 1685 1 2 . 1 1 167 167 GLN C C 167 175.571 175.571 175.375 0.196 25757 1686 1 2 . 1 1 167 167 GLN CA C 167 55.927 55.927 55.307 0.620 25757 1687 1 2 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.369 0.816 25757 1688 1 2 . 1 1 167 167 GLN H H 167 7.498 7.498 7.633 -0.135 25757 1689 1 2 . 1 1 168 168 ALA N N 168 126.706 126.706 125.827 0.879 25757 1690 1 2 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.481 -0.202 25757 1691 1 2 . 1 1 168 168 ALA C C 168 177.227 177.227 176.872 0.355 25757 1692 1 2 . 1 1 168 168 ALA CA C 168 52.066 52.066 50.922 1.144 25757 1693 1 2 . 1 1 168 168 ALA CB C 168 19.706 19.706 20.920 -1.214 25757 1694 1 2 . 1 1 168 168 ALA H H 168 8.534 8.534 8.313 0.221 25757 1695 1 3 . 1 1 9 9 ILE N N 9 116.733 116.733 120.788 -4.055 25757 1696 1 3 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.182 -0.425 25757 1697 1 3 . 1 1 9 9 ILE C C 9 177.828 177.828 177.437 0.391 25757 1698 1 3 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.666 2.938 25757 1699 1 3 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.646 -0.048 25757 1700 1 3 . 1 1 9 9 ILE H H 9 7.366 7.366 8.209 -0.843 25757 1701 1 3 . 1 1 10 10 ALA N N 10 121.080 121.080 123.359 -2.279 25757 1702 1 3 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.909 0.166 25757 1703 1 3 . 1 1 10 10 ALA C C 10 180.921 180.921 179.247 1.674 25757 1704 1 3 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.238 0.365 25757 1705 1 3 . 1 1 10 10 ALA CB C 10 17.984 17.984 18.104 -0.120 25757 1706 1 3 . 1 1 10 10 ALA H H 10 8.039 8.039 8.467 -0.428 25757 1707 1 3 . 1 1 11 11 GLU N N 11 119.580 119.580 118.916 0.664 25757 1708 1 3 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.807 0.282 25757 1709 1 3 . 1 1 11 11 GLU C C 11 179.561 179.561 178.797 0.764 25757 1710 1 3 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.400 0.485 25757 1711 1 3 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.936 0.527 25757 1712 1 3 . 1 1 11 11 GLU H H 11 7.741 7.741 8.039 -0.298 25757 1713 1 3 . 1 1 12 12 PHE N N 12 118.509 118.509 117.580 0.929 25757 1714 1 3 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.257 0.569 25757 1715 1 3 . 1 1 12 12 PHE C C 12 179.000 179.000 178.443 0.557 25757 1716 1 3 . 1 1 12 12 PHE CA C 12 60.164 60.164 60.487 -0.323 25757 1717 1 3 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.178 -0.068 25757 1718 1 3 . 1 1 12 12 PHE H H 12 8.470 8.470 6.997 1.472 25757 1719 1 3 . 1 1 13 13 LYS N N 13 123.523 123.523 120.319 3.204 25757 1720 1 3 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.219 -0.193 25757 1721 1 3 . 1 1 13 13 LYS C C 13 179.260 179.260 179.203 0.057 25757 1722 1 3 . 1 1 13 13 LYS CA C 13 60.164 60.164 60.029 0.135 25757 1723 1 3 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.246 -0.413 25757 1724 1 3 . 1 1 13 13 LYS H H 13 9.171 9.171 8.321 0.850 25757 1725 1 3 . 1 1 14 14 GLU N N 14 120.415 120.415 118.565 1.850 25757 1726 1 3 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.141 -0.046 25757 1727 1 3 . 1 1 14 14 GLU C C 14 179.851 179.851 179.058 0.793 25757 1728 1 3 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.269 0.317 25757 1729 1 3 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.442 0.119 25757 1730 1 3 . 1 1 14 14 GLU H H 14 7.822 7.822 8.215 -0.393 25757 1731 1 3 . 1 1 15 15 ALA N N 15 122.143 122.143 122.345 -0.202 25757 1732 1 3 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.192 -0.062 25757 1733 1 3 . 1 1 15 15 ALA C C 15 178.222 178.222 179.569 -1.347 25757 1734 1 3 . 1 1 15 15 ALA CA C 15 55.190 55.190 54.967 0.223 25757 1735 1 3 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.534 -0.032 25757 1736 1 3 . 1 1 15 15 ALA H H 15 8.244 8.244 8.153 0.091 25757 1737 1 3 . 1 1 16 16 PHE N N 16 119.809 119.809 116.816 2.993 25757 1738 1 3 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.535 -0.523 25757 1739 1 3 . 1 1 16 16 PHE C C 16 177.444 177.444 177.724 -0.280 25757 1740 1 3 . 1 1 16 16 PHE CA C 16 62.064 62.064 61.041 1.022 25757 1741 1 3 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.224 0.208 25757 1742 1 3 . 1 1 16 16 PHE H H 16 8.891 8.891 8.333 0.558 25757 1743 1 3 . 1 1 17 17 SER N N 17 112.631 112.631 115.611 -2.980 25757 1744 1 3 . 1 1 17 17 SER HA H 17 4.034 4.034 4.252 -0.218 25757 1745 1 3 . 1 1 17 17 SER C C 17 174.675 174.675 176.281 -1.606 25757 1746 1 3 . 1 1 17 17 SER CA C 17 61.507 61.507 62.183 -0.676 25757 1747 1 3 . 1 1 17 17 SER CB C 17 63.414 63.414 63.534 -0.120 25757 1748 1 3 . 1 1 17 17 SER H H 17 7.910 7.910 8.405 -0.495 25757 1749 1 3 . 1 1 18 18 LEU N N 18 120.614 120.614 116.703 3.911 25757 1750 1 3 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.248 -0.236 25757 1751 1 3 . 1 1 18 18 LEU C C 18 177.366 177.366 177.275 0.091 25757 1752 1 3 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.013 0.373 25757 1753 1 3 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.650 -0.055 25757 1754 1 3 . 1 1 18 18 LEU H H 18 7.423 7.423 8.018 -0.595 25757 1755 1 3 . 1 1 19 19 PHE N N 19 114.602 114.602 117.934 -3.332 25757 1756 1 3 . 1 1 19 19 PHE C C 19 176.961 176.961 175.798 1.163 25757 1757 1 3 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.478 -0.994 25757 1758 1 3 . 1 1 19 19 PHE CB C 19 40.769 40.769 40.758 0.011 25757 1759 1 3 . 1 1 19 19 PHE H H 19 7.254 7.254 7.636 -0.382 25757 1760 1 3 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.677 -0.102 25757 1761 1 3 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.296 -1.648 25757 1762 1 3 . 1 1 22 22 ASP CB C 22 40.010 40.010 41.171 -1.161 25757 1763 1 3 . 1 1 23 23 GLY N N 23 108.244 108.244 108.833 -0.589 25757 1764 1 3 . 1 1 23 23 GLY C C 23 175.188 175.188 174.895 0.293 25757 1765 1 3 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.264 1.139 25757 1766 1 3 . 1 1 23 23 GLY H H 23 7.555 7.555 8.421 -0.866 25757 1767 1 3 . 1 1 24 24 ASP N N 24 120.667 120.667 119.960 0.707 25757 1768 1 3 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.558 -0.089 25757 1769 1 3 . 1 1 24 24 ASP C C 24 177.457 177.457 177.789 -0.332 25757 1770 1 3 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.523 0.269 25757 1771 1 3 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.614 -1.098 25757 1772 1 3 . 1 1 24 24 ASP H H 24 8.397 8.397 8.003 0.394 25757 1773 1 3 . 1 1 25 25 GLY N N 25 112.989 112.989 108.525 4.464 25757 1774 1 3 . 1 1 25 25 GLY C C 25 173.639 173.639 173.139 0.500 25757 1775 1 3 . 1 1 25 25 GLY CA C 25 45.501 45.501 44.936 0.565 25757 1776 1 3 . 1 1 25 25 GLY H H 25 10.592 10.592 7.956 2.636 25757 1777 1 3 . 1 1 26 26 THR N N 26 112.948 112.948 113.073 -0.125 25757 1778 1 3 . 1 1 26 26 THR HA H 26 5.282 5.282 4.829 0.453 25757 1779 1 3 . 1 1 26 26 THR C C 26 172.853 172.853 172.382 0.471 25757 1780 1 3 . 1 1 26 26 THR CA C 26 59.817 59.817 61.525 -1.708 25757 1781 1 3 . 1 1 26 26 THR CB C 26 72.465 72.465 70.870 1.595 25757 1782 1 3 . 1 1 26 26 THR H H 26 8.121 8.121 8.055 0.066 25757 1783 1 3 . 1 1 27 27 ILE N N 27 127.195 127.195 122.658 4.537 25757 1784 1 3 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.645 0.268 25757 1785 1 3 . 1 1 27 27 ILE C C 27 176.091 176.091 174.705 1.386 25757 1786 1 3 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.152 0.613 25757 1787 1 3 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.994 -2.289 25757 1788 1 3 . 1 1 27 27 ILE H H 27 9.867 9.867 8.617 1.250 25757 1789 1 3 . 1 1 28 28 THR N N 28 116.655 116.655 119.651 -2.996 25757 1790 1 3 . 1 1 28 28 THR HA H 28 4.790 4.790 4.844 -0.054 25757 1791 1 3 . 1 1 28 28 THR C C 28 176.696 176.696 176.537 0.159 25757 1792 1 3 . 1 1 28 28 THR CA C 28 59.590 59.590 59.782 -0.192 25757 1793 1 3 . 1 1 28 28 THR CB C 28 72.457 72.457 70.836 1.621 25757 1794 1 3 . 1 1 28 28 THR H H 28 8.457 8.457 8.399 0.058 25757 1795 1 3 . 1 1 29 29 THR N N 29 111.878 111.878 116.664 -4.786 25757 1796 1 3 . 1 1 29 29 THR HA H 29 4.188 4.188 3.939 0.249 25757 1797 1 3 . 1 1 29 29 THR C C 29 177.399 177.399 176.406 0.993 25757 1798 1 3 . 1 1 29 29 THR CA C 29 66.386 66.386 66.695 -0.309 25757 1799 1 3 . 1 1 29 29 THR CB C 29 67.726 67.726 68.402 -0.676 25757 1800 1 3 . 1 1 29 29 THR H H 29 9.211 9.211 8.777 0.434 25757 1801 1 3 . 1 1 30 30 LYS N N 30 121.140 121.140 122.007 -0.867 25757 1802 1 3 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.954 0.123 25757 1803 1 3 . 1 1 30 30 LYS C C 30 179.793 179.793 178.401 1.392 25757 1804 1 3 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.968 -0.676 25757 1805 1 3 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.112 0.335 25757 1806 1 3 . 1 1 30 30 LYS H H 30 7.580 7.580 7.732 -0.152 25757 1807 1 3 . 1 1 31 31 GLU N N 31 121.865 121.865 119.312 2.553 25757 1808 1 3 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.949 0.045 25757 1809 1 3 . 1 1 31 31 GLU C C 31 179.355 179.355 179.034 0.321 25757 1810 1 3 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.929 -0.296 25757 1811 1 3 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.522 0.330 25757 1812 1 3 . 1 1 31 31 GLU H H 31 7.708 7.708 7.769 -0.061 25757 1813 1 3 . 1 1 32 32 LEU N N 32 120.597 120.597 117.341 3.256 25757 1814 1 3 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.090 0.026 25757 1815 1 3 . 1 1 32 32 LEU C C 32 178.885 178.885 179.107 -0.222 25757 1816 1 3 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.339 0.022 25757 1817 1 3 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.968 2.067 25757 1818 1 3 . 1 1 32 32 LEU H H 32 8.688 8.688 7.807 0.881 25757 1819 1 3 . 1 1 33 33 GLY N N 33 104.837 104.837 107.864 -3.027 25757 1820 1 3 . 1 1 33 33 GLY C C 33 175.123 175.123 175.834 -0.711 25757 1821 1 3 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.376 0.871 25757 1822 1 3 . 1 1 33 33 GLY H H 33 8.694 8.694 8.263 0.431 25757 1823 1 3 . 1 1 34 34 THR N N 34 117.631 117.631 118.198 -0.567 25757 1824 1 3 . 1 1 34 34 THR HA H 34 3.899 3.899 4.004 -0.105 25757 1825 1 3 . 1 1 34 34 THR C C 34 176.951 176.951 176.796 0.155 25757 1826 1 3 . 1 1 34 34 THR CA C 34 67.234 67.234 65.745 1.490 25757 1827 1 3 . 1 1 34 34 THR CB C 34 68.863 68.863 68.753 0.110 25757 1828 1 3 . 1 1 34 34 THR H H 34 7.960 7.960 7.953 0.007 25757 1829 1 3 . 1 1 35 35 VAL N N 35 121.659 121.659 121.418 0.241 25757 1830 1 3 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.562 -0.045 25757 1831 1 3 . 1 1 35 35 VAL C C 35 178.265 178.265 177.616 0.649 25757 1832 1 3 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.834 -0.159 25757 1833 1 3 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.317 -0.024 25757 1834 1 3 . 1 1 35 35 VAL H H 35 7.358 7.358 8.349 -0.991 25757 1835 1 3 . 1 1 36 36 MET N N 36 117.456 117.456 117.804 -0.348 25757 1836 1 3 . 1 1 36 36 MET C C 36 179.088 179.088 178.376 0.712 25757 1837 1 3 . 1 1 36 36 MET CA C 36 60.477 60.477 58.323 2.154 25757 1838 1 3 . 1 1 36 36 MET CB C 36 32.443 32.443 32.853 -0.410 25757 1839 1 3 . 1 1 36 36 MET H H 36 8.194 8.194 7.976 0.218 25757 1840 1 3 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.632 0.515 25757 1841 1 3 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.940 0.410 25757 1842 1 3 . 1 1 38 38 SER HA H 38 4.085 4.085 4.206 -0.121 25757 1843 1 3 . 1 1 38 38 SER C C 38 173.788 173.788 174.720 -0.932 25757 1844 1 3 . 1 1 38 38 SER CA C 38 61.617 61.617 61.014 0.604 25757 1845 1 3 . 1 1 38 38 SER CB C 38 62.943 62.943 63.054 -0.111 25757 1846 1 3 . 1 1 39 39 LEU N N 39 119.003 119.003 118.485 0.518 25757 1847 1 3 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.440 0.054 25757 1848 1 3 . 1 1 39 39 LEU C C 39 176.470 176.470 176.746 -0.276 25757 1849 1 3 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.528 0.151 25757 1850 1 3 . 1 1 39 39 LEU CB C 39 41.514 41.514 39.992 1.522 25757 1851 1 3 . 1 1 39 39 LEU H H 39 7.230 7.230 7.198 0.032 25757 1852 1 3 . 1 1 40 40 GLY N N 40 105.026 105.026 106.300 -1.274 25757 1853 1 3 . 1 1 40 40 GLY C C 40 174.322 174.322 174.457 -0.135 25757 1854 1 3 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.316 0.899 25757 1855 1 3 . 1 1 40 40 GLY H H 40 7.698 7.698 7.871 -0.173 25757 1856 1 3 . 1 1 41 41 GLN N N 41 117.929 117.929 119.243 -1.314 25757 1857 1 3 . 1 1 41 41 GLN C C 41 174.557 174.557 175.240 -0.683 25757 1858 1 3 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.020 0.824 25757 1859 1 3 . 1 1 41 41 GLN H H 41 7.866 7.866 7.542 0.324 25757 1860 1 3 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.641 0.095 25757 1861 1 3 . 1 1 43 43 PRO C C 43 177.805 177.805 176.578 1.227 25757 1862 1 3 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.819 -0.313 25757 1863 1 3 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.281 -0.119 25757 1864 1 3 . 1 1 44 44 THR N N 44 113.167 113.167 113.953 -0.786 25757 1865 1 3 . 1 1 44 44 THR HA H 44 4.684 4.684 4.631 0.053 25757 1866 1 3 . 1 1 44 44 THR C C 44 175.139 175.139 175.803 -0.664 25757 1867 1 3 . 1 1 44 44 THR CA C 44 60.556 60.556 59.142 1.414 25757 1868 1 3 . 1 1 44 44 THR CB C 44 71.064 71.064 71.501 -0.437 25757 1869 1 3 . 1 1 44 44 THR H H 44 8.798 8.798 7.748 1.050 25757 1870 1 3 . 1 1 45 45 GLU N N 45 120.673 120.673 120.430 0.243 25757 1871 1 3 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.960 0.031 25757 1872 1 3 . 1 1 45 45 GLU C C 45 178.940 178.940 178.917 0.023 25757 1873 1 3 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.780 0.121 25757 1874 1 3 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.172 -0.143 25757 1875 1 3 . 1 1 45 45 GLU H H 45 8.812 8.812 8.987 -0.175 25757 1876 1 3 . 1 1 46 46 ALA N N 46 120.576 120.576 121.373 -0.797 25757 1877 1 3 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.146 -0.179 25757 1878 1 3 . 1 1 46 46 ALA C C 46 180.290 180.290 179.781 0.509 25757 1879 1 3 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.071 -0.152 25757 1880 1 3 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.437 -0.276 25757 1881 1 3 . 1 1 46 46 ALA H H 46 8.276 8.276 8.374 -0.098 25757 1882 1 3 . 1 1 47 47 GLU N N 47 116.104 116.104 119.542 -3.438 25757 1883 1 3 . 1 1 47 47 GLU HA H 47 4.000 4.000 3.985 0.015 25757 1884 1 3 . 1 1 47 47 GLU C C 47 180.224 180.224 179.129 1.095 25757 1885 1 3 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.651 -0.720 25757 1886 1 3 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.613 0.376 25757 1887 1 3 . 1 1 47 47 GLU H H 47 7.425 7.425 7.665 -0.240 25757 1888 1 3 . 1 1 48 48 LEU N N 48 120.425 120.425 119.230 1.195 25757 1889 1 3 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.903 0.147 25757 1890 1 3 . 1 1 48 48 LEU C C 48 178.551 178.551 178.953 -0.402 25757 1891 1 3 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.232 -0.393 25757 1892 1 3 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.472 1.097 25757 1893 1 3 . 1 1 48 48 LEU H H 48 8.121 8.121 8.074 0.047 25757 1894 1 3 . 1 1 49 49 GLN N N 49 118.372 118.372 119.483 -1.111 25757 1895 1 3 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.883 -0.121 25757 1896 1 3 . 1 1 49 49 GLN C C 49 178.567 178.567 178.249 0.318 25757 1897 1 3 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.147 -0.284 25757 1898 1 3 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.505 -0.262 25757 1899 1 3 . 1 1 49 49 GLN H H 49 8.302 8.302 8.346 -0.044 25757 1900 1 3 . 1 1 50 50 ASP N N 50 119.992 119.992 120.279 -0.287 25757 1901 1 3 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.333 0.027 25757 1902 1 3 . 1 1 50 50 ASP C C 50 178.600 178.600 178.409 0.191 25757 1903 1 3 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.327 0.376 25757 1904 1 3 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.898 -0.431 25757 1905 1 3 . 1 1 50 50 ASP H H 50 8.150 8.150 8.366 -0.216 25757 1906 1 3 . 1 1 51 51 MET N N 51 119.238 119.238 118.760 0.478 25757 1907 1 3 . 1 1 51 51 MET HA H 51 3.981 3.981 3.987 -0.006 25757 1908 1 3 . 1 1 51 51 MET C C 51 179.006 179.006 178.606 0.400 25757 1909 1 3 . 1 1 51 51 MET CA C 51 59.443 59.443 59.306 0.137 25757 1910 1 3 . 1 1 51 51 MET CB C 51 33.380 33.380 32.488 0.892 25757 1911 1 3 . 1 1 51 51 MET H H 51 7.844 7.844 7.981 -0.137 25757 1912 1 3 . 1 1 52 52 ILE N N 52 118.161 118.161 119.014 -0.853 25757 1913 1 3 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.612 -0.134 25757 1914 1 3 . 1 1 52 52 ILE C C 52 177.847 177.847 178.866 -1.019 25757 1915 1 3 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.366 0.629 25757 1916 1 3 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.692 0.431 25757 1917 1 3 . 1 1 52 52 ILE H H 52 7.686 7.686 8.352 -0.666 25757 1918 1 3 . 1 1 53 53 ASN N N 53 117.884 117.884 117.777 0.107 25757 1919 1 3 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.509 -0.144 25757 1920 1 3 . 1 1 53 53 ASN C C 53 177.515 177.515 177.704 -0.189 25757 1921 1 3 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.621 0.586 25757 1922 1 3 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.127 -0.049 25757 1923 1 3 . 1 1 53 53 ASN H H 53 8.713 8.713 8.587 0.126 25757 1924 1 3 . 1 1 54 54 GLU N N 54 116.178 116.178 117.765 -1.587 25757 1925 1 3 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.350 -0.361 25757 1926 1 3 . 1 1 54 54 GLU C C 54 177.557 177.557 176.968 0.589 25757 1927 1 3 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.077 1.913 25757 1928 1 3 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.111 0.351 25757 1929 1 3 . 1 1 54 54 GLU H H 54 7.530 7.530 8.043 -0.513 25757 1930 1 3 . 1 1 55 55 VAL N N 55 107.164 107.164 111.688 -4.524 25757 1931 1 3 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.385 0.137 25757 1932 1 3 . 1 1 55 55 VAL C C 55 175.602 175.602 174.101 1.501 25757 1933 1 3 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.488 -0.136 25757 1934 1 3 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.049 0.554 25757 1935 1 3 . 1 1 55 55 VAL H H 55 7.175 7.175 7.505 -0.330 25757 1936 1 3 . 1 1 56 56 ASP N N 56 122.126 122.126 120.219 1.907 25757 1937 1 3 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.915 -0.316 25757 1938 1 3 . 1 1 56 56 ASP C C 56 176.182 176.182 175.797 0.385 25757 1939 1 3 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.346 0.459 25757 1940 1 3 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.812 -2.542 25757 1941 1 3 . 1 1 56 56 ASP H H 56 7.569 7.569 7.467 0.102 25757 1942 1 3 . 1 1 57 57 ALA N N 57 103.782 103.782 127.592 -23.810 25757 1943 1 3 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.318 -0.138 25757 1944 1 3 . 1 1 57 57 ALA C C 57 178.584 178.584 178.031 0.553 25757 1945 1 3 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.359 0.985 25757 1946 1 3 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.432 0.092 25757 1947 1 3 . 1 1 57 57 ALA H H 57 8.515 8.515 8.563 -0.048 25757 1948 1 3 . 1 1 58 58 ASP N N 58 113.602 113.602 119.869 -6.267 25757 1949 1 3 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.550 0.036 25757 1950 1 3 . 1 1 58 58 ASP C C 58 177.756 177.756 177.214 0.542 25757 1951 1 3 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.770 -2.008 25757 1952 1 3 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.267 -1.589 25757 1953 1 3 . 1 1 58 58 ASP H H 58 8.130 8.130 8.036 0.094 25757 1954 1 3 . 1 1 59 59 GLY N N 59 109.195 109.195 108.118 1.077 25757 1955 1 3 . 1 1 59 59 GLY C C 59 175.139 175.139 174.277 0.862 25757 1956 1 3 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.083 2.181 25757 1957 1 3 . 1 1 59 59 GLY H H 59 7.694 7.694 8.746 -1.052 25757 1958 1 3 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.824 -0.219 25757 1959 1 3 . 1 1 61 61 GLY N N 61 113.316 113.316 109.913 3.403 25757 1960 1 3 . 1 1 61 61 GLY C C 61 173.234 173.234 172.958 0.276 25757 1961 1 3 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.206 -0.508 25757 1962 1 3 . 1 1 61 61 GLY H H 61 10.633 10.633 8.444 2.189 25757 1963 1 3 . 1 1 62 62 THR N N 62 108.892 108.892 109.459 -0.567 25757 1964 1 3 . 1 1 62 62 THR HA H 62 4.736 4.736 4.941 -0.205 25757 1965 1 3 . 1 1 62 62 THR C C 62 173.091 173.091 172.615 0.476 25757 1966 1 3 . 1 1 62 62 THR CA C 62 59.617 59.617 60.086 -0.469 25757 1967 1 3 . 1 1 62 62 THR CB C 62 72.004 72.004 72.115 -0.111 25757 1968 1 3 . 1 1 62 62 THR H H 62 7.673 7.673 7.882 -0.209 25757 1969 1 3 . 1 1 63 63 ILE N N 63 123.324 123.324 122.319 1.005 25757 1970 1 3 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.770 0.359 25757 1971 1 3 . 1 1 63 63 ILE C C 63 175.652 175.652 174.110 1.542 25757 1972 1 3 . 1 1 63 63 ILE CA C 63 60.486 60.486 58.663 1.823 25757 1973 1 3 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.424 -1.467 25757 1974 1 3 . 1 1 63 63 ILE H H 63 8.907 8.907 8.625 0.282 25757 1975 1 3 . 1 1 64 64 ASP N N 64 128.253 128.253 127.308 0.945 25757 1976 1 3 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.920 0.401 25757 1977 1 3 . 1 1 64 64 ASP C C 64 176.431 176.431 177.462 -1.031 25757 1978 1 3 . 1 1 64 64 ASP CA C 64 52.331 52.331 52.983 -0.652 25757 1979 1 3 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.123 -0.070 25757 1980 1 3 . 1 1 64 64 ASP H H 64 8.864 8.864 8.454 0.410 25757 1981 1 3 . 1 1 65 65 PHE N N 65 118.583 118.583 120.232 -1.649 25757 1982 1 3 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.165 -0.305 25757 1983 1 3 . 1 1 65 65 PHE C C 65 173.458 173.458 174.761 -1.303 25757 1984 1 3 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.008 0.791 25757 1985 1 3 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.522 -0.642 25757 1986 1 3 . 1 1 65 65 PHE H H 65 8.962 8.962 8.774 0.188 25757 1987 1 3 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.366 -0.248 25757 1988 1 3 . 1 1 66 66 PRO C C 66 180.038 180.038 178.202 1.836 25757 1989 1 3 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.001 1.689 25757 1990 1 3 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.047 -0.370 25757 1991 1 3 . 1 1 67 67 GLU N N 67 118.402 118.402 119.700 -1.298 25757 1992 1 3 . 1 1 67 67 GLU C C 67 178.737 178.737 178.323 0.414 25757 1993 1 3 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.561 -0.553 25757 1994 1 3 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.411 0.274 25757 1995 1 3 . 1 1 67 67 GLU H H 67 7.953 7.953 7.798 0.155 25757 1996 1 3 . 1 1 68 68 PHE N N 68 123.421 123.421 120.927 2.494 25757 1997 1 3 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.252 -0.280 25757 1998 1 3 . 1 1 68 68 PHE C C 68 177.184 177.184 177.417 -0.233 25757 1999 1 3 . 1 1 68 68 PHE CA C 68 61.338 61.338 60.663 0.675 25757 2000 1 3 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.235 0.734 25757 2001 1 3 . 1 1 68 68 PHE H H 68 8.928 8.928 7.735 1.193 25757 2002 1 3 . 1 1 69 69 LEU N N 69 119.284 119.284 118.470 0.814 25757 2003 1 3 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.831 -0.496 25757 2004 1 3 . 1 1 69 69 LEU C C 69 178.987 178.987 178.716 0.271 25757 2005 1 3 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.785 -0.923 25757 2006 1 3 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.778 -0.946 25757 2007 1 3 . 1 1 69 69 LEU H H 69 8.374 8.374 7.825 0.549 25757 2008 1 3 . 1 1 70 70 THR N N 70 116.017 116.017 115.794 0.223 25757 2009 1 3 . 1 1 70 70 THR HA H 70 4.338 4.338 4.060 0.278 25757 2010 1 3 . 1 1 70 70 THR C C 70 176.169 176.169 176.487 -0.318 25757 2011 1 3 . 1 1 70 70 THR CA C 70 66.700 66.700 66.918 -0.218 25757 2012 1 3 . 1 1 70 70 THR CB C 70 68.379 68.379 68.957 -0.578 25757 2013 1 3 . 1 1 70 70 THR H H 70 7.493 7.493 7.246 0.247 25757 2014 1 3 . 1 1 71 71 MET N N 71 121.915 121.915 119.525 2.390 25757 2015 1 3 . 1 1 71 71 MET HA H 71 3.718 3.718 4.324 -0.606 25757 2016 1 3 . 1 1 71 71 MET C C 71 178.190 178.190 177.077 1.113 25757 2017 1 3 . 1 1 71 71 MET CA C 71 59.335 59.335 57.886 1.449 25757 2018 1 3 . 1 1 71 71 MET CB C 71 33.894 33.894 32.152 1.742 25757 2019 1 3 . 1 1 71 71 MET H H 71 7.924 7.924 8.135 -0.211 25757 2020 1 3 . 1 1 72 72 MET N N 72 116.973 116.973 118.447 -1.474 25757 2021 1 3 . 1 1 72 72 MET HA H 72 3.968 3.968 4.184 -0.216 25757 2022 1 3 . 1 1 72 72 MET C C 72 178.211 178.211 177.733 0.478 25757 2023 1 3 . 1 1 72 72 MET CA C 72 56.059 56.059 57.583 -1.524 25757 2024 1 3 . 1 1 72 72 MET CB C 72 31.639 31.639 33.319 -1.680 25757 2025 1 3 . 1 1 72 72 MET H H 72 8.276 8.276 7.882 0.394 25757 2026 1 3 . 1 1 73 73 ALA N N 73 122.499 122.499 122.223 0.276 25757 2027 1 3 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.934 0.016 25757 2028 1 3 . 1 1 73 73 ALA C C 73 180.231 180.231 179.204 1.027 25757 2029 1 3 . 1 1 73 73 ALA CA C 73 54.953 54.953 55.013 -0.060 25757 2030 1 3 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.928 0.104 25757 2031 1 3 . 1 1 73 73 ALA H H 73 8.240 8.240 7.870 0.370 25757 2032 1 3 . 1 1 74 74 ARG N N 74 116.098 116.098 118.052 -1.954 25757 2033 1 3 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.049 -0.057 25757 2034 1 3 . 1 1 74 74 ARG C C 74 178.567 178.567 178.333 0.234 25757 2035 1 3 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.386 0.439 25757 2036 1 3 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.963 0.112 25757 2037 1 3 . 1 1 74 74 ARG H H 74 7.420 7.420 7.648 -0.228 25757 2038 1 3 . 1 1 75 75 LYS N N 75 119.046 119.046 117.950 1.096 25757 2039 1 3 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.283 -0.240 25757 2040 1 3 . 1 1 75 75 LYS C C 75 179.045 179.045 178.112 0.933 25757 2041 1 3 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.948 -0.059 25757 2042 1 3 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.584 -0.818 25757 2043 1 3 . 1 1 75 75 LYS H H 75 7.862 7.862 8.158 -0.296 25757 2044 1 3 . 1 1 76 76 MET N N 76 116.772 116.772 120.441 -3.669 25757 2045 1 3 . 1 1 76 76 MET H H 76 8.099 8.099 7.860 0.239 25757 2046 1 3 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.557 0.077 25757 2047 1 3 . 1 1 78 78 ASP C C 78 176.395 176.395 176.381 0.014 25757 2048 1 3 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.991 -0.347 25757 2049 1 3 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.375 0.099 25757 2050 1 3 . 1 1 79 79 THR N N 79 113.904 113.904 113.606 0.298 25757 2051 1 3 . 1 1 79 79 THR HA H 79 4.215 4.215 4.339 -0.124 25757 2052 1 3 . 1 1 79 79 THR C C 79 174.204 174.204 173.665 0.539 25757 2053 1 3 . 1 1 79 79 THR CA C 79 62.264 62.264 62.193 0.071 25757 2054 1 3 . 1 1 79 79 THR CB C 79 69.884 69.884 69.020 0.864 25757 2055 1 3 . 1 1 79 79 THR H H 79 8.039 8.039 8.295 -0.256 25757 2056 1 3 . 1 1 80 80 ASP N N 80 123.572 123.572 121.938 1.634 25757 2057 1 3 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.916 -0.196 25757 2058 1 3 . 1 1 80 80 ASP C C 80 176.221 176.221 175.857 0.364 25757 2059 1 3 . 1 1 80 80 ASP CA C 80 54.315 54.315 53.674 0.641 25757 2060 1 3 . 1 1 80 80 ASP CB C 80 41.427 41.427 41.423 0.004 25757 2061 1 3 . 1 1 80 80 ASP H H 80 8.441 8.441 8.060 0.381 25757 2062 1 3 . 1 1 81 81 SER N N 81 117.879 117.879 119.021 -1.142 25757 2063 1 3 . 1 1 81 81 SER HA H 81 3.925 3.925 4.560 -0.635 25757 2064 1 3 . 1 1 81 81 SER C C 81 175.264 175.264 175.465 -0.201 25757 2065 1 3 . 1 1 81 81 SER CA C 81 58.860 58.860 59.941 -1.081 25757 2066 1 3 . 1 1 81 81 SER CB C 81 63.790 63.790 64.358 -0.568 25757 2067 1 3 . 1 1 81 81 SER H H 81 8.503 8.503 8.816 -0.313 25757 2068 1 3 . 1 1 82 82 GLU N N 82 123.206 123.206 122.417 0.789 25757 2069 1 3 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.973 0.085 25757 2070 1 3 . 1 1 82 82 GLU C C 82 178.378 178.378 178.406 -0.028 25757 2071 1 3 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.028 -0.442 25757 2072 1 3 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.040 0.563 25757 2073 1 3 . 1 1 82 82 GLU H H 82 8.563 8.563 8.909 -0.346 25757 2074 1 3 . 1 1 83 83 GLU N N 83 119.262 119.262 118.005 1.257 25757 2075 1 3 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.972 -0.015 25757 2076 1 3 . 1 1 83 83 GLU C C 83 178.606 178.606 178.762 -0.156 25757 2077 1 3 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.692 -0.023 25757 2078 1 3 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.216 0.139 25757 2079 1 3 . 1 1 83 83 GLU H H 83 7.728 7.728 8.732 -1.004 25757 2080 1 3 . 1 1 84 84 GLU N N 84 118.432 118.432 119.150 -0.718 25757 2081 1 3 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.038 0.069 25757 2082 1 3 . 1 1 84 84 GLU C C 84 179.436 179.436 179.094 0.342 25757 2083 1 3 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.940 0.563 25757 2084 1 3 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.221 -0.114 25757 2085 1 3 . 1 1 84 84 GLU H H 84 8.346 8.346 8.231 0.115 25757 2086 1 3 . 1 1 85 85 ILE N N 85 120.925 120.925 121.395 -0.470 25757 2087 1 3 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.890 -0.142 25757 2088 1 3 . 1 1 85 85 ILE C C 85 177.661 177.661 178.326 -0.665 25757 2089 1 3 . 1 1 85 85 ILE CA C 85 65.490 65.490 63.988 1.502 25757 2090 1 3 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.899 0.532 25757 2091 1 3 . 1 1 85 85 ILE H H 85 7.821 7.821 8.478 -0.657 25757 2092 1 3 . 1 1 86 86 ARG N N 86 121.916 121.916 118.940 2.976 25757 2093 1 3 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.724 0.412 25757 2094 1 3 . 1 1 86 86 ARG C C 86 179.208 179.208 178.969 0.239 25757 2095 1 3 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.540 0.831 25757 2096 1 3 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.762 0.336 25757 2097 1 3 . 1 1 86 86 ARG H H 86 8.432 8.432 8.197 0.235 25757 2098 1 3 . 1 1 87 87 GLU N N 87 118.261 118.261 118.613 -0.352 25757 2099 1 3 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.915 0.197 25757 2100 1 3 . 1 1 87 87 GLU C C 87 178.516 178.516 178.629 -0.113 25757 2101 1 3 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.239 -0.214 25757 2102 1 3 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.168 0.002 25757 2103 1 3 . 1 1 87 87 GLU H H 87 8.225 8.225 8.081 0.144 25757 2104 1 3 . 1 1 88 88 ALA N N 88 121.009 121.009 122.726 -1.717 25757 2105 1 3 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.487 0.340 25757 2106 1 3 . 1 1 88 88 ALA C C 88 177.947 177.947 178.126 -0.179 25757 2107 1 3 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.835 0.026 25757 2108 1 3 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.229 -0.274 25757 2109 1 3 . 1 1 88 88 ALA H H 88 7.789 7.789 7.970 -0.181 25757 2110 1 3 . 1 1 89 89 PHE N N 89 117.164 117.164 118.514 -1.350 25757 2111 1 3 . 1 1 89 89 PHE C C 89 176.134 176.134 177.463 -1.329 25757 2112 1 3 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.597 2.053 25757 2113 1 3 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.831 0.062 25757 2114 1 3 . 1 1 89 89 PHE H H 89 8.337 8.337 7.375 0.962 25757 2115 1 3 . 1 1 90 90 ARG N N 90 114.900 114.900 117.543 -2.643 25757 2116 1 3 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.955 -0.041 25757 2117 1 3 . 1 1 90 90 ARG C C 90 178.296 178.296 177.447 0.849 25757 2118 1 3 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.718 0.361 25757 2119 1 3 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.635 -0.542 25757 2120 1 3 . 1 1 90 90 ARG H H 90 7.681 7.681 7.664 0.017 25757 2121 1 3 . 1 1 91 91 VAL N N 91 116.927 116.927 115.229 1.698 25757 2122 1 3 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.840 -0.233 25757 2123 1 3 . 1 1 91 91 VAL C C 91 177.964 177.964 177.073 0.891 25757 2124 1 3 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.695 0.265 25757 2125 1 3 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.768 -0.149 25757 2126 1 3 . 1 1 91 91 VAL H H 91 7.405 7.405 7.584 -0.179 25757 2127 1 3 . 1 1 92 92 PHE N N 92 119.026 119.026 116.931 2.095 25757 2128 1 3 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.333 0.029 25757 2129 1 3 . 1 1 92 92 PHE C C 92 177.639 177.639 176.130 1.509 25757 2130 1 3 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.059 -0.338 25757 2131 1 3 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.724 -0.297 25757 2132 1 3 . 1 1 92 92 PHE H H 92 7.886 7.886 7.535 0.351 25757 2133 1 3 . 1 1 93 93 ASP N N 93 118.238 118.238 118.624 -0.386 25757 2134 1 3 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.987 -0.525 25757 2135 1 3 . 1 1 93 93 ASP C C 93 176.979 176.979 176.311 0.668 25757 2136 1 3 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.943 -0.795 25757 2137 1 3 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.071 -1.922 25757 2138 1 3 . 1 1 93 93 ASP H H 93 8.009 8.009 7.439 0.570 25757 2139 1 3 . 1 1 94 94 LYS N N 94 125.792 125.792 126.326 -0.534 25757 2140 1 3 . 1 1 94 94 LYS C C 94 178.213 178.213 177.735 0.478 25757 2141 1 3 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.980 0.338 25757 2142 1 3 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.729 -1.701 25757 2143 1 3 . 1 1 94 94 LYS H H 94 7.428 7.428 8.304 -0.876 25757 2144 1 3 . 1 1 95 95 ASP N N 95 113.833 113.833 115.618 -1.785 25757 2145 1 3 . 1 1 95 95 ASP C C 95 177.718 177.718 177.550 0.168 25757 2146 1 3 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.162 -1.217 25757 2147 1 3 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.562 -0.819 25757 2148 1 3 . 1 1 95 95 ASP H H 95 8.159 8.159 7.965 0.194 25757 2149 1 3 . 1 1 96 96 GLY N N 96 109.414 109.414 108.209 1.205 25757 2150 1 3 . 1 1 96 96 GLY C C 96 175.093 175.093 175.184 -0.091 25757 2151 1 3 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.768 1.486 25757 2152 1 3 . 1 1 96 96 GLY H H 96 7.848 7.848 8.128 -0.280 25757 2153 1 3 . 1 1 97 97 ASN N N 97 119.590 119.590 118.006 1.584 25757 2154 1 3 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.552 0.060 25757 2155 1 3 . 1 1 97 97 ASN C C 97 175.937 175.937 176.671 -0.734 25757 2156 1 3 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.409 -0.521 25757 2157 1 3 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.264 -0.944 25757 2158 1 3 . 1 1 97 97 ASN H H 97 8.338 8.338 8.620 -0.282 25757 2159 1 3 . 1 1 98 98 GLY N N 98 112.940 112.940 107.488 5.452 25757 2160 1 3 . 1 1 98 98 GLY C C 98 172.429 172.429 172.684 -0.255 25757 2161 1 3 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.995 0.097 25757 2162 1 3 . 1 1 98 98 GLY H H 98 10.695 10.695 8.742 1.953 25757 2163 1 3 . 1 1 99 99 TYR N N 99 115.544 115.544 118.271 -2.727 25757 2164 1 3 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.324 -0.237 25757 2165 1 3 . 1 1 99 99 TYR C C 99 174.859 174.859 174.762 0.097 25757 2166 1 3 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.357 -1.339 25757 2167 1 3 . 1 1 99 99 TYR CB C 99 43.353 43.353 41.993 1.360 25757 2168 1 3 . 1 1 99 99 TYR H H 99 7.597 7.597 8.423 -0.826 25757 2169 1 3 . 1 1 100 100 ILE N N 100 127.078 127.078 125.406 1.672 25757 2170 1 3 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.682 0.107 25757 2171 1 3 . 1 1 100 100 ILE C C 100 175.387 175.387 175.771 -0.384 25757 2172 1 3 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.112 -0.106 25757 2173 1 3 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.536 -0.746 25757 2174 1 3 . 1 1 100 100 ILE H H 100 10.267 10.267 9.383 0.884 25757 2175 1 3 . 1 1 101 101 SER N N 101 124.102 124.102 122.146 1.956 25757 2176 1 3 . 1 1 101 101 SER HA H 101 4.417 4.417 5.271 -0.854 25757 2177 1 3 . 1 1 101 101 SER C C 101 175.360 175.360 175.203 0.157 25757 2178 1 3 . 1 1 101 101 SER CA C 101 56.036 56.036 55.774 0.262 25757 2179 1 3 . 1 1 101 101 SER CB C 101 66.896 66.896 65.762 1.134 25757 2180 1 3 . 1 1 101 101 SER H H 101 8.985 8.985 8.279 0.706 25757 2181 1 3 . 1 1 102 102 ALA N N 102 122.780 122.780 124.446 -1.666 25757 2182 1 3 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.978 -0.234 25757 2183 1 3 . 1 1 102 102 ALA C C 102 179.175 179.175 178.523 0.652 25757 2184 1 3 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.177 1.113 25757 2185 1 3 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.189 -0.162 25757 2186 1 3 . 1 1 102 102 ALA H H 102 9.269 9.269 9.027 0.242 25757 2187 1 3 . 1 1 103 103 ALA N N 103 118.513 118.513 120.597 -2.084 25757 2188 1 3 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.628 0.383 25757 2189 1 3 . 1 1 103 103 ALA C C 103 181.521 181.521 179.040 2.481 25757 2190 1 3 . 1 1 103 103 ALA CA C 103 55.354 55.354 54.720 0.634 25757 2191 1 3 . 1 1 103 103 ALA CB C 103 18.291 18.291 17.999 0.292 25757 2192 1 3 . 1 1 103 103 ALA H H 103 8.321 8.321 8.210 0.111 25757 2193 1 3 . 1 1 104 104 GLU N N 104 119.550 119.550 119.101 0.449 25757 2194 1 3 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.027 -0.021 25757 2195 1 3 . 1 1 104 104 GLU C C 104 179.750 179.750 179.227 0.523 25757 2196 1 3 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.690 -0.521 25757 2197 1 3 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.362 -0.147 25757 2198 1 3 . 1 1 104 104 GLU H H 104 7.867 7.867 8.337 -0.470 25757 2199 1 3 . 1 1 105 105 LEU N N 105 122.688 122.688 120.188 2.500 25757 2200 1 3 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.879 0.039 25757 2201 1 3 . 1 1 105 105 LEU C C 105 178.233 178.233 178.132 0.101 25757 2202 1 3 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.441 -0.707 25757 2203 1 3 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.752 0.268 25757 2204 1 3 . 1 1 105 105 LEU H H 105 8.746 8.746 7.951 0.795 25757 2205 1 3 . 1 1 106 106 ARG N N 106 118.835 118.835 118.049 0.786 25757 2206 1 3 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.799 -0.149 25757 2207 1 3 . 1 1 106 106 ARG C C 106 178.742 178.742 178.641 0.101 25757 2208 1 3 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.491 0.472 25757 2209 1 3 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.471 0.575 25757 2210 1 3 . 1 1 106 106 ARG H H 106 8.684 8.684 8.296 0.388 25757 2211 1 3 . 1 1 107 107 HIS N N 107 119.258 119.258 119.080 0.178 25757 2212 1 3 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.380 -0.113 25757 2213 1 3 . 1 1 107 107 HIS C C 107 177.244 177.244 178.153 -0.909 25757 2214 1 3 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.495 1.657 25757 2215 1 3 . 1 1 107 107 HIS CB C 107 30.575 30.575 30.191 0.384 25757 2216 1 3 . 1 1 107 107 HIS H H 107 7.691 7.691 8.072 -0.381 25757 2217 1 3 . 1 1 108 108 VAL N N 108 118.996 118.996 121.319 -2.323 25757 2218 1 3 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.724 -0.286 25757 2219 1 3 . 1 1 108 108 VAL C C 108 177.998 177.998 178.110 -0.112 25757 2220 1 3 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.582 -0.151 25757 2221 1 3 . 1 1 108 108 VAL CB C 108 31.424 31.424 32.050 -0.626 25757 2222 1 3 . 1 1 108 108 VAL H H 108 7.599 7.599 8.184 -0.585 25757 2223 1 3 . 1 1 109 109 MET N N 109 114.880 114.880 118.293 -3.413 25757 2224 1 3 . 1 1 109 109 MET C C 109 179.119 179.119 178.096 1.023 25757 2225 1 3 . 1 1 109 109 MET CA C 109 56.979 56.979 58.435 -1.456 25757 2226 1 3 . 1 1 109 109 MET CB C 109 29.253 29.253 32.352 -3.099 25757 2227 1 3 . 1 1 109 109 MET H H 109 7.911 7.911 8.282 -0.371 25757 2228 1 3 . 1 1 110 110 THR N N 110 116.943 116.943 116.676 0.267 25757 2229 1 3 . 1 1 110 110 THR HA H 110 4.229 4.229 4.212 0.017 25757 2230 1 3 . 1 1 110 110 THR C C 110 178.506 178.506 177.625 0.881 25757 2231 1 3 . 1 1 110 110 THR CA C 110 66.573 66.573 66.219 0.354 25757 2232 1 3 . 1 1 110 110 THR CB C 110 68.575 68.575 68.553 0.022 25757 2233 1 3 . 1 1 110 110 THR H H 110 8.353 8.353 8.046 0.307 25757 2234 1 3 . 1 1 111 111 ASN N N 111 123.829 123.829 119.701 4.128 25757 2235 1 3 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.441 -0.079 25757 2236 1 3 . 1 1 111 111 ASN C C 111 177.197 177.197 177.137 0.060 25757 2237 1 3 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.799 0.160 25757 2238 1 3 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.449 -1.226 25757 2239 1 3 . 1 1 111 111 ASN H H 111 8.053 8.053 8.102 -0.049 25757 2240 1 3 . 1 1 112 112 LEU N N 112 119.036 119.036 115.947 3.089 25757 2241 1 3 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.020 0.150 25757 2242 1 3 . 1 1 112 112 LEU C C 112 176.377 176.377 177.714 -1.337 25757 2243 1 3 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.296 -0.791 25757 2244 1 3 . 1 1 112 112 LEU CB C 112 42.360 42.360 41.472 0.888 25757 2245 1 3 . 1 1 112 112 LEU H H 112 7.794 7.794 7.395 0.399 25757 2246 1 3 . 1 1 113 113 GLY N N 113 106.045 106.045 104.971 1.074 25757 2247 1 3 . 1 1 113 113 GLY C C 113 174.248 174.248 173.674 0.574 25757 2248 1 3 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.779 0.528 25757 2249 1 3 . 1 1 113 113 GLY H H 113 7.741 7.741 7.976 -0.234 25757 2250 1 3 . 1 1 114 114 GLU N N 114 120.556 120.556 121.418 -0.862 25757 2251 1 3 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.366 -0.056 25757 2252 1 3 . 1 1 114 114 GLU C C 114 174.993 174.993 175.544 -0.551 25757 2253 1 3 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.495 -0.858 25757 2254 1 3 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.213 1.004 25757 2255 1 3 . 1 1 114 114 GLU H H 114 7.980 7.980 7.827 0.153 25757 2256 1 3 . 1 1 115 115 LYS N N 115 124.986 124.986 124.757 0.229 25757 2257 1 3 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.376 -0.042 25757 2258 1 3 . 1 1 115 115 LYS C C 115 175.285 175.285 176.026 -0.741 25757 2259 1 3 . 1 1 115 115 LYS CA C 115 55.581 55.581 55.780 -0.199 25757 2260 1 3 . 1 1 115 115 LYS CB C 115 31.973 31.973 33.109 -1.136 25757 2261 1 3 . 1 1 115 115 LYS H H 115 8.613 8.613 8.494 0.119 25757 2262 1 3 . 1 1 116 116 LEU N N 116 125.243 125.243 123.158 2.085 25757 2263 1 3 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.727 -0.039 25757 2264 1 3 . 1 1 116 116 LEU C C 116 178.365 178.365 176.682 1.683 25757 2265 1 3 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.142 1.206 25757 2266 1 3 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.795 0.494 25757 2267 1 3 . 1 1 116 116 LEU H H 116 8.066 8.066 8.272 -0.206 25757 2268 1 3 . 1 1 117 117 THR N N 117 114.324 114.324 114.405 -0.081 25757 2269 1 3 . 1 1 117 117 THR HA H 117 4.713 4.713 4.610 0.103 25757 2270 1 3 . 1 1 117 117 THR C C 117 175.539 175.539 174.522 1.017 25757 2271 1 3 . 1 1 117 117 THR CA C 117 60.756 60.756 60.832 -0.076 25757 2272 1 3 . 1 1 117 117 THR CB C 117 71.144 71.144 71.562 -0.418 25757 2273 1 3 . 1 1 117 117 THR H H 117 9.228 9.228 8.338 0.890 25757 2274 1 3 . 1 1 118 118 ASP N N 118 121.016 121.016 123.035 -2.019 25757 2275 1 3 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.287 -0.132 25757 2276 1 3 . 1 1 118 118 ASP H H 118 8.919 8.919 8.779 0.140 25757 2277 1 3 . 1 1 119 119 GLU N N 119 121.016 121.016 118.915 2.101 25757 2278 1 3 . 1 1 119 119 GLU C C 119 179.204 179.204 178.685 0.519 25757 2279 1 3 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.037 -0.967 25757 2280 1 3 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.494 -0.450 25757 2281 1 3 . 1 1 119 119 GLU H H 119 8.919 8.919 8.719 0.200 25757 2282 1 3 . 1 1 120 120 GLU N N 120 120.566 120.566 120.591 -0.025 25757 2283 1 3 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.129 -0.128 25757 2284 1 3 . 1 1 120 120 GLU C C 120 180.329 180.329 178.764 1.565 25757 2285 1 3 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.307 -0.216 25757 2286 1 3 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.476 1.162 25757 2287 1 3 . 1 1 120 120 GLU H H 120 7.732 7.732 7.639 0.093 25757 2288 1 3 . 1 1 121 121 VAL N N 121 121.875 121.875 119.605 2.270 25757 2289 1 3 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.485 -0.020 25757 2290 1 3 . 1 1 121 121 VAL C C 121 177.477 177.477 177.985 -0.508 25757 2291 1 3 . 1 1 121 121 VAL CA C 121 67.171 67.171 67.015 0.156 25757 2292 1 3 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.631 -0.197 25757 2293 1 3 . 1 1 121 121 VAL H H 121 8.104 8.104 7.505 0.599 25757 2294 1 3 . 1 1 122 122 ASP N N 122 120.566 120.566 118.985 1.581 25757 2295 1 3 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.314 0.021 25757 2296 1 3 . 1 1 122 122 ASP C C 122 179.298 179.298 178.727 0.571 25757 2297 1 3 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.817 0.022 25757 2298 1 3 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.797 -0.485 25757 2299 1 3 . 1 1 122 122 ASP H H 122 8.089 8.089 8.188 -0.099 25757 2300 1 3 . 1 1 123 123 GLU N N 123 119.821 119.821 120.132 -0.311 25757 2301 1 3 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.030 0.019 25757 2302 1 3 . 1 1 123 123 GLU C C 123 178.749 178.749 179.100 -0.351 25757 2303 1 3 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.509 -0.191 25757 2304 1 3 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.823 -0.437 25757 2305 1 3 . 1 1 123 123 GLU H H 123 8.105 8.105 7.826 0.279 25757 2306 1 3 . 1 1 124 124 MET N N 124 119.288 119.288 118.159 1.129 25757 2307 1 3 . 1 1 124 124 MET C C 124 180.865 180.865 178.929 1.936 25757 2308 1 3 . 1 1 124 124 MET CA C 124 60.684 60.684 59.136 1.548 25757 2309 1 3 . 1 1 124 124 MET CB C 124 33.141 33.141 32.052 1.089 25757 2310 1 3 . 1 1 124 124 MET H H 124 7.726 7.726 8.147 -0.421 25757 2311 1 3 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.014 -0.285 25757 2312 1 3 . 1 1 125 125 ILE C C 125 177.341 177.341 178.009 -0.668 25757 2313 1 3 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.267 0.534 25757 2314 1 3 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.927 -1.362 25757 2315 1 3 . 1 1 126 126 ARG N N 126 118.555 118.555 119.911 -1.356 25757 2316 1 3 . 1 1 126 126 ARG C C 126 179.164 179.164 177.947 1.217 25757 2317 1 3 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.182 0.742 25757 2318 1 3 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.255 -0.390 25757 2319 1 3 . 1 1 126 126 ARG H H 126 8.380 8.380 7.923 0.457 25757 2320 1 3 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.371 -0.446 25757 2321 1 3 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.528 1.529 25757 2322 1 3 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.233 0.595 25757 2323 1 3 . 1 1 128 128 ALA N N 128 116.764 116.764 120.806 -4.042 25757 2324 1 3 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.252 0.165 25757 2325 1 3 . 1 1 128 128 ALA C C 128 177.885 177.885 176.248 1.637 25757 2326 1 3 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.437 -0.482 25757 2327 1 3 . 1 1 128 128 ALA CB C 128 22.567 22.567 20.151 2.416 25757 2328 1 3 . 1 1 128 128 ALA H H 128 7.152 7.152 7.806 -0.654 25757 2329 1 3 . 1 1 129 129 ASP N N 129 117.762 117.762 117.279 0.483 25757 2330 1 3 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.271 -0.794 25757 2331 1 3 . 1 1 129 129 ASP C C 129 175.935 175.935 176.372 -0.437 25757 2332 1 3 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.191 2.324 25757 2333 1 3 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.819 -1.074 25757 2334 1 3 . 1 1 129 129 ASP H H 129 8.007 8.007 7.735 0.272 25757 2335 1 3 . 1 1 130 130 ILE N N 130 128.249 128.249 124.331 3.918 25757 2336 1 3 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.804 0.060 25757 2337 1 3 . 1 1 130 130 ILE C C 130 177.764 177.764 177.343 0.421 25757 2338 1 3 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.961 -0.413 25757 2339 1 3 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.224 0.424 25757 2340 1 3 . 1 1 130 130 ILE H H 130 8.412 8.412 8.928 -0.516 25757 2341 1 3 . 1 1 131 131 ASP N N 131 116.430 116.430 116.481 -0.051 25757 2342 1 3 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.603 -0.069 25757 2343 1 3 . 1 1 131 131 ASP C C 131 178.313 178.313 177.175 1.138 25757 2344 1 3 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.876 -0.992 25757 2345 1 3 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.929 -0.967 25757 2346 1 3 . 1 1 131 131 ASP H H 131 8.254 8.254 8.140 0.114 25757 2347 1 3 . 1 1 132 132 GLY N N 132 108.460 108.460 109.169 -0.709 25757 2348 1 3 . 1 1 132 132 GLY C C 132 175.211 175.211 174.477 0.734 25757 2349 1 3 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.877 1.726 25757 2350 1 3 . 1 1 132 132 GLY H H 132 7.547 7.547 7.918 -0.371 25757 2351 1 3 . 1 1 133 133 ASP N N 133 120.909 120.909 118.583 2.326 25757 2352 1 3 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.540 -0.077 25757 2353 1 3 . 1 1 133 133 ASP C C 133 177.691 177.691 176.890 0.801 25757 2354 1 3 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.940 0.874 25757 2355 1 3 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.180 0.118 25757 2356 1 3 . 1 1 133 133 ASP H H 133 8.339 8.339 8.451 -0.112 25757 2357 1 3 . 1 1 134 134 GLY N N 134 112.704 112.704 107.131 5.573 25757 2358 1 3 . 1 1 134 134 GLY C C 134 172.722 172.722 173.700 -0.978 25757 2359 1 3 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.527 0.510 25757 2360 1 3 . 1 1 134 134 GLY H H 134 10.396 10.396 7.949 2.447 25757 2361 1 3 . 1 1 135 135 GLN N N 135 114.799 114.799 118.296 -3.497 25757 2362 1 3 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.166 -0.302 25757 2363 1 3 . 1 1 135 135 GLN C C 135 174.760 174.760 175.324 -0.564 25757 2364 1 3 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.162 -0.841 25757 2365 1 3 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.517 -0.452 25757 2366 1 3 . 1 1 135 135 GLN H H 135 7.975 7.975 8.575 -0.600 25757 2367 1 3 . 1 1 136 136 VAL N N 136 125.364 125.364 125.187 0.177 25757 2368 1 3 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.588 0.620 25757 2369 1 3 . 1 1 136 136 VAL C C 136 175.831 175.831 175.081 0.750 25757 2370 1 3 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.695 0.122 25757 2371 1 3 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.549 0.125 25757 2372 1 3 . 1 1 136 136 VAL H H 136 9.169 9.169 9.214 -0.045 25757 2373 1 3 . 1 1 137 137 ASN N N 137 129.155 129.155 124.210 4.945 25757 2374 1 3 . 1 1 137 137 ASN C C 137 174.737 174.737 175.432 -0.695 25757 2375 1 3 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.577 0.774 25757 2376 1 3 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.208 -2.885 25757 2377 1 3 . 1 1 137 137 ASN H H 137 9.652 9.652 8.315 1.337 25757 2378 1 3 . 1 1 138 138 TYR N N 138 118.504 118.504 122.361 -3.857 25757 2379 1 3 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.619 -0.340 25757 2380 1 3 . 1 1 138 138 TYR C C 138 176.174 176.174 176.821 -0.647 25757 2381 1 3 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.150 1.424 25757 2382 1 3 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.048 -0.318 25757 2383 1 3 . 1 1 138 138 TYR H H 138 8.460 8.460 8.593 -0.133 25757 2384 1 3 . 1 1 139 139 GLU N N 139 118.644 118.644 117.214 1.430 25757 2385 1 3 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.634 -0.086 25757 2386 1 3 . 1 1 139 139 GLU C C 139 180.265 180.265 178.161 2.104 25757 2387 1 3 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.588 0.898 25757 2388 1 3 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.418 0.573 25757 2389 1 3 . 1 1 139 139 GLU H H 139 8.136 8.136 8.724 -0.588 25757 2390 1 3 . 1 1 140 140 GLU N N 140 120.030 120.030 116.551 3.479 25757 2391 1 3 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.147 -0.259 25757 2392 1 3 . 1 1 140 140 GLU C C 140 179.627 179.627 177.691 1.936 25757 2393 1 3 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.467 1.210 25757 2394 1 3 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.665 0.062 25757 2395 1 3 . 1 1 140 140 GLU H H 140 8.798 8.798 8.274 0.524 25757 2396 1 3 . 1 1 141 141 PHE N N 141 123.154 123.154 121.330 1.824 25757 2397 1 3 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.974 -0.277 25757 2398 1 3 . 1 1 141 141 PHE C C 141 176.952 176.952 177.948 -0.996 25757 2399 1 3 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.559 1.493 25757 2400 1 3 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.770 0.361 25757 2401 1 3 . 1 1 141 141 PHE H H 141 8.633 8.633 7.826 0.807 25757 2402 1 3 . 1 1 142 142 VAL N N 142 120.046 120.046 117.558 2.488 25757 2403 1 3 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.646 -0.690 25757 2404 1 3 . 1 1 142 142 VAL C C 142 179.627 179.627 177.481 2.146 25757 2405 1 3 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.409 1.834 25757 2406 1 3 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.345 0.795 25757 2407 1 3 . 1 1 142 142 VAL H H 142 8.894 8.894 8.267 0.627 25757 2408 1 3 . 1 1 143 143 GLN N N 143 118.996 118.996 120.231 -1.235 25757 2409 1 3 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.975 -0.199 25757 2410 1 3 . 1 1 143 143 GLN C C 143 178.443 178.443 177.919 0.524 25757 2411 1 3 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.425 0.704 25757 2412 1 3 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.047 -0.304 25757 2413 1 3 . 1 1 143 143 GLN H H 143 7.627 7.627 7.916 -0.289 25757 2414 1 3 . 1 1 144 144 MET N N 144 116.361 116.361 118.285 -1.924 25757 2415 1 3 . 1 1 144 144 MET HA H 144 4.169 4.169 4.057 0.112 25757 2416 1 3 . 1 1 144 144 MET C C 144 178.418 178.418 177.074 1.344 25757 2417 1 3 . 1 1 144 144 MET CA C 144 56.137 56.137 57.803 -1.666 25757 2418 1 3 . 1 1 144 144 MET CB C 144 31.095 31.095 32.384 -1.289 25757 2419 1 3 . 1 1 144 144 MET H H 144 7.179 7.179 7.296 -0.117 25757 2420 1 3 . 1 1 145 145 MET N N 145 115.373 115.373 116.921 -1.548 25757 2421 1 3 . 1 1 145 145 MET HA H 145 4.334 4.334 4.528 -0.194 25757 2422 1 3 . 1 1 145 145 MET C C 145 177.217 177.217 175.685 1.532 25757 2423 1 3 . 1 1 145 145 MET CA C 145 55.296 55.296 55.265 0.031 25757 2424 1 3 . 1 1 145 145 MET CB C 145 34.458 34.458 33.934 0.524 25757 2425 1 3 . 1 1 145 145 MET H H 145 7.776 7.776 7.704 0.072 25757 2426 1 3 . 1 1 146 146 THR N N 146 107.988 107.988 112.892 -4.904 25757 2427 1 3 . 1 1 146 146 THR HA H 146 4.239 4.239 4.424 -0.185 25757 2428 1 3 . 1 1 146 146 THR C C 146 175.378 175.378 174.919 0.459 25757 2429 1 3 . 1 1 146 146 THR CA C 146 61.625 61.625 61.713 -0.088 25757 2430 1 3 . 1 1 146 146 THR CB C 146 70.817 70.817 68.343 2.474 25757 2431 1 3 . 1 1 146 146 THR H H 146 7.736 7.736 7.760 -0.024 25757 2432 1 3 . 1 1 147 147 GLY N N 147 110.157 110.157 110.294 -0.137 25757 2433 1 3 . 1 1 147 147 GLY C C 147 174.046 174.046 174.136 -0.090 25757 2434 1 3 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.773 0.771 25757 2435 1 3 . 1 1 147 147 GLY H H 147 7.793 7.793 8.172 -0.379 25757 2436 1 3 . 1 1 150 150 THR HA H 150 4.239 4.239 4.390 -0.151 25757 2437 1 3 . 1 1 150 150 THR C C 150 174.397 174.397 174.251 0.146 25757 2438 1 3 . 1 1 150 150 THR CA C 150 61.260 61.260 62.285 -1.024 25757 2439 1 3 . 1 1 150 150 THR CB C 150 70.358 70.358 69.347 1.011 25757 2440 1 3 . 1 1 151 151 ALA N N 151 126.304 126.304 123.753 2.551 25757 2441 1 3 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.439 -0.151 25757 2442 1 3 . 1 1 151 151 ALA C C 151 177.678 177.678 177.742 -0.064 25757 2443 1 3 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.405 0.743 25757 2444 1 3 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.834 -0.415 25757 2445 1 3 . 1 1 151 151 ALA H H 151 8.618 8.618 7.010 1.608 25757 2446 1 3 . 1 1 152 152 ALA N N 152 123.861 123.861 121.541 2.320 25757 2447 1 3 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.339 -0.221 25757 2448 1 3 . 1 1 152 152 ALA C C 152 178.823 178.823 178.244 0.579 25757 2449 1 3 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.438 2.056 25757 2450 1 3 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.205 0.552 25757 2451 1 3 . 1 1 152 152 ALA H H 152 8.354 8.354 8.729 -0.375 25757 2452 1 3 . 1 1 153 153 GLY N N 153 109.984 109.984 107.528 2.456 25757 2453 1 3 . 1 1 153 153 GLY C C 153 174.389 174.389 175.767 -1.378 25757 2454 1 3 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.168 -2.037 25757 2455 1 3 . 1 1 153 153 GLY H H 153 9.028 9.028 8.280 0.748 25757 2456 1 3 . 1 1 154 154 SER N N 154 113.934 113.934 117.857 -3.923 25757 2457 1 3 . 1 1 154 154 SER HA H 154 4.255 4.255 4.044 0.211 25757 2458 1 3 . 1 1 154 154 SER C C 154 177.929 177.929 176.854 1.075 25757 2459 1 3 . 1 1 154 154 SER CA C 154 59.379 59.379 62.716 -3.337 25757 2460 1 3 . 1 1 154 154 SER CB C 154 64.090 64.090 62.523 1.567 25757 2461 1 3 . 1 1 154 154 SER H H 154 7.962 7.962 8.103 -0.141 25757 2462 1 3 . 1 1 155 155 GLY N N 155 115.337 115.337 108.739 6.598 25757 2463 1 3 . 1 1 155 155 GLY C C 155 175.891 175.891 175.576 0.315 25757 2464 1 3 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.801 0.845 25757 2465 1 3 . 1 1 155 155 GLY H H 155 9.451 9.451 7.667 1.784 25757 2466 1 3 . 1 1 156 156 TRP N N 156 119.600 119.600 121.806 -2.206 25757 2467 1 3 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.332 -0.061 25757 2468 1 3 . 1 1 156 156 TRP C C 156 178.947 178.947 179.169 -0.222 25757 2469 1 3 . 1 1 156 156 TRP CA C 156 60.164 60.164 59.732 0.432 25757 2470 1 3 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.078 0.525 25757 2471 1 3 . 1 1 156 156 TRP H H 156 8.542 8.542 7.365 1.177 25757 2472 1 3 . 1 1 157 157 ARG N N 157 118.583 118.583 120.085 -1.502 25757 2473 1 3 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.046 -0.064 25757 2474 1 3 . 1 1 157 157 ARG C C 157 177.894 177.894 178.294 -0.400 25757 2475 1 3 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.514 -0.176 25757 2476 1 3 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.819 0.238 25757 2477 1 3 . 1 1 157 157 ARG H H 157 7.747 7.747 8.435 -0.688 25757 2478 1 3 . 1 1 158 158 LYS N N 158 117.033 117.033 120.338 -3.305 25757 2479 1 3 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.986 -0.043 25757 2480 1 3 . 1 1 158 158 LYS C C 158 176.973 176.973 179.123 -2.150 25757 2481 1 3 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.558 0.816 25757 2482 1 3 . 1 1 158 158 LYS CB C 158 32.291 32.291 31.884 0.407 25757 2483 1 3 . 1 1 158 158 LYS H H 158 7.529 7.529 8.059 -0.529 25757 2484 1 3 . 1 1 159 159 ILE N N 159 116.553 116.553 120.778 -4.225 25757 2485 1 3 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.796 -0.252 25757 2486 1 3 . 1 1 159 159 ILE C C 159 176.894 176.894 177.212 -0.318 25757 2487 1 3 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.559 0.957 25757 2488 1 3 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.047 -0.243 25757 2489 1 3 . 1 1 159 159 ILE H H 159 7.348 7.348 8.291 -0.943 25757 2490 1 3 . 1 1 160 160 LYS N N 160 119.278 119.278 120.641 -1.363 25757 2491 1 3 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.283 -0.244 25757 2492 1 3 . 1 1 160 160 LYS C C 160 178.566 178.566 179.199 -0.633 25757 2493 1 3 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.930 0.444 25757 2494 1 3 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.412 0.406 25757 2495 1 3 . 1 1 160 160 LYS H H 160 8.225 8.225 7.895 0.330 25757 2496 1 3 . 1 1 161 161 LEU N N 161 117.056 117.056 120.009 -2.953 25757 2497 1 3 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.103 -0.043 25757 2498 1 3 . 1 1 161 161 LEU C C 161 178.977 178.977 178.734 0.243 25757 2499 1 3 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.806 0.218 25757 2500 1 3 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.552 0.430 25757 2501 1 3 . 1 1 161 161 LEU H H 161 8.057 8.057 8.467 -0.410 25757 2502 1 3 . 1 1 162 162 ALA N N 162 121.814 121.814 121.909 -0.095 25757 2503 1 3 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.102 -0.010 25757 2504 1 3 . 1 1 162 162 ALA C C 162 178.374 178.374 179.944 -1.570 25757 2505 1 3 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.401 0.389 25757 2506 1 3 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.470 -0.145 25757 2507 1 3 . 1 1 162 162 ALA H H 162 8.170 8.170 8.242 -0.072 25757 2508 1 3 . 1 1 163 163 VAL N N 163 115.449 115.449 114.082 1.367 25757 2509 1 3 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.788 -0.170 25757 2510 1 3 . 1 1 163 163 VAL C C 163 178.362 178.362 177.732 0.630 25757 2511 1 3 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.674 0.598 25757 2512 1 3 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.385 0.652 25757 2513 1 3 . 1 1 163 163 VAL H H 163 8.499 8.499 8.227 0.272 25757 2514 1 3 . 1 1 164 164 ARG N N 164 115.775 115.775 120.501 -4.726 25757 2515 1 3 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.185 0.012 25757 2516 1 3 . 1 1 164 164 ARG C C 164 178.938 178.938 178.655 0.283 25757 2517 1 3 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.005 -1.322 25757 2518 1 3 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.462 -0.628 25757 2519 1 3 . 1 1 164 164 ARG H H 164 8.165 8.165 8.083 0.082 25757 2520 1 3 . 1 1 165 165 GLY N N 165 105.570 105.570 105.981 -0.411 25757 2521 1 3 . 1 1 165 165 GLY C C 165 173.134 173.134 175.241 -2.107 25757 2522 1 3 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.554 1.188 25757 2523 1 3 . 1 1 165 165 GLY H H 165 8.455 8.455 8.421 0.034 25757 2524 1 3 . 1 1 166 166 ALA N N 166 120.648 120.648 123.692 -3.044 25757 2525 1 3 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.199 0.143 25757 2526 1 3 . 1 1 166 166 ALA C C 166 176.155 176.155 177.746 -1.591 25757 2527 1 3 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.010 -2.237 25757 2528 1 3 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.119 0.359 25757 2529 1 3 . 1 1 166 166 ALA H H 166 7.826 7.826 7.783 0.043 25757 2530 1 3 . 1 1 167 167 GLN N N 167 117.315 117.315 117.327 -0.012 25757 2531 1 3 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.432 -0.155 25757 2532 1 3 . 1 1 167 167 GLN C C 167 175.571 175.571 175.416 0.155 25757 2533 1 3 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.792 1.135 25757 2534 1 3 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.762 0.423 25757 2535 1 3 . 1 1 167 167 GLN H H 167 7.498 7.498 7.623 -0.125 25757 2536 1 3 . 1 1 168 168 ALA N N 168 126.706 126.706 128.349 -1.643 25757 2537 1 3 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.076 0.203 25757 2538 1 3 . 1 1 168 168 ALA C C 168 177.227 177.227 177.127 0.100 25757 2539 1 3 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.254 -2.188 25757 2540 1 3 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.346 0.360 25757 2541 1 3 . 1 1 168 168 ALA H H 168 8.534 8.534 8.663 -0.129 25757 2542 1 4 . 1 1 9 9 ILE N N 9 116.733 116.733 121.251 -4.518 25757 2543 1 4 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.896 -0.139 25757 2544 1 4 . 1 1 9 9 ILE C C 9 177.828 177.828 177.387 0.441 25757 2545 1 4 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.988 2.616 25757 2546 1 4 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.441 0.156 25757 2547 1 4 . 1 1 9 9 ILE H H 9 7.366 7.366 8.216 -0.850 25757 2548 1 4 . 1 1 10 10 ALA N N 10 121.080 121.080 122.497 -1.417 25757 2549 1 4 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.018 0.057 25757 2550 1 4 . 1 1 10 10 ALA C C 10 180.921 180.921 179.635 1.286 25757 2551 1 4 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.241 0.362 25757 2552 1 4 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.945 0.039 25757 2553 1 4 . 1 1 10 10 ALA H H 10 8.039 8.039 8.320 -0.281 25757 2554 1 4 . 1 1 11 11 GLU N N 11 119.580 119.580 119.272 0.308 25757 2555 1 4 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.982 0.107 25757 2556 1 4 . 1 1 11 11 GLU C C 11 179.561 179.561 178.990 0.571 25757 2557 1 4 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.329 0.556 25757 2558 1 4 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.931 0.532 25757 2559 1 4 . 1 1 11 11 GLU H H 11 7.741 7.741 7.572 0.169 25757 2560 1 4 . 1 1 12 12 PHE N N 12 118.509 118.509 117.886 0.623 25757 2561 1 4 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.372 0.454 25757 2562 1 4 . 1 1 12 12 PHE C C 12 179.000 179.000 178.482 0.518 25757 2563 1 4 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.681 0.484 25757 2564 1 4 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.886 0.224 25757 2565 1 4 . 1 1 12 12 PHE H H 12 8.470 8.470 7.389 1.081 25757 2566 1 4 . 1 1 13 13 LYS N N 13 123.523 123.523 119.860 3.663 25757 2567 1 4 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.164 -0.138 25757 2568 1 4 . 1 1 13 13 LYS C C 13 179.260 179.260 179.255 0.005 25757 2569 1 4 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.942 0.222 25757 2570 1 4 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.226 -0.393 25757 2571 1 4 . 1 1 13 13 LYS H H 13 9.171 9.171 8.624 0.547 25757 2572 1 4 . 1 1 14 14 GLU N N 14 120.415 120.415 118.936 1.479 25757 2573 1 4 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.237 -0.142 25757 2574 1 4 . 1 1 14 14 GLU C C 14 179.851 179.851 178.897 0.954 25757 2575 1 4 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.121 0.465 25757 2576 1 4 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.759 -0.198 25757 2577 1 4 . 1 1 14 14 GLU H H 14 7.822 7.822 8.117 -0.295 25757 2578 1 4 . 1 1 15 15 ALA N N 15 122.143 122.143 122.590 -0.447 25757 2579 1 4 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.255 -0.125 25757 2580 1 4 . 1 1 15 15 ALA C C 15 178.222 178.222 179.767 -1.545 25757 2581 1 4 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.411 -0.222 25757 2582 1 4 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.812 -0.310 25757 2583 1 4 . 1 1 15 15 ALA H H 15 8.244 8.244 8.375 -0.131 25757 2584 1 4 . 1 1 16 16 PHE N N 16 119.809 119.809 118.486 1.323 25757 2585 1 4 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.246 -0.234 25757 2586 1 4 . 1 1 16 16 PHE C C 16 177.444 177.444 177.027 0.417 25757 2587 1 4 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.163 1.901 25757 2588 1 4 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.078 -0.646 25757 2589 1 4 . 1 1 16 16 PHE H H 16 8.891 8.891 8.618 0.273 25757 2590 1 4 . 1 1 17 17 SER N N 17 112.631 112.631 116.230 -3.599 25757 2591 1 4 . 1 1 17 17 SER HA H 17 4.034 4.034 3.897 0.137 25757 2592 1 4 . 1 1 17 17 SER C C 17 174.675 174.675 176.189 -1.514 25757 2593 1 4 . 1 1 17 17 SER CA C 17 61.507 61.507 61.553 -0.046 25757 2594 1 4 . 1 1 17 17 SER CB C 17 63.414 63.414 63.474 -0.060 25757 2595 1 4 . 1 1 17 17 SER H H 17 7.910 7.910 8.392 -0.482 25757 2596 1 4 . 1 1 18 18 LEU N N 18 120.614 120.614 117.072 3.542 25757 2597 1 4 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.207 -0.195 25757 2598 1 4 . 1 1 18 18 LEU C C 18 177.366 177.366 177.939 -0.573 25757 2599 1 4 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.328 0.058 25757 2600 1 4 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.831 -0.235 25757 2601 1 4 . 1 1 18 18 LEU H H 18 7.423 7.423 7.896 -0.473 25757 2602 1 4 . 1 1 19 19 PHE N N 19 114.602 114.602 117.752 -3.150 25757 2603 1 4 . 1 1 19 19 PHE C C 19 176.961 176.961 175.687 1.274 25757 2604 1 4 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.375 -0.891 25757 2605 1 4 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.559 1.210 25757 2606 1 4 . 1 1 19 19 PHE H H 19 7.254 7.254 7.099 0.155 25757 2607 1 4 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.616 -0.041 25757 2608 1 4 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.247 -1.599 25757 2609 1 4 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.791 -0.781 25757 2610 1 4 . 1 1 23 23 GLY N N 23 108.244 108.244 109.214 -0.970 25757 2611 1 4 . 1 1 23 23 GLY C C 23 175.188 175.188 174.804 0.384 25757 2612 1 4 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.159 1.244 25757 2613 1 4 . 1 1 23 23 GLY H H 23 7.555 7.555 7.603 -0.048 25757 2614 1 4 . 1 1 24 24 ASP N N 24 120.667 120.667 120.041 0.626 25757 2615 1 4 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.572 -0.103 25757 2616 1 4 . 1 1 24 24 ASP C C 24 177.457 177.457 177.843 -0.386 25757 2617 1 4 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.437 0.355 25757 2618 1 4 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.721 -1.205 25757 2619 1 4 . 1 1 24 24 ASP H H 24 8.397 8.397 8.435 -0.038 25757 2620 1 4 . 1 1 25 25 GLY N N 25 112.989 112.989 108.895 4.094 25757 2621 1 4 . 1 1 25 25 GLY C C 25 173.639 173.639 173.427 0.212 25757 2622 1 4 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.199 0.302 25757 2623 1 4 . 1 1 25 25 GLY H H 25 10.592 10.592 8.398 2.194 25757 2624 1 4 . 1 1 26 26 THR N N 26 112.948 112.948 112.649 0.299 25757 2625 1 4 . 1 1 26 26 THR HA H 26 5.282 5.282 5.056 0.226 25757 2626 1 4 . 1 1 26 26 THR C C 26 172.853 172.853 172.709 0.144 25757 2627 1 4 . 1 1 26 26 THR CA C 26 59.817 59.817 61.422 -1.605 25757 2628 1 4 . 1 1 26 26 THR CB C 26 72.465 72.465 71.169 1.296 25757 2629 1 4 . 1 1 26 26 THR H H 26 8.121 8.121 8.248 -0.127 25757 2630 1 4 . 1 1 27 27 ILE N N 27 127.195 127.195 123.932 3.263 25757 2631 1 4 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.673 0.240 25757 2632 1 4 . 1 1 27 27 ILE C C 27 176.091 176.091 174.842 1.249 25757 2633 1 4 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.402 0.363 25757 2634 1 4 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.650 -1.945 25757 2635 1 4 . 1 1 27 27 ILE H H 27 9.867 9.867 8.561 1.306 25757 2636 1 4 . 1 1 28 28 THR N N 28 116.655 116.655 120.010 -3.355 25757 2637 1 4 . 1 1 28 28 THR HA H 28 4.790 4.790 4.786 0.004 25757 2638 1 4 . 1 1 28 28 THR C C 28 176.696 176.696 176.179 0.517 25757 2639 1 4 . 1 1 28 28 THR CA C 28 59.590 59.590 59.633 -0.043 25757 2640 1 4 . 1 1 28 28 THR CB C 28 72.457 72.457 70.762 1.695 25757 2641 1 4 . 1 1 28 28 THR H H 28 8.457 8.457 8.704 -0.247 25757 2642 1 4 . 1 1 29 29 THR N N 29 111.878 111.878 117.420 -5.542 25757 2643 1 4 . 1 1 29 29 THR HA H 29 4.188 4.188 3.978 0.210 25757 2644 1 4 . 1 1 29 29 THR C C 29 177.399 177.399 176.357 1.042 25757 2645 1 4 . 1 1 29 29 THR CA C 29 66.386 66.386 66.584 -0.198 25757 2646 1 4 . 1 1 29 29 THR CB C 29 67.726 67.726 68.498 -0.772 25757 2647 1 4 . 1 1 29 29 THR H H 29 9.211 9.211 8.954 0.257 25757 2648 1 4 . 1 1 30 30 LYS N N 30 121.140 121.140 120.479 0.661 25757 2649 1 4 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.992 0.085 25757 2650 1 4 . 1 1 30 30 LYS C C 30 179.793 179.793 179.019 0.774 25757 2651 1 4 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.377 -0.085 25757 2652 1 4 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.936 0.511 25757 2653 1 4 . 1 1 30 30 LYS H H 30 7.580 7.580 7.884 -0.304 25757 2654 1 4 . 1 1 31 31 GLU N N 31 121.865 121.865 119.721 2.144 25757 2655 1 4 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.088 -0.094 25757 2656 1 4 . 1 1 31 31 GLU C C 31 179.355 179.355 179.022 0.333 25757 2657 1 4 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.660 -0.027 25757 2658 1 4 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.430 0.422 25757 2659 1 4 . 1 1 31 31 GLU H H 31 7.708 7.708 7.536 0.172 25757 2660 1 4 . 1 1 32 32 LEU N N 32 120.597 120.597 117.491 3.106 25757 2661 1 4 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.130 -0.014 25757 2662 1 4 . 1 1 32 32 LEU C C 32 178.885 178.885 179.119 -0.234 25757 2663 1 4 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.404 -0.043 25757 2664 1 4 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.164 1.872 25757 2665 1 4 . 1 1 32 32 LEU H H 32 8.688 8.688 7.833 0.855 25757 2666 1 4 . 1 1 33 33 GLY N N 33 104.837 104.837 107.843 -3.006 25757 2667 1 4 . 1 1 33 33 GLY C C 33 175.123 175.123 175.901 -0.778 25757 2668 1 4 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.681 0.566 25757 2669 1 4 . 1 1 33 33 GLY H H 33 8.694 8.694 8.669 0.025 25757 2670 1 4 . 1 1 34 34 THR N N 34 117.631 117.631 119.230 -1.599 25757 2671 1 4 . 1 1 34 34 THR HA H 34 3.899 3.899 3.945 -0.046 25757 2672 1 4 . 1 1 34 34 THR C C 34 176.951 176.951 176.710 0.241 25757 2673 1 4 . 1 1 34 34 THR CA C 34 67.234 67.234 67.425 -0.191 25757 2674 1 4 . 1 1 34 34 THR CB C 34 68.863 68.863 68.639 0.224 25757 2675 1 4 . 1 1 34 34 THR H H 34 7.960 7.960 7.947 0.013 25757 2676 1 4 . 1 1 35 35 VAL N N 35 121.659 121.659 121.832 -0.173 25757 2677 1 4 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.552 -0.035 25757 2678 1 4 . 1 1 35 35 VAL C C 35 178.265 178.265 177.326 0.939 25757 2679 1 4 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.122 0.553 25757 2680 1 4 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.376 -0.083 25757 2681 1 4 . 1 1 35 35 VAL H H 35 7.358 7.358 7.760 -0.402 25757 2682 1 4 . 1 1 36 36 MET N N 36 117.456 117.456 114.090 3.366 25757 2683 1 4 . 1 1 36 36 MET C C 36 179.088 179.088 178.263 0.825 25757 2684 1 4 . 1 1 36 36 MET CA C 36 60.477 60.477 57.727 2.750 25757 2685 1 4 . 1 1 36 36 MET CB C 36 32.443 32.443 32.761 -0.318 25757 2686 1 4 . 1 1 36 36 MET H H 36 8.194 8.194 7.934 0.260 25757 2687 1 4 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.955 0.192 25757 2688 1 4 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.290 0.060 25757 2689 1 4 . 1 1 38 38 SER HA H 38 4.085 4.085 4.362 -0.277 25757 2690 1 4 . 1 1 38 38 SER C C 38 173.788 173.788 174.308 -0.520 25757 2691 1 4 . 1 1 38 38 SER CA C 38 61.617 61.617 60.285 1.332 25757 2692 1 4 . 1 1 38 38 SER CB C 38 62.943 62.943 63.074 -0.131 25757 2693 1 4 . 1 1 39 39 LEU N N 39 119.003 119.003 120.133 -1.130 25757 2694 1 4 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.495 -0.001 25757 2695 1 4 . 1 1 39 39 LEU C C 39 176.470 176.470 176.927 -0.457 25757 2696 1 4 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.240 0.439 25757 2697 1 4 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.237 0.277 25757 2698 1 4 . 1 1 39 39 LEU H H 39 7.230 7.230 7.209 0.021 25757 2699 1 4 . 1 1 40 40 GLY N N 40 105.026 105.026 106.955 -1.929 25757 2700 1 4 . 1 1 40 40 GLY C C 40 174.322 174.322 174.718 -0.396 25757 2701 1 4 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.444 0.771 25757 2702 1 4 . 1 1 40 40 GLY H H 40 7.698 7.698 7.646 0.052 25757 2703 1 4 . 1 1 41 41 GLN N N 41 117.929 117.929 118.341 -0.412 25757 2704 1 4 . 1 1 41 41 GLN C C 41 174.557 174.557 174.557 0.000 25757 2705 1 4 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.720 -0.876 25757 2706 1 4 . 1 1 41 41 GLN H H 41 7.866 7.866 7.843 0.023 25757 2707 1 4 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.590 0.146 25757 2708 1 4 . 1 1 43 43 PRO C C 43 177.805 177.805 176.184 1.621 25757 2709 1 4 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.186 -0.681 25757 2710 1 4 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.325 -0.163 25757 2711 1 4 . 1 1 44 44 THR N N 44 113.167 113.167 117.207 -4.040 25757 2712 1 4 . 1 1 44 44 THR HA H 44 4.684 4.684 4.539 0.145 25757 2713 1 4 . 1 1 44 44 THR C C 44 175.139 175.139 175.721 -0.582 25757 2714 1 4 . 1 1 44 44 THR CA C 44 60.556 60.556 58.947 1.609 25757 2715 1 4 . 1 1 44 44 THR CB C 44 71.064 71.064 70.393 0.671 25757 2716 1 4 . 1 1 44 44 THR H H 44 8.798 8.798 7.825 0.973 25757 2717 1 4 . 1 1 45 45 GLU N N 45 120.673 120.673 121.545 -0.872 25757 2718 1 4 . 1 1 45 45 GLU HA H 45 3.991 3.991 4.038 -0.047 25757 2719 1 4 . 1 1 45 45 GLU C C 45 178.940 178.940 178.072 0.868 25757 2720 1 4 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.976 -0.075 25757 2721 1 4 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.648 -0.619 25757 2722 1 4 . 1 1 45 45 GLU H H 45 8.812 8.812 8.997 -0.185 25757 2723 1 4 . 1 1 46 46 ALA N N 46 120.576 120.576 122.065 -1.489 25757 2724 1 4 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.080 -0.113 25757 2725 1 4 . 1 1 46 46 ALA C C 46 180.290 180.290 179.707 0.583 25757 2726 1 4 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.186 -0.267 25757 2727 1 4 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.140 0.021 25757 2728 1 4 . 1 1 46 46 ALA H H 46 8.276 8.276 8.076 0.200 25757 2729 1 4 . 1 1 47 47 GLU N N 47 116.104 116.104 119.248 -3.144 25757 2730 1 4 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.062 -0.062 25757 2731 1 4 . 1 1 47 47 GLU C C 47 180.224 180.224 178.773 1.451 25757 2732 1 4 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.394 -0.463 25757 2733 1 4 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.217 0.772 25757 2734 1 4 . 1 1 47 47 GLU H H 47 7.425 7.425 8.406 -0.981 25757 2735 1 4 . 1 1 48 48 LEU N N 48 120.425 120.425 119.788 0.637 25757 2736 1 4 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.937 0.113 25757 2737 1 4 . 1 1 48 48 LEU C C 48 178.551 178.551 179.359 -0.808 25757 2738 1 4 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.116 -0.277 25757 2739 1 4 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.381 1.188 25757 2740 1 4 . 1 1 48 48 LEU H H 48 8.121 8.121 7.594 0.527 25757 2741 1 4 . 1 1 49 49 GLN N N 49 118.372 118.372 117.599 0.773 25757 2742 1 4 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.923 -0.161 25757 2743 1 4 . 1 1 49 49 GLN C C 49 178.567 178.567 178.760 -0.193 25757 2744 1 4 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.002 -0.139 25757 2745 1 4 . 1 1 49 49 GLN CB C 49 28.242 28.242 27.976 0.266 25757 2746 1 4 . 1 1 49 49 GLN H H 49 8.302 8.302 8.224 0.078 25757 2747 1 4 . 1 1 50 50 ASP N N 50 119.992 119.992 120.749 -0.757 25757 2748 1 4 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.391 -0.031 25757 2749 1 4 . 1 1 50 50 ASP C C 50 178.600 178.600 178.435 0.165 25757 2750 1 4 . 1 1 50 50 ASP CA C 50 57.703 57.703 56.841 0.862 25757 2751 1 4 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.720 -0.253 25757 2752 1 4 . 1 1 50 50 ASP H H 50 8.150 8.150 8.216 -0.066 25757 2753 1 4 . 1 1 51 51 MET N N 51 119.238 119.238 119.483 -0.245 25757 2754 1 4 . 1 1 51 51 MET HA H 51 3.981 3.981 3.994 -0.013 25757 2755 1 4 . 1 1 51 51 MET C C 51 179.006 179.006 178.417 0.589 25757 2756 1 4 . 1 1 51 51 MET CA C 51 59.443 59.443 58.819 0.625 25757 2757 1 4 . 1 1 51 51 MET CB C 51 33.380 33.380 32.545 0.835 25757 2758 1 4 . 1 1 51 51 MET H H 51 7.844 7.844 7.981 -0.137 25757 2759 1 4 . 1 1 52 52 ILE N N 52 118.161 118.161 118.084 0.077 25757 2760 1 4 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.593 -0.115 25757 2761 1 4 . 1 1 52 52 ILE C C 52 177.847 177.847 178.635 -0.788 25757 2762 1 4 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.680 0.315 25757 2763 1 4 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.472 0.651 25757 2764 1 4 . 1 1 52 52 ILE H H 52 7.686 7.686 8.287 -0.601 25757 2765 1 4 . 1 1 53 53 ASN N N 53 117.884 117.884 117.259 0.625 25757 2766 1 4 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.384 -0.019 25757 2767 1 4 . 1 1 53 53 ASN C C 53 177.515 177.515 176.570 0.945 25757 2768 1 4 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.716 0.491 25757 2769 1 4 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.536 -0.458 25757 2770 1 4 . 1 1 53 53 ASN H H 53 8.713 8.713 8.241 0.472 25757 2771 1 4 . 1 1 54 54 GLU N N 54 116.178 116.178 118.121 -1.943 25757 2772 1 4 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.266 -0.277 25757 2773 1 4 . 1 1 54 54 GLU C C 54 177.557 177.557 177.564 -0.007 25757 2774 1 4 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.630 1.360 25757 2775 1 4 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.311 0.152 25757 2776 1 4 . 1 1 54 54 GLU H H 54 7.530 7.530 8.048 -0.518 25757 2777 1 4 . 1 1 55 55 VAL N N 55 107.164 107.164 112.172 -5.008 25757 2778 1 4 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.280 0.242 25757 2779 1 4 . 1 1 55 55 VAL C C 55 175.602 175.602 174.696 0.906 25757 2780 1 4 . 1 1 55 55 VAL CA C 55 60.352 60.352 61.215 -0.863 25757 2781 1 4 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.384 0.219 25757 2782 1 4 . 1 1 55 55 VAL H H 55 7.175 7.175 7.623 -0.448 25757 2783 1 4 . 1 1 56 56 ASP N N 56 122.126 122.126 120.777 1.349 25757 2784 1 4 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.126 -0.527 25757 2785 1 4 . 1 1 56 56 ASP C C 56 176.182 176.182 175.999 0.183 25757 2786 1 4 . 1 1 56 56 ASP CA C 56 53.806 53.806 52.965 0.841 25757 2787 1 4 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.204 -1.934 25757 2788 1 4 . 1 1 56 56 ASP H H 56 7.569 7.569 7.339 0.230 25757 2789 1 4 . 1 1 57 57 ALA N N 57 103.782 103.782 128.749 -24.967 25757 2790 1 4 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.258 -0.078 25757 2791 1 4 . 1 1 57 57 ALA C C 57 178.584 178.584 177.861 0.723 25757 2792 1 4 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.568 0.776 25757 2793 1 4 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.345 0.179 25757 2794 1 4 . 1 1 57 57 ALA H H 57 8.515 8.515 8.521 -0.006 25757 2795 1 4 . 1 1 58 58 ASP N N 58 113.602 113.602 118.728 -5.126 25757 2796 1 4 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.585 0.001 25757 2797 1 4 . 1 1 58 58 ASP C C 58 177.756 177.756 176.930 0.826 25757 2798 1 4 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.209 -1.447 25757 2799 1 4 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.250 -1.572 25757 2800 1 4 . 1 1 58 58 ASP H H 58 8.130 8.130 7.868 0.262 25757 2801 1 4 . 1 1 59 59 GLY N N 59 109.195 109.195 108.899 0.296 25757 2802 1 4 . 1 1 59 59 GLY C C 59 175.139 175.139 175.101 0.038 25757 2803 1 4 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.639 1.625 25757 2804 1 4 . 1 1 59 59 GLY H H 59 7.694 7.694 8.518 -0.824 25757 2805 1 4 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.657 -0.052 25757 2806 1 4 . 1 1 61 61 GLY N N 61 113.316 113.316 110.457 2.859 25757 2807 1 4 . 1 1 61 61 GLY C C 61 173.234 173.234 172.912 0.322 25757 2808 1 4 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.107 0.591 25757 2809 1 4 . 1 1 61 61 GLY H H 61 10.633 10.633 8.448 2.185 25757 2810 1 4 . 1 1 62 62 THR N N 62 108.892 108.892 111.535 -2.643 25757 2811 1 4 . 1 1 62 62 THR HA H 62 4.736 4.736 4.701 0.035 25757 2812 1 4 . 1 1 62 62 THR C C 62 173.091 173.091 173.205 -0.114 25757 2813 1 4 . 1 1 62 62 THR CA C 62 59.617 59.617 60.183 -0.566 25757 2814 1 4 . 1 1 62 62 THR CB C 62 72.004 72.004 71.901 0.103 25757 2815 1 4 . 1 1 62 62 THR H H 62 7.673 7.673 7.305 0.368 25757 2816 1 4 . 1 1 63 63 ILE N N 63 123.324 123.324 124.902 -1.578 25757 2817 1 4 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.673 0.456 25757 2818 1 4 . 1 1 63 63 ILE C C 63 175.652 175.652 175.620 0.032 25757 2819 1 4 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.994 -0.508 25757 2820 1 4 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.253 -0.296 25757 2821 1 4 . 1 1 63 63 ILE H H 63 8.907 8.907 8.862 0.045 25757 2822 1 4 . 1 1 64 64 ASP N N 64 128.253 128.253 127.047 1.206 25757 2823 1 4 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.861 0.460 25757 2824 1 4 . 1 1 64 64 ASP C C 64 176.431 176.431 177.329 -0.898 25757 2825 1 4 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.289 -0.958 25757 2826 1 4 . 1 1 64 64 ASP CB C 64 42.053 42.053 43.008 -0.955 25757 2827 1 4 . 1 1 64 64 ASP H H 64 8.864 8.864 9.100 -0.236 25757 2828 1 4 . 1 1 65 65 PHE N N 65 118.583 118.583 120.940 -2.357 25757 2829 1 4 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.311 -0.451 25757 2830 1 4 . 1 1 65 65 PHE C C 65 173.458 173.458 174.325 -0.867 25757 2831 1 4 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.449 2.350 25757 2832 1 4 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.702 -0.822 25757 2833 1 4 . 1 1 65 65 PHE H H 65 8.962 8.962 8.939 0.023 25757 2834 1 4 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.647 0.471 25757 2835 1 4 . 1 1 66 66 PRO C C 66 180.038 180.038 178.481 1.557 25757 2836 1 4 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.979 1.711 25757 2837 1 4 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.727 -0.050 25757 2838 1 4 . 1 1 67 67 GLU N N 67 118.402 118.402 119.091 -0.689 25757 2839 1 4 . 1 1 67 67 GLU C C 67 178.737 178.737 178.498 0.239 25757 2840 1 4 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.827 -0.819 25757 2841 1 4 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.100 0.585 25757 2842 1 4 . 1 1 67 67 GLU H H 67 7.953 7.953 8.339 -0.386 25757 2843 1 4 . 1 1 68 68 PHE N N 68 123.421 123.421 120.223 3.198 25757 2844 1 4 . 1 1 68 68 PHE HA H 68 3.972 3.972 3.991 -0.019 25757 2845 1 4 . 1 1 68 68 PHE C C 68 177.184 177.184 177.076 0.108 25757 2846 1 4 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.266 0.072 25757 2847 1 4 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.851 1.118 25757 2848 1 4 . 1 1 68 68 PHE H H 68 8.928 8.928 7.410 1.518 25757 2849 1 4 . 1 1 69 69 LEU N N 69 119.284 119.284 119.494 -0.210 25757 2850 1 4 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.495 -0.160 25757 2851 1 4 . 1 1 69 69 LEU C C 69 178.987 178.987 178.212 0.775 25757 2852 1 4 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.745 -0.883 25757 2853 1 4 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.501 -0.669 25757 2854 1 4 . 1 1 69 69 LEU H H 69 8.374 8.374 7.583 0.791 25757 2855 1 4 . 1 1 70 70 THR N N 70 116.017 116.017 115.451 0.566 25757 2856 1 4 . 1 1 70 70 THR HA H 70 4.338 4.338 3.646 0.692 25757 2857 1 4 . 1 1 70 70 THR C C 70 176.169 176.169 176.448 -0.279 25757 2858 1 4 . 1 1 70 70 THR CA C 70 66.700 66.700 67.139 -0.439 25757 2859 1 4 . 1 1 70 70 THR CB C 70 68.379 68.379 68.568 -0.189 25757 2860 1 4 . 1 1 70 70 THR H H 70 7.493 7.493 8.071 -0.578 25757 2861 1 4 . 1 1 71 71 MET N N 71 121.915 121.915 121.976 -0.061 25757 2862 1 4 . 1 1 71 71 MET HA H 71 3.718 3.718 3.908 -0.190 25757 2863 1 4 . 1 1 71 71 MET C C 71 178.190 178.190 177.324 0.866 25757 2864 1 4 . 1 1 71 71 MET CA C 71 59.335 59.335 58.383 0.952 25757 2865 1 4 . 1 1 71 71 MET CB C 71 33.894 33.894 32.181 1.714 25757 2866 1 4 . 1 1 71 71 MET H H 71 7.924 7.924 7.877 0.047 25757 2867 1 4 . 1 1 72 72 MET N N 72 116.973 116.973 117.585 -0.612 25757 2868 1 4 . 1 1 72 72 MET HA H 72 3.968 3.968 3.961 0.007 25757 2869 1 4 . 1 1 72 72 MET C C 72 178.211 178.211 178.465 -0.254 25757 2870 1 4 . 1 1 72 72 MET CA C 72 56.059 56.059 58.625 -2.566 25757 2871 1 4 . 1 1 72 72 MET CB C 72 31.639 31.639 32.488 -0.849 25757 2872 1 4 . 1 1 72 72 MET H H 72 8.276 8.276 7.705 0.571 25757 2873 1 4 . 1 1 73 73 ALA N N 73 122.499 122.499 121.842 0.657 25757 2874 1 4 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.676 0.274 25757 2875 1 4 . 1 1 73 73 ALA C C 73 180.231 180.231 179.431 0.800 25757 2876 1 4 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.856 0.097 25757 2877 1 4 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.459 0.573 25757 2878 1 4 . 1 1 73 73 ALA H H 73 8.240 8.240 8.138 0.102 25757 2879 1 4 . 1 1 74 74 ARG N N 74 116.098 116.098 118.820 -2.722 25757 2880 1 4 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.950 0.042 25757 2881 1 4 . 1 1 74 74 ARG C C 74 178.567 178.567 178.334 0.233 25757 2882 1 4 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.977 -0.152 25757 2883 1 4 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.007 0.068 25757 2884 1 4 . 1 1 74 74 ARG H H 74 7.420 7.420 8.182 -0.762 25757 2885 1 4 . 1 1 75 75 LYS N N 75 119.046 119.046 120.348 -1.302 25757 2886 1 4 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.022 0.021 25757 2887 1 4 . 1 1 75 75 LYS C C 75 179.045 179.045 178.705 0.340 25757 2888 1 4 . 1 1 75 75 LYS CA C 75 57.889 57.889 59.008 -1.119 25757 2889 1 4 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.123 -0.357 25757 2890 1 4 . 1 1 75 75 LYS H H 75 7.862 7.862 7.992 -0.130 25757 2891 1 4 . 1 1 76 76 MET N N 76 116.772 116.772 119.629 -2.857 25757 2892 1 4 . 1 1 76 76 MET H H 76 8.099 8.099 8.179 -0.080 25757 2893 1 4 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.726 -0.092 25757 2894 1 4 . 1 1 78 78 ASP C C 78 176.395 176.395 176.425 -0.030 25757 2895 1 4 . 1 1 78 78 ASP CA C 78 54.644 54.644 53.847 0.797 25757 2896 1 4 . 1 1 78 78 ASP CB C 78 41.474 41.474 42.493 -1.020 25757 2897 1 4 . 1 1 79 79 THR N N 79 113.904 113.904 118.548 -4.644 25757 2898 1 4 . 1 1 79 79 THR HA H 79 4.215 4.215 4.270 -0.055 25757 2899 1 4 . 1 1 79 79 THR C C 79 174.204 174.204 175.066 -0.862 25757 2900 1 4 . 1 1 79 79 THR CA C 79 62.264 62.264 63.877 -1.613 25757 2901 1 4 . 1 1 79 79 THR CB C 79 69.884 69.884 69.288 0.596 25757 2902 1 4 . 1 1 79 79 THR H H 79 8.039 8.039 8.453 -0.414 25757 2903 1 4 . 1 1 80 80 ASP N N 80 123.572 123.572 123.753 -0.181 25757 2904 1 4 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.572 0.148 25757 2905 1 4 . 1 1 80 80 ASP C C 80 176.221 176.221 176.159 0.062 25757 2906 1 4 . 1 1 80 80 ASP CA C 80 54.315 54.315 55.450 -1.135 25757 2907 1 4 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.791 0.636 25757 2908 1 4 . 1 1 80 80 ASP H H 80 8.441 8.441 7.969 0.472 25757 2909 1 4 . 1 1 81 81 SER N N 81 117.879 117.879 119.129 -1.250 25757 2910 1 4 . 1 1 81 81 SER HA H 81 3.925 3.925 4.510 -0.585 25757 2911 1 4 . 1 1 81 81 SER C C 81 175.264 175.264 175.282 -0.018 25757 2912 1 4 . 1 1 81 81 SER CA C 81 58.860 58.860 59.041 -0.181 25757 2913 1 4 . 1 1 81 81 SER CB C 81 63.790 63.790 63.906 -0.116 25757 2914 1 4 . 1 1 81 81 SER H H 81 8.503 8.503 8.552 -0.049 25757 2915 1 4 . 1 1 82 82 GLU N N 82 123.206 123.206 122.105 1.101 25757 2916 1 4 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.078 -0.020 25757 2917 1 4 . 1 1 82 82 GLU C C 82 178.378 178.378 178.024 0.354 25757 2918 1 4 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.933 -0.347 25757 2919 1 4 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.477 0.126 25757 2920 1 4 . 1 1 82 82 GLU H H 82 8.563 8.563 8.543 0.020 25757 2921 1 4 . 1 1 83 83 GLU N N 83 119.262 119.262 118.223 1.039 25757 2922 1 4 . 1 1 83 83 GLU HA H 83 3.957 3.957 4.036 -0.079 25757 2923 1 4 . 1 1 83 83 GLU C C 83 178.606 178.606 179.049 -0.443 25757 2924 1 4 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.551 0.118 25757 2925 1 4 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.060 0.295 25757 2926 1 4 . 1 1 83 83 GLU H H 83 7.728 7.728 8.579 -0.851 25757 2927 1 4 . 1 1 84 84 GLU N N 84 118.432 118.432 118.938 -0.506 25757 2928 1 4 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.059 0.048 25757 2929 1 4 . 1 1 84 84 GLU C C 84 179.436 179.436 179.069 0.367 25757 2930 1 4 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.206 0.297 25757 2931 1 4 . 1 1 84 84 GLU CB C 84 29.107 29.107 28.866 0.241 25757 2932 1 4 . 1 1 84 84 GLU H H 84 8.346 8.346 8.421 -0.075 25757 2933 1 4 . 1 1 85 85 ILE N N 85 120.925 120.925 121.183 -0.258 25757 2934 1 4 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.876 -0.128 25757 2935 1 4 . 1 1 85 85 ILE C C 85 177.661 177.661 178.420 -0.759 25757 2936 1 4 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.094 1.396 25757 2937 1 4 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.014 0.417 25757 2938 1 4 . 1 1 85 85 ILE H H 85 7.821 7.821 8.220 -0.399 25757 2939 1 4 . 1 1 86 86 ARG N N 86 121.916 121.916 118.742 3.174 25757 2940 1 4 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.050 0.086 25757 2941 1 4 . 1 1 86 86 ARG C C 86 179.208 179.208 178.834 0.374 25757 2942 1 4 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.719 0.652 25757 2943 1 4 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.832 0.266 25757 2944 1 4 . 1 1 86 86 ARG H H 86 8.432 8.432 8.302 0.130 25757 2945 1 4 . 1 1 87 87 GLU N N 87 118.261 118.261 118.945 -0.684 25757 2946 1 4 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.997 0.115 25757 2947 1 4 . 1 1 87 87 GLU C C 87 178.516 178.516 178.287 0.229 25757 2948 1 4 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.489 -0.464 25757 2949 1 4 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.473 -0.302 25757 2950 1 4 . 1 1 87 87 GLU H H 87 8.225 8.225 8.384 -0.159 25757 2951 1 4 . 1 1 88 88 ALA N N 88 121.009 121.009 122.486 -1.477 25757 2952 1 4 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.535 0.292 25757 2953 1 4 . 1 1 88 88 ALA C C 88 177.947 177.947 178.570 -0.623 25757 2954 1 4 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.892 -0.031 25757 2955 1 4 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.131 -0.176 25757 2956 1 4 . 1 1 88 88 ALA H H 88 7.789 7.789 7.776 0.013 25757 2957 1 4 . 1 1 89 89 PHE N N 89 117.164 117.164 118.496 -1.332 25757 2958 1 4 . 1 1 89 89 PHE C C 89 176.134 176.134 177.402 -1.268 25757 2959 1 4 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.681 1.969 25757 2960 1 4 . 1 1 89 89 PHE CB C 89 38.893 38.893 39.026 -0.133 25757 2961 1 4 . 1 1 89 89 PHE H H 89 8.337 8.337 7.579 0.758 25757 2962 1 4 . 1 1 90 90 ARG N N 90 114.900 114.900 117.500 -2.600 25757 2963 1 4 . 1 1 90 90 ARG HA H 90 3.914 3.914 4.137 -0.223 25757 2964 1 4 . 1 1 90 90 ARG C C 90 178.296 178.296 177.639 0.657 25757 2965 1 4 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.748 1.331 25757 2966 1 4 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.242 -0.149 25757 2967 1 4 . 1 1 90 90 ARG H H 90 7.681 7.681 7.890 -0.209 25757 2968 1 4 . 1 1 91 91 VAL N N 91 116.927 116.927 115.428 1.499 25757 2969 1 4 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.944 -0.337 25757 2970 1 4 . 1 1 91 91 VAL C C 91 177.964 177.964 177.157 0.807 25757 2971 1 4 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.708 1.252 25757 2972 1 4 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.174 0.445 25757 2973 1 4 . 1 1 91 91 VAL H H 91 7.405 7.405 7.636 -0.231 25757 2974 1 4 . 1 1 92 92 PHE N N 92 119.026 119.026 116.774 2.252 25757 2975 1 4 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.354 0.008 25757 2976 1 4 . 1 1 92 92 PHE C C 92 177.639 177.639 175.660 1.979 25757 2977 1 4 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.122 -0.401 25757 2978 1 4 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.896 -0.469 25757 2979 1 4 . 1 1 92 92 PHE H H 92 7.886 7.886 7.507 0.379 25757 2980 1 4 . 1 1 93 93 ASP N N 93 118.238 118.238 118.857 -0.619 25757 2981 1 4 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.870 -0.408 25757 2982 1 4 . 1 1 93 93 ASP C C 93 176.979 176.979 176.620 0.359 25757 2983 1 4 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.477 -0.329 25757 2984 1 4 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.087 -1.938 25757 2985 1 4 . 1 1 93 93 ASP H H 93 8.009 8.009 7.319 0.690 25757 2986 1 4 . 1 1 94 94 LYS N N 94 125.792 125.792 125.311 0.481 25757 2987 1 4 . 1 1 94 94 LYS C C 94 178.213 178.213 177.953 0.260 25757 2988 1 4 . 1 1 94 94 LYS CA C 94 59.318 59.318 59.033 0.285 25757 2989 1 4 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.467 -1.438 25757 2990 1 4 . 1 1 94 94 LYS H H 94 7.428 7.428 8.232 -0.804 25757 2991 1 4 . 1 1 95 95 ASP N N 95 113.833 113.833 115.833 -2.000 25757 2992 1 4 . 1 1 95 95 ASP C C 95 177.718 177.718 177.509 0.209 25757 2993 1 4 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.025 -1.080 25757 2994 1 4 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.411 -0.668 25757 2995 1 4 . 1 1 95 95 ASP H H 95 8.159 8.159 8.012 0.147 25757 2996 1 4 . 1 1 96 96 GLY N N 96 109.414 109.414 108.196 1.218 25757 2997 1 4 . 1 1 96 96 GLY C C 96 175.093 175.093 175.131 -0.038 25757 2998 1 4 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.861 1.393 25757 2999 1 4 . 1 1 96 96 GLY H H 96 7.848 7.848 8.107 -0.259 25757 3000 1 4 . 1 1 97 97 ASN N N 97 119.590 119.590 118.584 1.006 25757 3001 1 4 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.516 0.096 25757 3002 1 4 . 1 1 97 97 ASN C C 97 175.937 175.937 176.575 -0.638 25757 3003 1 4 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.831 -0.943 25757 3004 1 4 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.771 -1.451 25757 3005 1 4 . 1 1 97 97 ASN H H 97 8.338 8.338 8.284 0.054 25757 3006 1 4 . 1 1 98 98 GLY N N 98 112.940 112.940 108.152 4.788 25757 3007 1 4 . 1 1 98 98 GLY C C 98 172.429 172.429 172.496 -0.067 25757 3008 1 4 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.047 0.045 25757 3009 1 4 . 1 1 98 98 GLY H H 98 10.695 10.695 9.199 1.496 25757 3010 1 4 . 1 1 99 99 TYR N N 99 115.544 115.544 118.233 -2.689 25757 3011 1 4 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.515 -0.428 25757 3012 1 4 . 1 1 99 99 TYR C C 99 174.859 174.859 174.828 0.031 25757 3013 1 4 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.143 -1.125 25757 3014 1 4 . 1 1 99 99 TYR CB C 99 43.353 43.353 41.999 1.354 25757 3015 1 4 . 1 1 99 99 TYR H H 99 7.597 7.597 7.935 -0.338 25757 3016 1 4 . 1 1 100 100 ILE N N 100 127.078 127.078 125.064 2.014 25757 3017 1 4 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.564 0.225 25757 3018 1 4 . 1 1 100 100 ILE C C 100 175.387 175.387 175.870 -0.483 25757 3019 1 4 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.118 -0.112 25757 3020 1 4 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.407 -0.617 25757 3021 1 4 . 1 1 100 100 ILE H H 100 10.267 10.267 9.351 0.916 25757 3022 1 4 . 1 1 101 101 SER N N 101 124.102 124.102 122.314 1.788 25757 3023 1 4 . 1 1 101 101 SER HA H 101 4.417 4.417 5.046 -0.629 25757 3024 1 4 . 1 1 101 101 SER C C 101 175.360 175.360 175.154 0.206 25757 3025 1 4 . 1 1 101 101 SER CA C 101 56.036 56.036 56.276 -0.240 25757 3026 1 4 . 1 1 101 101 SER CB C 101 66.896 66.896 65.611 1.285 25757 3027 1 4 . 1 1 101 101 SER H H 101 8.985 8.985 9.449 -0.464 25757 3028 1 4 . 1 1 102 102 ALA N N 102 122.780 122.780 126.825 -4.045 25757 3029 1 4 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.950 -0.206 25757 3030 1 4 . 1 1 102 102 ALA C C 102 179.175 179.175 178.784 0.391 25757 3031 1 4 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.722 0.568 25757 3032 1 4 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.587 -0.560 25757 3033 1 4 . 1 1 102 102 ALA H H 102 9.269 9.269 9.078 0.191 25757 3034 1 4 . 1 1 103 103 ALA N N 103 118.513 118.513 121.046 -2.533 25757 3035 1 4 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.899 0.112 25757 3036 1 4 . 1 1 103 103 ALA C C 103 181.521 181.521 179.273 2.248 25757 3037 1 4 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.316 0.037 25757 3038 1 4 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.201 0.090 25757 3039 1 4 . 1 1 103 103 ALA H H 103 8.321 8.321 8.430 -0.109 25757 3040 1 4 . 1 1 104 104 GLU N N 104 119.550 119.550 119.309 0.241 25757 3041 1 4 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.013 -0.007 25757 3042 1 4 . 1 1 104 104 GLU C C 104 179.750 179.750 179.153 0.597 25757 3043 1 4 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.722 -0.554 25757 3044 1 4 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.284 -0.069 25757 3045 1 4 . 1 1 104 104 GLU H H 104 7.867 7.867 8.334 -0.467 25757 3046 1 4 . 1 1 105 105 LEU N N 105 122.688 122.688 119.943 2.745 25757 3047 1 4 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.829 0.089 25757 3048 1 4 . 1 1 105 105 LEU C C 105 178.233 178.233 178.815 -0.582 25757 3049 1 4 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.001 -0.267 25757 3050 1 4 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.437 0.583 25757 3051 1 4 . 1 1 105 105 LEU H H 105 8.746 8.746 7.747 0.999 25757 3052 1 4 . 1 1 106 106 ARG N N 106 118.835 118.835 118.922 -0.087 25757 3053 1 4 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.806 -0.156 25757 3054 1 4 . 1 1 106 106 ARG C C 106 178.742 178.742 178.997 -0.255 25757 3055 1 4 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.146 0.817 25757 3056 1 4 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.354 0.692 25757 3057 1 4 . 1 1 106 106 ARG H H 106 8.684 8.684 8.142 0.542 25757 3058 1 4 . 1 1 107 107 HIS N N 107 119.258 119.258 117.317 1.941 25757 3059 1 4 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.455 -0.188 25757 3060 1 4 . 1 1 107 107 HIS C C 107 177.244 177.244 178.222 -0.978 25757 3061 1 4 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.790 1.362 25757 3062 1 4 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.362 1.213 25757 3063 1 4 . 1 1 107 107 HIS H H 107 7.691 7.691 8.156 -0.465 25757 3064 1 4 . 1 1 108 108 VAL N N 108 118.996 118.996 122.446 -3.450 25757 3065 1 4 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.784 -0.346 25757 3066 1 4 . 1 1 108 108 VAL C C 108 177.998 177.998 178.347 -0.349 25757 3067 1 4 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.691 -0.260 25757 3068 1 4 . 1 1 108 108 VAL CB C 108 31.424 31.424 32.033 -0.609 25757 3069 1 4 . 1 1 108 108 VAL H H 108 7.599 7.599 8.164 -0.565 25757 3070 1 4 . 1 1 109 109 MET N N 109 114.880 114.880 116.684 -1.804 25757 3071 1 4 . 1 1 109 109 MET C C 109 179.119 179.119 177.808 1.311 25757 3072 1 4 . 1 1 109 109 MET CA C 109 56.979 56.979 58.141 -1.161 25757 3073 1 4 . 1 1 109 109 MET CB C 109 29.253 29.253 32.802 -3.549 25757 3074 1 4 . 1 1 109 109 MET H H 109 7.911 7.911 8.122 -0.211 25757 3075 1 4 . 1 1 110 110 THR N N 110 116.943 116.943 115.970 0.973 25757 3076 1 4 . 1 1 110 110 THR HA H 110 4.229 4.229 4.187 0.042 25757 3077 1 4 . 1 1 110 110 THR C C 110 178.506 178.506 177.241 1.265 25757 3078 1 4 . 1 1 110 110 THR CA C 110 66.573 66.573 66.060 0.513 25757 3079 1 4 . 1 1 110 110 THR CB C 110 68.575 68.575 68.664 -0.089 25757 3080 1 4 . 1 1 110 110 THR H H 110 8.353 8.353 8.240 0.113 25757 3081 1 4 . 1 1 111 111 ASN N N 111 123.829 123.829 120.668 3.161 25757 3082 1 4 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.498 -0.136 25757 3083 1 4 . 1 1 111 111 ASN C C 111 177.197 177.197 176.865 0.332 25757 3084 1 4 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.825 0.134 25757 3085 1 4 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.087 -0.864 25757 3086 1 4 . 1 1 111 111 ASN H H 111 8.053 8.053 8.428 -0.375 25757 3087 1 4 . 1 1 112 112 LEU N N 112 119.036 119.036 118.007 1.029 25757 3088 1 4 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.122 0.048 25757 3089 1 4 . 1 1 112 112 LEU C C 112 176.377 176.377 177.819 -1.442 25757 3090 1 4 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.462 -0.957 25757 3091 1 4 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.525 -0.165 25757 3092 1 4 . 1 1 112 112 LEU H H 112 7.794 7.794 7.713 0.081 25757 3093 1 4 . 1 1 113 113 GLY N N 113 106.045 106.045 105.871 0.174 25757 3094 1 4 . 1 1 113 113 GLY C C 113 174.248 174.248 174.024 0.224 25757 3095 1 4 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.692 0.615 25757 3096 1 4 . 1 1 113 113 GLY H H 113 7.741 7.741 7.676 0.065 25757 3097 1 4 . 1 1 114 114 GLU N N 114 120.556 120.556 122.768 -2.212 25757 3098 1 4 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.087 0.223 25757 3099 1 4 . 1 1 114 114 GLU C C 114 174.993 174.993 175.867 -0.874 25757 3100 1 4 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.723 -1.086 25757 3101 1 4 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.405 1.812 25757 3102 1 4 . 1 1 114 114 GLU H H 114 7.980 7.980 7.935 0.045 25757 3103 1 4 . 1 1 115 115 LYS N N 115 124.986 124.986 127.600 -2.614 25757 3104 1 4 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.123 0.211 25757 3105 1 4 . 1 1 115 115 LYS C C 115 175.285 175.285 175.815 -0.530 25757 3106 1 4 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.902 -1.321 25757 3107 1 4 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.431 -0.458 25757 3108 1 4 . 1 1 115 115 LYS H H 115 8.613 8.613 7.957 0.656 25757 3109 1 4 . 1 1 116 116 LEU N N 116 125.243 125.243 124.614 0.629 25757 3110 1 4 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.964 -0.276 25757 3111 1 4 . 1 1 116 116 LEU C C 116 178.365 178.365 175.850 2.515 25757 3112 1 4 . 1 1 116 116 LEU CA C 116 54.348 54.348 52.875 1.473 25757 3113 1 4 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.224 1.065 25757 3114 1 4 . 1 1 116 116 LEU H H 116 8.066 8.066 7.936 0.130 25757 3115 1 4 . 1 1 117 117 THR N N 117 114.324 114.324 114.055 0.269 25757 3116 1 4 . 1 1 117 117 THR HA H 117 4.713 4.713 4.506 0.207 25757 3117 1 4 . 1 1 117 117 THR C C 117 175.539 175.539 174.823 0.716 25757 3118 1 4 . 1 1 117 117 THR CA C 117 60.756 60.756 60.477 0.279 25757 3119 1 4 . 1 1 117 117 THR CB C 117 71.144 71.144 71.290 -0.146 25757 3120 1 4 . 1 1 117 117 THR H H 117 9.228 9.228 8.072 1.156 25757 3121 1 4 . 1 1 118 118 ASP N N 118 121.016 121.016 122.854 -1.838 25757 3122 1 4 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.283 -0.128 25757 3123 1 4 . 1 1 118 118 ASP H H 118 8.919 8.919 8.749 0.170 25757 3124 1 4 . 1 1 119 119 GLU N N 119 121.016 121.016 118.421 2.595 25757 3125 1 4 . 1 1 119 119 GLU C C 119 179.204 179.204 179.072 0.132 25757 3126 1 4 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.229 -1.159 25757 3127 1 4 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.089 -0.045 25757 3128 1 4 . 1 1 119 119 GLU H H 119 8.919 8.919 8.881 0.038 25757 3129 1 4 . 1 1 120 120 GLU N N 120 120.566 120.566 120.410 0.156 25757 3130 1 4 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.995 0.006 25757 3131 1 4 . 1 1 120 120 GLU C C 120 180.329 180.329 178.873 1.456 25757 3132 1 4 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.167 -0.076 25757 3133 1 4 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.534 1.104 25757 3134 1 4 . 1 1 120 120 GLU H H 120 7.732 7.732 7.763 -0.031 25757 3135 1 4 . 1 1 121 121 VAL N N 121 121.875 121.875 119.411 2.464 25757 3136 1 4 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.522 -0.057 25757 3137 1 4 . 1 1 121 121 VAL C C 121 177.477 177.477 178.113 -0.636 25757 3138 1 4 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.252 0.919 25757 3139 1 4 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.658 -0.224 25757 3140 1 4 . 1 1 121 121 VAL H H 121 8.104 8.104 7.441 0.663 25757 3141 1 4 . 1 1 122 122 ASP N N 122 120.566 120.566 118.382 2.184 25757 3142 1 4 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.313 0.022 25757 3143 1 4 . 1 1 122 122 ASP C C 122 179.298 179.298 178.637 0.661 25757 3144 1 4 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.535 0.304 25757 3145 1 4 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.900 -0.588 25757 3146 1 4 . 1 1 122 122 ASP H H 122 8.089 8.089 8.190 -0.101 25757 3147 1 4 . 1 1 123 123 GLU N N 123 119.821 119.821 119.865 -0.044 25757 3148 1 4 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.045 0.004 25757 3149 1 4 . 1 1 123 123 GLU C C 123 178.749 178.749 178.980 -0.231 25757 3150 1 4 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.273 0.045 25757 3151 1 4 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.695 -0.309 25757 3152 1 4 . 1 1 123 123 GLU H H 123 8.105 8.105 7.813 0.292 25757 3153 1 4 . 1 1 124 124 MET N N 124 119.288 119.288 117.575 1.713 25757 3154 1 4 . 1 1 124 124 MET C C 124 180.865 180.865 179.031 1.834 25757 3155 1 4 . 1 1 124 124 MET CA C 124 60.684 60.684 59.133 1.551 25757 3156 1 4 . 1 1 124 124 MET CB C 124 33.141 33.141 31.973 1.168 25757 3157 1 4 . 1 1 124 124 MET H H 124 7.726 7.726 8.153 -0.427 25757 3158 1 4 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.058 -0.329 25757 3159 1 4 . 1 1 125 125 ILE C C 125 177.341 177.341 178.146 -0.805 25757 3160 1 4 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.260 0.541 25757 3161 1 4 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.646 -1.081 25757 3162 1 4 . 1 1 126 126 ARG N N 126 118.555 118.555 120.608 -2.053 25757 3163 1 4 . 1 1 126 126 ARG C C 126 179.164 179.164 177.919 1.245 25757 3164 1 4 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.258 0.666 25757 3165 1 4 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.248 -0.383 25757 3166 1 4 . 1 1 126 126 ARG H H 126 8.380 8.380 7.977 0.403 25757 3167 1 4 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.361 -0.436 25757 3168 1 4 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.693 1.364 25757 3169 1 4 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.128 0.700 25757 3170 1 4 . 1 1 128 128 ALA N N 128 116.764 116.764 120.710 -3.946 25757 3171 1 4 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.234 0.183 25757 3172 1 4 . 1 1 128 128 ALA C C 128 177.885 177.885 177.212 0.673 25757 3173 1 4 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.999 -1.044 25757 3174 1 4 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.996 2.571 25757 3175 1 4 . 1 1 128 128 ALA H H 128 7.152 7.152 7.922 -0.770 25757 3176 1 4 . 1 1 129 129 ASP N N 129 117.762 117.762 118.937 -1.175 25757 3177 1 4 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.112 -0.635 25757 3178 1 4 . 1 1 129 129 ASP C C 129 175.935 175.935 176.611 -0.676 25757 3179 1 4 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.624 1.891 25757 3180 1 4 . 1 1 129 129 ASP CB C 129 40.745 40.745 40.385 0.360 25757 3181 1 4 . 1 1 129 129 ASP H H 129 8.007 8.007 7.955 0.052 25757 3182 1 4 . 1 1 130 130 ILE N N 130 128.249 128.249 125.063 3.186 25757 3183 1 4 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.841 0.023 25757 3184 1 4 . 1 1 130 130 ILE C C 130 177.764 177.764 177.348 0.416 25757 3185 1 4 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.960 -0.412 25757 3186 1 4 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.276 0.372 25757 3187 1 4 . 1 1 130 130 ILE H H 130 8.412 8.412 8.094 0.318 25757 3188 1 4 . 1 1 131 131 ASP N N 131 116.430 116.430 117.085 -0.655 25757 3189 1 4 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.654 -0.120 25757 3190 1 4 . 1 1 131 131 ASP C C 131 178.313 178.313 176.687 1.626 25757 3191 1 4 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.506 -0.622 25757 3192 1 4 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.760 -0.798 25757 3193 1 4 . 1 1 131 131 ASP H H 131 8.254 8.254 8.071 0.183 25757 3194 1 4 . 1 1 132 132 GLY N N 132 108.460 108.460 108.555 -0.095 25757 3195 1 4 . 1 1 132 132 GLY C C 132 175.211 175.211 174.831 0.380 25757 3196 1 4 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.127 1.476 25757 3197 1 4 . 1 1 132 132 GLY H H 132 7.547 7.547 7.969 -0.422 25757 3198 1 4 . 1 1 133 133 ASP N N 133 120.909 120.909 118.923 1.986 25757 3199 1 4 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.562 -0.099 25757 3200 1 4 . 1 1 133 133 ASP C C 133 177.691 177.691 177.082 0.609 25757 3201 1 4 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.435 1.379 25757 3202 1 4 . 1 1 133 133 ASP CB C 133 40.298 40.298 39.929 0.369 25757 3203 1 4 . 1 1 133 133 ASP H H 133 8.339 8.339 8.566 -0.227 25757 3204 1 4 . 1 1 134 134 GLY N N 134 112.704 112.704 107.563 5.141 25757 3205 1 4 . 1 1 134 134 GLY C C 134 172.722 172.722 173.619 -0.897 25757 3206 1 4 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.619 0.418 25757 3207 1 4 . 1 1 134 134 GLY H H 134 10.396 10.396 7.991 2.405 25757 3208 1 4 . 1 1 135 135 GLN N N 135 114.799 114.799 117.827 -3.028 25757 3209 1 4 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.169 -0.305 25757 3210 1 4 . 1 1 135 135 GLN C C 135 174.760 174.760 174.810 -0.050 25757 3211 1 4 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.798 -1.478 25757 3212 1 4 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.608 -1.543 25757 3213 1 4 . 1 1 135 135 GLN H H 135 7.975 7.975 8.716 -0.741 25757 3214 1 4 . 1 1 136 136 VAL N N 136 125.364 125.364 124.148 1.216 25757 3215 1 4 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.777 0.431 25757 3216 1 4 . 1 1 136 136 VAL C C 136 175.831 175.831 175.583 0.248 25757 3217 1 4 . 1 1 136 136 VAL CA C 136 61.817 61.817 60.878 0.939 25757 3218 1 4 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.314 0.360 25757 3219 1 4 . 1 1 136 136 VAL H H 136 9.169 9.169 9.163 0.006 25757 3220 1 4 . 1 1 137 137 ASN N N 137 129.155 129.155 123.549 5.606 25757 3221 1 4 . 1 1 137 137 ASN C C 137 174.737 174.737 175.483 -0.746 25757 3222 1 4 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.917 0.434 25757 3223 1 4 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.627 -3.304 25757 3224 1 4 . 1 1 137 137 ASN H H 137 9.652 9.652 8.761 0.891 25757 3225 1 4 . 1 1 138 138 TYR N N 138 118.504 118.504 122.132 -3.628 25757 3226 1 4 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.509 -0.230 25757 3227 1 4 . 1 1 138 138 TYR C C 138 176.174 176.174 177.333 -1.159 25757 3228 1 4 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.063 0.511 25757 3229 1 4 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.288 -0.558 25757 3230 1 4 . 1 1 138 138 TYR H H 138 8.460 8.460 8.636 -0.176 25757 3231 1 4 . 1 1 139 139 GLU N N 139 118.644 118.644 117.315 1.329 25757 3232 1 4 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.876 -0.328 25757 3233 1 4 . 1 1 139 139 GLU C C 139 180.265 180.265 178.515 1.750 25757 3234 1 4 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.917 0.569 25757 3235 1 4 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.895 0.096 25757 3236 1 4 . 1 1 139 139 GLU H H 139 8.136 8.136 8.148 -0.012 25757 3237 1 4 . 1 1 140 140 GLU N N 140 120.030 120.030 116.864 3.166 25757 3238 1 4 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.025 -0.137 25757 3239 1 4 . 1 1 140 140 GLU C C 140 179.627 179.627 178.213 1.414 25757 3240 1 4 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.342 0.335 25757 3241 1 4 . 1 1 140 140 GLU CB C 140 29.727 29.727 28.953 0.774 25757 3242 1 4 . 1 1 140 140 GLU H H 140 8.798 8.798 8.412 0.386 25757 3243 1 4 . 1 1 141 141 PHE N N 141 123.154 123.154 122.588 0.566 25757 3244 1 4 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.844 -0.147 25757 3245 1 4 . 1 1 141 141 PHE C C 141 176.952 176.952 177.915 -0.963 25757 3246 1 4 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.767 1.285 25757 3247 1 4 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.306 0.825 25757 3248 1 4 . 1 1 141 141 PHE H H 141 8.633 8.633 8.147 0.486 25757 3249 1 4 . 1 1 142 142 VAL N N 142 120.046 120.046 116.257 3.789 25757 3250 1 4 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.560 -0.604 25757 3251 1 4 . 1 1 142 142 VAL C C 142 179.627 179.627 177.588 2.039 25757 3252 1 4 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.035 2.208 25757 3253 1 4 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.351 0.789 25757 3254 1 4 . 1 1 142 142 VAL H H 142 8.894 8.894 8.063 0.831 25757 3255 1 4 . 1 1 143 143 GLN N N 143 118.996 118.996 119.979 -0.983 25757 3256 1 4 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.009 -0.233 25757 3257 1 4 . 1 1 143 143 GLN C C 143 178.443 178.443 178.010 0.433 25757 3258 1 4 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.330 0.799 25757 3259 1 4 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.097 -0.354 25757 3260 1 4 . 1 1 143 143 GLN H H 143 7.627 7.627 7.412 0.215 25757 3261 1 4 . 1 1 144 144 MET N N 144 116.361 116.361 118.319 -1.958 25757 3262 1 4 . 1 1 144 144 MET HA H 144 4.169 4.169 4.025 0.144 25757 3263 1 4 . 1 1 144 144 MET C C 144 178.418 178.418 176.998 1.420 25757 3264 1 4 . 1 1 144 144 MET CA C 144 56.137 56.137 57.926 -1.789 25757 3265 1 4 . 1 1 144 144 MET CB C 144 31.095 31.095 32.365 -1.270 25757 3266 1 4 . 1 1 144 144 MET H H 144 7.179 7.179 7.325 -0.146 25757 3267 1 4 . 1 1 145 145 MET N N 145 115.373 115.373 116.459 -1.086 25757 3268 1 4 . 1 1 145 145 MET HA H 145 4.334 4.334 4.507 -0.173 25757 3269 1 4 . 1 1 145 145 MET C C 145 177.217 177.217 176.344 0.873 25757 3270 1 4 . 1 1 145 145 MET CA C 145 55.296 55.296 55.690 -0.394 25757 3271 1 4 . 1 1 145 145 MET CB C 145 34.458 34.458 33.404 1.054 25757 3272 1 4 . 1 1 145 145 MET H H 145 7.776 7.776 7.497 0.279 25757 3273 1 4 . 1 1 146 146 THR N N 146 107.988 107.988 112.124 -4.136 25757 3274 1 4 . 1 1 146 146 THR HA H 146 4.239 4.239 4.418 -0.179 25757 3275 1 4 . 1 1 146 146 THR C C 146 175.378 175.378 174.945 0.433 25757 3276 1 4 . 1 1 146 146 THR CA C 146 61.625 61.625 61.729 -0.104 25757 3277 1 4 . 1 1 146 146 THR CB C 146 70.817 70.817 68.698 2.119 25757 3278 1 4 . 1 1 146 146 THR H H 146 7.736 7.736 7.822 -0.086 25757 3279 1 4 . 1 1 147 147 GLY N N 147 110.157 110.157 109.945 0.212 25757 3280 1 4 . 1 1 147 147 GLY C C 147 174.046 174.046 173.953 0.093 25757 3281 1 4 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.753 0.791 25757 3282 1 4 . 1 1 147 147 GLY H H 147 7.793 7.793 7.997 -0.204 25757 3283 1 4 . 1 1 150 150 THR HA H 150 4.239 4.239 4.343 -0.104 25757 3284 1 4 . 1 1 150 150 THR C C 150 174.397 174.397 174.225 0.172 25757 3285 1 4 . 1 1 150 150 THR CA C 150 61.260 61.260 62.234 -0.974 25757 3286 1 4 . 1 1 150 150 THR CB C 150 70.358 70.358 69.338 1.020 25757 3287 1 4 . 1 1 151 151 ALA N N 151 126.304 126.304 122.785 3.519 25757 3288 1 4 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.700 -0.412 25757 3289 1 4 . 1 1 151 151 ALA C C 151 177.678 177.678 177.704 -0.026 25757 3290 1 4 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.228 0.920 25757 3291 1 4 . 1 1 151 151 ALA CB C 151 19.419 19.419 20.125 -0.706 25757 3292 1 4 . 1 1 151 151 ALA H H 151 8.618 8.618 7.210 1.408 25757 3293 1 4 . 1 1 152 152 ALA N N 152 123.861 123.861 121.603 2.258 25757 3294 1 4 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.311 -0.193 25757 3295 1 4 . 1 1 152 152 ALA C C 152 178.823 178.823 178.253 0.570 25757 3296 1 4 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.545 1.948 25757 3297 1 4 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.103 0.654 25757 3298 1 4 . 1 1 152 152 ALA H H 152 8.354 8.354 8.698 -0.344 25757 3299 1 4 . 1 1 153 153 GLY N N 153 109.984 109.984 107.515 2.469 25757 3300 1 4 . 1 1 153 153 GLY C C 153 174.389 174.389 175.750 -1.361 25757 3301 1 4 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.057 -1.926 25757 3302 1 4 . 1 1 153 153 GLY H H 153 9.028 9.028 8.133 0.895 25757 3303 1 4 . 1 1 154 154 SER N N 154 113.934 113.934 117.751 -3.817 25757 3304 1 4 . 1 1 154 154 SER HA H 154 4.255 4.255 3.987 0.268 25757 3305 1 4 . 1 1 154 154 SER C C 154 177.929 177.929 176.360 1.569 25757 3306 1 4 . 1 1 154 154 SER CA C 154 59.379 59.379 61.978 -2.599 25757 3307 1 4 . 1 1 154 154 SER CB C 154 64.090 64.090 62.766 1.324 25757 3308 1 4 . 1 1 154 154 SER H H 154 7.962 7.962 8.265 -0.303 25757 3309 1 4 . 1 1 155 155 GLY N N 155 115.337 115.337 108.907 6.430 25757 3310 1 4 . 1 1 155 155 GLY C C 155 175.891 175.891 175.608 0.283 25757 3311 1 4 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.836 0.810 25757 3312 1 4 . 1 1 155 155 GLY H H 155 9.451 9.451 7.722 1.729 25757 3313 1 4 . 1 1 156 156 TRP N N 156 119.600 119.600 121.853 -2.253 25757 3314 1 4 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.253 0.018 25757 3315 1 4 . 1 1 156 156 TRP C C 156 178.947 178.947 178.854 0.093 25757 3316 1 4 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.157 0.007 25757 3317 1 4 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.115 0.488 25757 3318 1 4 . 1 1 156 156 TRP H H 156 8.542 8.542 7.294 1.248 25757 3319 1 4 . 1 1 157 157 ARG N N 157 118.583 118.583 119.765 -1.182 25757 3320 1 4 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.026 -0.044 25757 3321 1 4 . 1 1 157 157 ARG C C 157 177.894 177.894 177.935 -0.041 25757 3322 1 4 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.915 -0.577 25757 3323 1 4 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.075 -0.018 25757 3324 1 4 . 1 1 157 157 ARG H H 157 7.747 7.747 8.523 -0.776 25757 3325 1 4 . 1 1 158 158 LYS N N 158 117.033 117.033 120.975 -3.942 25757 3326 1 4 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.210 -0.267 25757 3327 1 4 . 1 1 158 158 LYS C C 158 176.973 176.973 179.050 -2.077 25757 3328 1 4 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.791 0.583 25757 3329 1 4 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.195 0.096 25757 3330 1 4 . 1 1 158 158 LYS H H 158 7.529 7.529 8.003 -0.474 25757 3331 1 4 . 1 1 159 159 ILE N N 159 116.553 116.553 119.491 -2.938 25757 3332 1 4 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.791 -0.247 25757 3333 1 4 . 1 1 159 159 ILE C C 159 176.894 176.894 177.244 -0.350 25757 3334 1 4 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.007 0.509 25757 3335 1 4 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.991 -0.187 25757 3336 1 4 . 1 1 159 159 ILE H H 159 7.348 7.348 8.172 -0.824 25757 3337 1 4 . 1 1 160 160 LYS N N 160 119.278 119.278 120.593 -1.315 25757 3338 1 4 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.341 -0.302 25757 3339 1 4 . 1 1 160 160 LYS C C 160 178.566 178.566 179.240 -0.674 25757 3340 1 4 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.093 1.281 25757 3341 1 4 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.045 0.773 25757 3342 1 4 . 1 1 160 160 LYS H H 160 8.225 8.225 8.060 0.165 25757 3343 1 4 . 1 1 161 161 LEU N N 161 117.056 117.056 119.951 -2.895 25757 3344 1 4 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.139 -0.079 25757 3345 1 4 . 1 1 161 161 LEU C C 161 178.977 178.977 179.059 -0.082 25757 3346 1 4 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.731 -0.707 25757 3347 1 4 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.805 0.177 25757 3348 1 4 . 1 1 161 161 LEU H H 161 8.057 8.057 8.540 -0.483 25757 3349 1 4 . 1 1 162 162 ALA N N 162 121.814 121.814 121.922 -0.108 25757 3350 1 4 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.191 -0.099 25757 3351 1 4 . 1 1 162 162 ALA C C 162 178.374 178.374 179.726 -1.352 25757 3352 1 4 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.348 0.442 25757 3353 1 4 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.632 -0.307 25757 3354 1 4 . 1 1 162 162 ALA H H 162 8.170 8.170 8.333 -0.163 25757 3355 1 4 . 1 1 163 163 VAL N N 163 115.449 115.449 116.106 -0.657 25757 3356 1 4 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.964 -0.346 25757 3357 1 4 . 1 1 163 163 VAL C C 163 178.362 178.362 177.864 0.498 25757 3358 1 4 . 1 1 163 163 VAL CA C 163 66.272 66.272 64.802 1.470 25757 3359 1 4 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.632 1.405 25757 3360 1 4 . 1 1 163 163 VAL H H 163 8.499 8.499 8.267 0.232 25757 3361 1 4 . 1 1 164 164 ARG N N 164 115.775 115.775 120.729 -4.954 25757 3362 1 4 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.309 -0.112 25757 3363 1 4 . 1 1 164 164 ARG C C 164 178.938 178.938 178.014 0.924 25757 3364 1 4 . 1 1 164 164 ARG CA C 164 57.683 57.683 57.962 -0.279 25757 3365 1 4 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.235 -0.401 25757 3366 1 4 . 1 1 164 164 ARG H H 164 8.165 8.165 8.275 -0.110 25757 3367 1 4 . 1 1 165 165 GLY N N 165 105.570 105.570 106.030 -0.460 25757 3368 1 4 . 1 1 165 165 GLY C C 165 173.134 173.134 175.375 -2.241 25757 3369 1 4 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.726 1.016 25757 3370 1 4 . 1 1 165 165 GLY H H 165 8.455 8.455 8.048 0.407 25757 3371 1 4 . 1 1 166 166 ALA N N 166 120.648 120.648 123.493 -2.845 25757 3372 1 4 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.468 -0.126 25757 3373 1 4 . 1 1 166 166 ALA C C 166 176.155 176.155 177.966 -1.811 25757 3374 1 4 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.120 -2.347 25757 3375 1 4 . 1 1 166 166 ALA CB C 166 19.478 19.478 18.984 0.494 25757 3376 1 4 . 1 1 166 166 ALA H H 166 7.826 7.826 8.092 -0.266 25757 3377 1 4 . 1 1 167 167 GLN N N 167 117.315 117.315 117.651 -0.336 25757 3378 1 4 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.413 -0.136 25757 3379 1 4 . 1 1 167 167 GLN C C 167 175.571 175.571 176.144 -0.573 25757 3380 1 4 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.739 1.188 25757 3381 1 4 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.508 -0.323 25757 3382 1 4 . 1 1 167 167 GLN H H 167 7.498 7.498 7.760 -0.262 25757 3383 1 4 . 1 1 168 168 ALA N N 168 126.706 126.706 127.541 -0.835 25757 3384 1 4 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.355 -0.076 25757 3385 1 4 . 1 1 168 168 ALA C C 168 177.227 177.227 177.477 -0.250 25757 3386 1 4 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.242 -1.176 25757 3387 1 4 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.282 0.424 25757 3388 1 4 . 1 1 168 168 ALA H H 168 8.534 8.534 8.536 -0.002 25757 3389 1 5 . 1 1 9 9 ILE N N 9 116.733 116.733 120.980 -4.247 25757 3390 1 5 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.071 -0.314 25757 3391 1 5 . 1 1 9 9 ILE C C 9 177.828 177.828 177.135 0.693 25757 3392 1 5 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.413 3.192 25757 3393 1 5 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.598 -0.000 25757 3394 1 5 . 1 1 9 9 ILE H H 9 7.366 7.366 8.085 -0.719 25757 3395 1 5 . 1 1 10 10 ALA N N 10 121.080 121.080 123.371 -2.291 25757 3396 1 5 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.057 0.018 25757 3397 1 5 . 1 1 10 10 ALA C C 10 180.921 180.921 179.168 1.753 25757 3398 1 5 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.288 0.315 25757 3399 1 5 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.776 0.208 25757 3400 1 5 . 1 1 10 10 ALA H H 10 8.039 8.039 8.268 -0.229 25757 3401 1 5 . 1 1 11 11 GLU N N 11 119.580 119.580 118.750 0.830 25757 3402 1 5 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.982 0.107 25757 3403 1 5 . 1 1 11 11 GLU C C 11 179.561 179.561 178.819 0.742 25757 3404 1 5 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.779 0.106 25757 3405 1 5 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.891 0.572 25757 3406 1 5 . 1 1 11 11 GLU H H 11 7.741 7.741 8.478 -0.737 25757 3407 1 5 . 1 1 12 12 PHE N N 12 118.509 118.509 117.738 0.771 25757 3408 1 5 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.301 0.525 25757 3409 1 5 . 1 1 12 12 PHE C C 12 179.000 179.000 178.327 0.673 25757 3410 1 5 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.925 0.239 25757 3411 1 5 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.952 0.159 25757 3412 1 5 . 1 1 12 12 PHE H H 12 8.470 8.470 7.413 1.057 25757 3413 1 5 . 1 1 13 13 LYS N N 13 123.523 123.523 119.948 3.575 25757 3414 1 5 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.137 -0.111 25757 3415 1 5 . 1 1 13 13 LYS C C 13 179.260 179.260 179.267 -0.007 25757 3416 1 5 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.942 0.222 25757 3417 1 5 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.228 -0.395 25757 3418 1 5 . 1 1 13 13 LYS H H 13 9.171 9.171 8.447 0.724 25757 3419 1 5 . 1 1 14 14 GLU N N 14 120.415 120.415 118.768 1.647 25757 3420 1 5 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.253 -0.158 25757 3421 1 5 . 1 1 14 14 GLU C C 14 179.851 179.851 178.997 0.854 25757 3422 1 5 . 1 1 14 14 GLU CA C 14 59.586 59.586 58.889 0.697 25757 3423 1 5 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.727 -0.166 25757 3424 1 5 . 1 1 14 14 GLU H H 14 7.822 7.822 8.165 -0.343 25757 3425 1 5 . 1 1 15 15 ALA N N 15 122.143 122.143 122.669 -0.526 25757 3426 1 5 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.238 -0.108 25757 3427 1 5 . 1 1 15 15 ALA C C 15 178.222 178.222 179.538 -1.316 25757 3428 1 5 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.331 -0.141 25757 3429 1 5 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.681 -0.179 25757 3430 1 5 . 1 1 15 15 ALA H H 15 8.244 8.244 8.500 -0.256 25757 3431 1 5 . 1 1 16 16 PHE N N 16 119.809 119.809 118.353 1.456 25757 3432 1 5 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.397 -0.385 25757 3433 1 5 . 1 1 16 16 PHE C C 16 177.444 177.444 176.825 0.619 25757 3434 1 5 . 1 1 16 16 PHE CA C 16 62.064 62.064 59.853 2.211 25757 3435 1 5 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.202 -0.770 25757 3436 1 5 . 1 1 16 16 PHE H H 16 8.891 8.891 8.426 0.465 25757 3437 1 5 . 1 1 17 17 SER N N 17 112.631 112.631 117.126 -4.495 25757 3438 1 5 . 1 1 17 17 SER HA H 17 4.034 4.034 3.981 0.053 25757 3439 1 5 . 1 1 17 17 SER C C 17 174.675 174.675 176.013 -1.338 25757 3440 1 5 . 1 1 17 17 SER CA C 17 61.507 61.507 61.934 -0.427 25757 3441 1 5 . 1 1 17 17 SER CB C 17 63.414 63.414 63.579 -0.165 25757 3442 1 5 . 1 1 17 17 SER H H 17 7.910 7.910 8.431 -0.521 25757 3443 1 5 . 1 1 18 18 LEU N N 18 120.614 120.614 117.848 2.766 25757 3444 1 5 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.245 -0.233 25757 3445 1 5 . 1 1 18 18 LEU C C 18 177.366 177.366 177.919 -0.553 25757 3446 1 5 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.258 0.129 25757 3447 1 5 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.886 -0.291 25757 3448 1 5 . 1 1 18 18 LEU H H 18 7.423 7.423 7.843 -0.420 25757 3449 1 5 . 1 1 19 19 PHE N N 19 114.602 114.602 117.696 -3.094 25757 3450 1 5 . 1 1 19 19 PHE C C 19 176.961 176.961 176.250 0.711 25757 3451 1 5 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.660 -1.175 25757 3452 1 5 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.242 1.526 25757 3453 1 5 . 1 1 19 19 PHE H H 19 7.254 7.254 7.179 0.075 25757 3454 1 5 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.678 -0.102 25757 3455 1 5 . 1 1 22 22 ASP CA C 22 52.648 52.648 53.464 -0.816 25757 3456 1 5 . 1 1 22 22 ASP CB C 22 40.010 40.010 41.102 -1.092 25757 3457 1 5 . 1 1 23 23 GLY N N 23 108.244 108.244 109.288 -1.044 25757 3458 1 5 . 1 1 23 23 GLY C C 23 175.188 175.188 175.479 -0.291 25757 3459 1 5 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.367 1.036 25757 3460 1 5 . 1 1 23 23 GLY H H 23 7.555 7.555 7.724 -0.169 25757 3461 1 5 . 1 1 24 24 ASP N N 24 120.667 120.667 119.975 0.692 25757 3462 1 5 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.533 -0.064 25757 3463 1 5 . 1 1 24 24 ASP C C 24 177.457 177.457 177.874 -0.417 25757 3464 1 5 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.420 0.372 25757 3465 1 5 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.107 -0.591 25757 3466 1 5 . 1 1 24 24 ASP H H 24 8.397 8.397 8.088 0.309 25757 3467 1 5 . 1 1 25 25 GLY N N 25 112.989 112.989 108.221 4.768 25757 3468 1 5 . 1 1 25 25 GLY C C 25 173.639 173.639 173.494 0.145 25757 3469 1 5 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.133 0.368 25757 3470 1 5 . 1 1 25 25 GLY H H 25 10.592 10.592 8.090 2.502 25757 3471 1 5 . 1 1 26 26 THR N N 26 112.948 112.948 113.099 -0.151 25757 3472 1 5 . 1 1 26 26 THR HA H 26 5.282 5.282 4.983 0.299 25757 3473 1 5 . 1 1 26 26 THR C C 26 172.853 172.853 172.681 0.172 25757 3474 1 5 . 1 1 26 26 THR CA C 26 59.817 59.817 61.617 -1.800 25757 3475 1 5 . 1 1 26 26 THR CB C 26 72.465 72.465 71.311 1.154 25757 3476 1 5 . 1 1 26 26 THR H H 26 8.121 8.121 8.210 -0.089 25757 3477 1 5 . 1 1 27 27 ILE N N 27 127.195 127.195 124.234 2.961 25757 3478 1 5 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.824 0.089 25757 3479 1 5 . 1 1 27 27 ILE C C 27 176.091 176.091 174.877 1.214 25757 3480 1 5 . 1 1 27 27 ILE CA C 27 60.765 60.765 59.907 0.858 25757 3481 1 5 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.309 -1.604 25757 3482 1 5 . 1 1 27 27 ILE H H 27 9.867 9.867 8.555 1.312 25757 3483 1 5 . 1 1 28 28 THR N N 28 116.655 116.655 120.555 -3.900 25757 3484 1 5 . 1 1 28 28 THR HA H 28 4.790 4.790 4.745 0.045 25757 3485 1 5 . 1 1 28 28 THR C C 28 176.696 176.696 176.350 0.346 25757 3486 1 5 . 1 1 28 28 THR CA C 28 59.590 59.590 59.977 -0.387 25757 3487 1 5 . 1 1 28 28 THR CB C 28 72.457 72.457 70.870 1.587 25757 3488 1 5 . 1 1 28 28 THR H H 28 8.457 8.457 8.374 0.083 25757 3489 1 5 . 1 1 29 29 THR N N 29 111.878 111.878 116.593 -4.715 25757 3490 1 5 . 1 1 29 29 THR HA H 29 4.188 4.188 3.978 0.210 25757 3491 1 5 . 1 1 29 29 THR C C 29 177.399 177.399 176.277 1.122 25757 3492 1 5 . 1 1 29 29 THR CA C 29 66.386 66.386 66.591 -0.205 25757 3493 1 5 . 1 1 29 29 THR CB C 29 67.726 67.726 68.397 -0.671 25757 3494 1 5 . 1 1 29 29 THR H H 29 9.211 9.211 8.938 0.273 25757 3495 1 5 . 1 1 30 30 LYS N N 30 121.140 121.140 121.883 -0.743 25757 3496 1 5 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.943 0.134 25757 3497 1 5 . 1 1 30 30 LYS C C 30 179.793 179.793 178.355 1.438 25757 3498 1 5 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.981 -0.689 25757 3499 1 5 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.156 0.291 25757 3500 1 5 . 1 1 30 30 LYS H H 30 7.580 7.580 7.686 -0.106 25757 3501 1 5 . 1 1 31 31 GLU N N 31 121.865 121.865 119.270 2.595 25757 3502 1 5 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.897 0.097 25757 3503 1 5 . 1 1 31 31 GLU C C 31 179.355 179.355 178.965 0.390 25757 3504 1 5 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.916 -0.284 25757 3505 1 5 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.428 0.423 25757 3506 1 5 . 1 1 31 31 GLU H H 31 7.708 7.708 7.658 0.050 25757 3507 1 5 . 1 1 32 32 LEU N N 32 120.597 120.597 117.518 3.079 25757 3508 1 5 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.085 0.031 25757 3509 1 5 . 1 1 32 32 LEU C C 32 178.885 178.885 179.181 -0.296 25757 3510 1 5 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.264 0.097 25757 3511 1 5 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.996 2.040 25757 3512 1 5 . 1 1 32 32 LEU H H 32 8.688 8.688 7.673 1.015 25757 3513 1 5 . 1 1 33 33 GLY N N 33 104.837 104.837 107.775 -2.938 25757 3514 1 5 . 1 1 33 33 GLY C C 33 175.123 175.123 175.812 -0.689 25757 3515 1 5 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.402 0.845 25757 3516 1 5 . 1 1 33 33 GLY H H 33 8.694 8.694 8.348 0.346 25757 3517 1 5 . 1 1 34 34 THR N N 34 117.631 117.631 118.000 -0.369 25757 3518 1 5 . 1 1 34 34 THR HA H 34 3.899 3.899 4.050 -0.151 25757 3519 1 5 . 1 1 34 34 THR C C 34 176.951 176.951 176.803 0.148 25757 3520 1 5 . 1 1 34 34 THR CA C 34 67.234 67.234 65.667 1.567 25757 3521 1 5 . 1 1 34 34 THR CB C 34 68.863 68.863 68.772 0.091 25757 3522 1 5 . 1 1 34 34 THR H H 34 7.960 7.960 7.956 0.004 25757 3523 1 5 . 1 1 35 35 VAL N N 35 121.659 121.659 121.121 0.538 25757 3524 1 5 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.583 -0.066 25757 3525 1 5 . 1 1 35 35 VAL C C 35 178.265 178.265 177.334 0.931 25757 3526 1 5 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.683 -0.007 25757 3527 1 5 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.232 0.061 25757 3528 1 5 . 1 1 35 35 VAL H H 35 7.358 7.358 8.384 -1.026 25757 3529 1 5 . 1 1 36 36 MET N N 36 117.456 117.456 118.459 -1.003 25757 3530 1 5 . 1 1 36 36 MET C C 36 179.088 179.088 178.209 0.879 25757 3531 1 5 . 1 1 36 36 MET CA C 36 60.477 60.477 58.527 1.950 25757 3532 1 5 . 1 1 36 36 MET CB C 36 32.443 32.443 33.099 -0.656 25757 3533 1 5 . 1 1 36 36 MET H H 36 8.194 8.194 7.933 0.261 25757 3534 1 5 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.610 0.537 25757 3535 1 5 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.195 1.155 25757 3536 1 5 . 1 1 38 38 SER HA H 38 4.085 4.085 4.281 -0.196 25757 3537 1 5 . 1 1 38 38 SER C C 38 173.788 173.788 174.597 -0.809 25757 3538 1 5 . 1 1 38 38 SER CA C 38 61.617 61.617 61.465 0.152 25757 3539 1 5 . 1 1 38 38 SER CB C 38 62.943 62.943 62.976 -0.033 25757 3540 1 5 . 1 1 39 39 LEU N N 39 119.003 119.003 117.646 1.357 25757 3541 1 5 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.408 0.086 25757 3542 1 5 . 1 1 39 39 LEU C C 39 176.470 176.470 176.916 -0.446 25757 3543 1 5 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.413 0.267 25757 3544 1 5 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.024 1.490 25757 3545 1 5 . 1 1 39 39 LEU H H 39 7.230 7.230 7.347 -0.117 25757 3546 1 5 . 1 1 40 40 GLY N N 40 105.026 105.026 106.189 -1.163 25757 3547 1 5 . 1 1 40 40 GLY C C 40 174.322 174.322 174.518 -0.196 25757 3548 1 5 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.134 1.081 25757 3549 1 5 . 1 1 40 40 GLY H H 40 7.698 7.698 7.954 -0.256 25757 3550 1 5 . 1 1 41 41 GLN N N 41 117.929 117.929 118.987 -1.058 25757 3551 1 5 . 1 1 41 41 GLN C C 41 174.557 174.557 174.514 0.043 25757 3552 1 5 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.458 0.386 25757 3553 1 5 . 1 1 41 41 GLN H H 41 7.866 7.866 7.428 0.438 25757 3554 1 5 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.573 0.163 25757 3555 1 5 . 1 1 43 43 PRO C C 43 177.805 177.805 175.940 1.865 25757 3556 1 5 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.112 -0.607 25757 3557 1 5 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.292 -0.131 25757 3558 1 5 . 1 1 44 44 THR N N 44 113.167 113.167 114.815 -1.648 25757 3559 1 5 . 1 1 44 44 THR HA H 44 4.684 4.684 4.528 0.156 25757 3560 1 5 . 1 1 44 44 THR C C 44 175.139 175.139 175.520 -0.381 25757 3561 1 5 . 1 1 44 44 THR CA C 44 60.556 60.556 59.485 1.071 25757 3562 1 5 . 1 1 44 44 THR CB C 44 71.064 71.064 70.933 0.131 25757 3563 1 5 . 1 1 44 44 THR H H 44 8.798 8.798 7.560 1.238 25757 3564 1 5 . 1 1 45 45 GLU N N 45 120.673 120.673 120.988 -0.315 25757 3565 1 5 . 1 1 45 45 GLU HA H 45 3.991 3.991 4.030 -0.039 25757 3566 1 5 . 1 1 45 45 GLU C C 45 178.940 178.940 178.730 0.210 25757 3567 1 5 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.978 -0.077 25757 3568 1 5 . 1 1 45 45 GLU CB C 45 29.029 29.029 28.970 0.059 25757 3569 1 5 . 1 1 45 45 GLU H H 45 8.812 8.812 8.906 -0.094 25757 3570 1 5 . 1 1 46 46 ALA N N 46 120.576 120.576 119.407 1.169 25757 3571 1 5 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.114 -0.147 25757 3572 1 5 . 1 1 46 46 ALA C C 46 180.290 180.290 179.874 0.416 25757 3573 1 5 . 1 1 46 46 ALA CA C 46 54.919 54.919 54.970 -0.051 25757 3574 1 5 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.291 -0.130 25757 3575 1 5 . 1 1 46 46 ALA H H 46 8.276 8.276 8.398 -0.122 25757 3576 1 5 . 1 1 47 47 GLU N N 47 116.104 116.104 119.231 -3.127 25757 3577 1 5 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.048 -0.048 25757 3578 1 5 . 1 1 47 47 GLU C C 47 180.224 180.224 179.064 1.160 25757 3579 1 5 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.466 -0.535 25757 3580 1 5 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.491 0.498 25757 3581 1 5 . 1 1 47 47 GLU H H 47 7.425 7.425 7.756 -0.331 25757 3582 1 5 . 1 1 48 48 LEU N N 48 120.425 120.425 119.702 0.723 25757 3583 1 5 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.957 0.093 25757 3584 1 5 . 1 1 48 48 LEU C C 48 178.551 178.551 179.153 -0.602 25757 3585 1 5 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.374 -0.535 25757 3586 1 5 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.399 1.170 25757 3587 1 5 . 1 1 48 48 LEU H H 48 8.121 8.121 8.126 -0.005 25757 3588 1 5 . 1 1 49 49 GLN N N 49 118.372 118.372 118.179 0.193 25757 3589 1 5 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.835 -0.073 25757 3590 1 5 . 1 1 49 49 GLN C C 49 178.567 178.567 178.178 0.389 25757 3591 1 5 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.409 -0.546 25757 3592 1 5 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.502 -0.260 25757 3593 1 5 . 1 1 49 49 GLN H H 49 8.302 8.302 8.344 -0.042 25757 3594 1 5 . 1 1 50 50 ASP N N 50 119.992 119.992 120.503 -0.511 25757 3595 1 5 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.341 0.019 25757 3596 1 5 . 1 1 50 50 ASP C C 50 178.600 178.600 178.572 0.028 25757 3597 1 5 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.175 0.528 25757 3598 1 5 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.798 -0.331 25757 3599 1 5 . 1 1 50 50 ASP H H 50 8.150 8.150 8.075 0.075 25757 3600 1 5 . 1 1 51 51 MET N N 51 119.238 119.238 118.757 0.481 25757 3601 1 5 . 1 1 51 51 MET HA H 51 3.981 3.981 3.894 0.087 25757 3602 1 5 . 1 1 51 51 MET C C 51 179.006 179.006 178.859 0.147 25757 3603 1 5 . 1 1 51 51 MET CA C 51 59.443 59.443 60.007 -0.564 25757 3604 1 5 . 1 1 51 51 MET CB C 51 33.380 33.380 32.764 0.616 25757 3605 1 5 . 1 1 51 51 MET H H 51 7.844 7.844 7.973 -0.129 25757 3606 1 5 . 1 1 52 52 ILE N N 52 118.161 118.161 118.602 -0.441 25757 3607 1 5 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.697 -0.219 25757 3608 1 5 . 1 1 52 52 ILE C C 52 177.847 177.847 178.911 -1.064 25757 3609 1 5 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.174 0.821 25757 3610 1 5 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.636 0.487 25757 3611 1 5 . 1 1 52 52 ILE H H 52 7.686 7.686 8.302 -0.616 25757 3612 1 5 . 1 1 53 53 ASN N N 53 117.884 117.884 117.803 0.081 25757 3613 1 5 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.489 -0.124 25757 3614 1 5 . 1 1 53 53 ASN C C 53 177.515 177.515 177.645 -0.130 25757 3615 1 5 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.609 0.598 25757 3616 1 5 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.444 -0.366 25757 3617 1 5 . 1 1 53 53 ASN H H 53 8.713 8.713 8.433 0.280 25757 3618 1 5 . 1 1 54 54 GLU N N 54 116.178 116.178 117.601 -1.423 25757 3619 1 5 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.271 -0.282 25757 3620 1 5 . 1 1 54 54 GLU C C 54 177.557 177.557 177.095 0.462 25757 3621 1 5 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.936 1.054 25757 3622 1 5 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.442 0.021 25757 3623 1 5 . 1 1 54 54 GLU H H 54 7.530 7.530 8.039 -0.509 25757 3624 1 5 . 1 1 55 55 VAL N N 55 107.164 107.164 111.498 -4.334 25757 3625 1 5 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.373 0.149 25757 3626 1 5 . 1 1 55 55 VAL C C 55 175.602 175.602 174.656 0.946 25757 3627 1 5 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.497 -0.145 25757 3628 1 5 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.324 0.279 25757 3629 1 5 . 1 1 55 55 VAL H H 55 7.175 7.175 7.493 -0.318 25757 3630 1 5 . 1 1 56 56 ASP N N 56 122.126 122.126 121.414 0.712 25757 3631 1 5 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.965 -0.366 25757 3632 1 5 . 1 1 56 56 ASP C C 56 176.182 176.182 176.069 0.113 25757 3633 1 5 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.631 0.175 25757 3634 1 5 . 1 1 56 56 ASP CB C 56 40.270 40.270 41.042 -0.772 25757 3635 1 5 . 1 1 56 56 ASP H H 56 7.569 7.569 7.515 0.054 25757 3636 1 5 . 1 1 57 57 ALA N N 57 103.782 103.782 129.127 -25.345 25757 3637 1 5 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.110 0.070 25757 3638 1 5 . 1 1 57 57 ALA C C 57 178.584 178.584 178.129 0.455 25757 3639 1 5 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.989 0.356 25757 3640 1 5 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.757 -0.233 25757 3641 1 5 . 1 1 57 57 ALA H H 57 8.515 8.515 8.818 -0.303 25757 3642 1 5 . 1 1 58 58 ASP N N 58 113.602 113.602 116.110 -2.508 25757 3643 1 5 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.632 -0.046 25757 3644 1 5 . 1 1 58 58 ASP C C 58 177.756 177.756 177.127 0.629 25757 3645 1 5 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.139 -1.377 25757 3646 1 5 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.947 -2.268 25757 3647 1 5 . 1 1 58 58 ASP H H 58 8.130 8.130 8.147 -0.017 25757 3648 1 5 . 1 1 59 59 GLY N N 59 109.195 109.195 110.955 -1.760 25757 3649 1 5 . 1 1 59 59 GLY C C 59 175.139 175.139 174.526 0.613 25757 3650 1 5 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.236 2.028 25757 3651 1 5 . 1 1 59 59 GLY H H 59 7.694 7.694 8.224 -0.530 25757 3652 1 5 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.767 -0.162 25757 3653 1 5 . 1 1 61 61 GLY N N 61 113.316 113.316 109.838 3.478 25757 3654 1 5 . 1 1 61 61 GLY C C 61 173.234 173.234 173.064 0.170 25757 3655 1 5 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.068 0.630 25757 3656 1 5 . 1 1 61 61 GLY H H 61 10.633 10.633 8.550 2.083 25757 3657 1 5 . 1 1 62 62 THR N N 62 108.892 108.892 109.579 -0.687 25757 3658 1 5 . 1 1 62 62 THR HA H 62 4.736 4.736 4.898 -0.162 25757 3659 1 5 . 1 1 62 62 THR C C 62 173.091 173.091 172.115 0.976 25757 3660 1 5 . 1 1 62 62 THR CA C 62 59.617 59.617 59.555 0.062 25757 3661 1 5 . 1 1 62 62 THR CB C 62 72.004 72.004 72.266 -0.262 25757 3662 1 5 . 1 1 62 62 THR H H 62 7.673 7.673 8.224 -0.551 25757 3663 1 5 . 1 1 63 63 ILE N N 63 123.324 123.324 120.506 2.818 25757 3664 1 5 . 1 1 63 63 ILE HA H 63 5.129 5.129 5.021 0.108 25757 3665 1 5 . 1 1 63 63 ILE C C 63 175.652 175.652 175.258 0.394 25757 3666 1 5 . 1 1 63 63 ILE CA C 63 60.486 60.486 59.834 0.652 25757 3667 1 5 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.442 -1.485 25757 3668 1 5 . 1 1 63 63 ILE H H 63 8.907 8.907 8.327 0.580 25757 3669 1 5 . 1 1 64 64 ASP N N 64 128.253 128.253 126.607 1.646 25757 3670 1 5 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.995 0.326 25757 3671 1 5 . 1 1 64 64 ASP C C 64 176.431 176.431 177.470 -1.039 25757 3672 1 5 . 1 1 64 64 ASP CA C 64 52.331 52.331 52.892 -0.561 25757 3673 1 5 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.319 -0.266 25757 3674 1 5 . 1 1 64 64 ASP H H 64 8.864 8.864 9.039 -0.175 25757 3675 1 5 . 1 1 65 65 PHE N N 65 118.583 118.583 120.362 -1.779 25757 3676 1 5 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.059 -0.199 25757 3677 1 5 . 1 1 65 65 PHE C C 65 173.458 173.458 175.106 -1.648 25757 3678 1 5 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.707 0.092 25757 3679 1 5 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.142 -1.262 25757 3680 1 5 . 1 1 65 65 PHE H H 65 8.962 8.962 8.988 -0.026 25757 3681 1 5 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.337 -0.219 25757 3682 1 5 . 1 1 66 66 PRO C C 66 180.038 180.038 178.547 1.491 25757 3683 1 5 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.505 1.185 25757 3684 1 5 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.168 -0.491 25757 3685 1 5 . 1 1 67 67 GLU N N 67 118.402 118.402 119.181 -0.779 25757 3686 1 5 . 1 1 67 67 GLU C C 67 178.737 178.737 178.836 -0.099 25757 3687 1 5 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.829 -0.821 25757 3688 1 5 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.249 0.436 25757 3689 1 5 . 1 1 67 67 GLU H H 67 7.953 7.953 8.510 -0.557 25757 3690 1 5 . 1 1 68 68 PHE N N 68 123.421 123.421 119.459 3.962 25757 3691 1 5 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.110 -0.138 25757 3692 1 5 . 1 1 68 68 PHE C C 68 177.184 177.184 177.524 -0.340 25757 3693 1 5 . 1 1 68 68 PHE CA C 68 61.338 61.338 60.986 0.352 25757 3694 1 5 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.893 1.076 25757 3695 1 5 . 1 1 68 68 PHE H H 68 8.928 8.928 7.540 1.388 25757 3696 1 5 . 1 1 69 69 LEU N N 69 119.284 119.284 119.374 -0.090 25757 3697 1 5 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.628 -0.293 25757 3698 1 5 . 1 1 69 69 LEU C C 69 178.987 178.987 178.578 0.409 25757 3699 1 5 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.736 -0.874 25757 3700 1 5 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.635 -0.803 25757 3701 1 5 . 1 1 69 69 LEU H H 69 8.374 8.374 7.674 0.700 25757 3702 1 5 . 1 1 70 70 THR N N 70 116.017 116.017 115.519 0.498 25757 3703 1 5 . 1 1 70 70 THR HA H 70 4.338 4.338 3.817 0.521 25757 3704 1 5 . 1 1 70 70 THR C C 70 176.169 176.169 176.643 -0.474 25757 3705 1 5 . 1 1 70 70 THR CA C 70 66.700 66.700 66.567 0.133 25757 3706 1 5 . 1 1 70 70 THR CB C 70 68.379 68.379 68.554 -0.175 25757 3707 1 5 . 1 1 70 70 THR H H 70 7.493 7.493 8.137 -0.644 25757 3708 1 5 . 1 1 71 71 MET N N 71 121.915 121.915 121.753 0.162 25757 3709 1 5 . 1 1 71 71 MET HA H 71 3.718 3.718 3.993 -0.275 25757 3710 1 5 . 1 1 71 71 MET C C 71 178.190 178.190 177.577 0.613 25757 3711 1 5 . 1 1 71 71 MET CA C 71 59.335 59.335 58.307 1.028 25757 3712 1 5 . 1 1 71 71 MET CB C 71 33.894 33.894 32.003 1.891 25757 3713 1 5 . 1 1 71 71 MET H H 71 7.924 7.924 7.956 -0.032 25757 3714 1 5 . 1 1 72 72 MET N N 72 116.973 116.973 117.007 -0.034 25757 3715 1 5 . 1 1 72 72 MET HA H 72 3.968 3.968 4.079 -0.111 25757 3716 1 5 . 1 1 72 72 MET C C 72 178.211 178.211 178.428 -0.217 25757 3717 1 5 . 1 1 72 72 MET CA C 72 56.059 56.059 58.524 -2.465 25757 3718 1 5 . 1 1 72 72 MET CB C 72 31.639 31.639 32.888 -1.249 25757 3719 1 5 . 1 1 72 72 MET H H 72 8.276 8.276 7.842 0.434 25757 3720 1 5 . 1 1 73 73 ALA N N 73 122.499 122.499 121.939 0.560 25757 3721 1 5 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.911 0.039 25757 3722 1 5 . 1 1 73 73 ALA C C 73 180.231 180.231 179.650 0.581 25757 3723 1 5 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.770 0.183 25757 3724 1 5 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.794 0.238 25757 3725 1 5 . 1 1 73 73 ALA H H 73 8.240 8.240 8.283 -0.043 25757 3726 1 5 . 1 1 74 74 ARG N N 74 116.098 116.098 118.805 -2.707 25757 3727 1 5 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.962 0.030 25757 3728 1 5 . 1 1 74 74 ARG C C 74 178.567 178.567 178.854 -0.287 25757 3729 1 5 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.218 -0.392 25757 3730 1 5 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.203 -0.128 25757 3731 1 5 . 1 1 74 74 ARG H H 74 7.420 7.420 8.190 -0.770 25757 3732 1 5 . 1 1 75 75 LYS N N 75 119.046 119.046 119.927 -0.881 25757 3733 1 5 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.096 -0.053 25757 3734 1 5 . 1 1 75 75 LYS C C 75 179.045 179.045 178.348 0.697 25757 3735 1 5 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.753 -0.864 25757 3736 1 5 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.552 0.214 25757 3737 1 5 . 1 1 75 75 LYS H H 75 7.862 7.862 8.180 -0.318 25757 3738 1 5 . 1 1 76 76 MET N N 76 116.772 116.772 119.423 -2.651 25757 3739 1 5 . 1 1 76 76 MET H H 76 8.099 8.099 7.944 0.155 25757 3740 1 5 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.485 0.149 25757 3741 1 5 . 1 1 78 78 ASP C C 78 176.395 176.395 176.884 -0.489 25757 3742 1 5 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.720 -0.076 25757 3743 1 5 . 1 1 78 78 ASP CB C 78 41.474 41.474 40.945 0.529 25757 3744 1 5 . 1 1 79 79 THR N N 79 113.904 113.904 111.431 2.473 25757 3745 1 5 . 1 1 79 79 THR HA H 79 4.215 4.215 4.322 -0.107 25757 3746 1 5 . 1 1 79 79 THR C C 79 174.204 174.204 174.941 -0.737 25757 3747 1 5 . 1 1 79 79 THR CA C 79 62.264 62.264 62.976 -0.712 25757 3748 1 5 . 1 1 79 79 THR CB C 79 69.884 69.884 69.471 0.413 25757 3749 1 5 . 1 1 79 79 THR H H 79 8.039 8.039 8.434 -0.395 25757 3750 1 5 . 1 1 80 80 ASP N N 80 123.572 123.572 122.222 1.350 25757 3751 1 5 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.918 -0.198 25757 3752 1 5 . 1 1 80 80 ASP C C 80 176.221 176.221 176.390 -0.169 25757 3753 1 5 . 1 1 80 80 ASP CA C 80 54.315 54.315 53.774 0.541 25757 3754 1 5 . 1 1 80 80 ASP CB C 80 41.427 41.427 43.233 -1.806 25757 3755 1 5 . 1 1 80 80 ASP H H 80 8.441 8.441 8.350 0.092 25757 3756 1 5 . 1 1 81 81 SER N N 81 117.879 117.879 114.828 3.051 25757 3757 1 5 . 1 1 81 81 SER HA H 81 3.925 3.925 4.643 -0.718 25757 3758 1 5 . 1 1 81 81 SER C C 81 175.264 175.264 175.640 -0.376 25757 3759 1 5 . 1 1 81 81 SER CA C 81 58.860 58.860 58.801 0.059 25757 3760 1 5 . 1 1 81 81 SER CB C 81 63.790 63.790 64.061 -0.271 25757 3761 1 5 . 1 1 81 81 SER H H 81 8.503 8.503 8.554 -0.051 25757 3762 1 5 . 1 1 82 82 GLU N N 82 123.206 123.206 122.210 0.996 25757 3763 1 5 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.939 0.119 25757 3764 1 5 . 1 1 82 82 GLU C C 82 178.378 178.378 178.589 -0.211 25757 3765 1 5 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.230 -0.644 25757 3766 1 5 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.488 0.115 25757 3767 1 5 . 1 1 82 82 GLU H H 82 8.563 8.563 8.722 -0.159 25757 3768 1 5 . 1 1 83 83 GLU N N 83 119.262 119.262 118.402 0.860 25757 3769 1 5 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.929 0.028 25757 3770 1 5 . 1 1 83 83 GLU C C 83 178.606 178.606 179.043 -0.437 25757 3771 1 5 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.700 -0.031 25757 3772 1 5 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.092 0.263 25757 3773 1 5 . 1 1 83 83 GLU H H 83 7.728 7.728 8.499 -0.771 25757 3774 1 5 . 1 1 84 84 GLU N N 84 118.432 118.432 119.724 -1.292 25757 3775 1 5 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.132 -0.025 25757 3776 1 5 . 1 1 84 84 GLU C C 84 179.436 179.436 178.843 0.593 25757 3777 1 5 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.985 0.518 25757 3778 1 5 . 1 1 84 84 GLU CB C 84 29.107 29.107 28.775 0.332 25757 3779 1 5 . 1 1 84 84 GLU H H 84 8.346 8.346 7.803 0.543 25757 3780 1 5 . 1 1 85 85 ILE N N 85 120.925 120.925 120.160 0.765 25757 3781 1 5 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.870 -0.122 25757 3782 1 5 . 1 1 85 85 ILE C C 85 177.661 177.661 178.525 -0.864 25757 3783 1 5 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.505 0.985 25757 3784 1 5 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.824 0.607 25757 3785 1 5 . 1 1 85 85 ILE H H 85 7.821 7.821 8.259 -0.438 25757 3786 1 5 . 1 1 86 86 ARG N N 86 121.916 121.916 119.263 2.653 25757 3787 1 5 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.740 0.396 25757 3788 1 5 . 1 1 86 86 ARG C C 86 179.208 179.208 178.819 0.389 25757 3789 1 5 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.780 0.591 25757 3790 1 5 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.869 0.229 25757 3791 1 5 . 1 1 86 86 ARG H H 86 8.432 8.432 8.214 0.218 25757 3792 1 5 . 1 1 87 87 GLU N N 87 118.261 118.261 118.922 -0.661 25757 3793 1 5 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.878 0.234 25757 3794 1 5 . 1 1 87 87 GLU C C 87 178.516 178.516 178.680 -0.164 25757 3795 1 5 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.177 -0.152 25757 3796 1 5 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.335 -0.165 25757 3797 1 5 . 1 1 87 87 GLU H H 87 8.225 8.225 8.191 0.034 25757 3798 1 5 . 1 1 88 88 ALA N N 88 121.009 121.009 122.755 -1.746 25757 3799 1 5 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.464 0.363 25757 3800 1 5 . 1 1 88 88 ALA C C 88 177.947 177.947 178.062 -0.115 25757 3801 1 5 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.880 -0.019 25757 3802 1 5 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.350 -0.395 25757 3803 1 5 . 1 1 88 88 ALA H H 88 7.789 7.789 7.957 -0.168 25757 3804 1 5 . 1 1 89 89 PHE N N 89 117.164 117.164 118.460 -1.296 25757 3805 1 5 . 1 1 89 89 PHE C C 89 176.134 176.134 177.425 -1.291 25757 3806 1 5 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.452 2.198 25757 3807 1 5 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.838 0.055 25757 3808 1 5 . 1 1 89 89 PHE H H 89 8.337 8.337 7.365 0.972 25757 3809 1 5 . 1 1 90 90 ARG N N 90 114.900 114.900 117.555 -2.655 25757 3810 1 5 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.917 -0.003 25757 3811 1 5 . 1 1 90 90 ARG C C 90 178.296 178.296 177.307 0.989 25757 3812 1 5 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.717 0.362 25757 3813 1 5 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.604 -0.511 25757 3814 1 5 . 1 1 90 90 ARG H H 90 7.681 7.681 7.708 -0.027 25757 3815 1 5 . 1 1 91 91 VAL N N 91 116.927 116.927 115.512 1.415 25757 3816 1 5 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.931 -0.324 25757 3817 1 5 . 1 1 91 91 VAL C C 91 177.964 177.964 176.952 1.012 25757 3818 1 5 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.547 1.413 25757 3819 1 5 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.414 0.205 25757 3820 1 5 . 1 1 91 91 VAL H H 91 7.405 7.405 7.514 -0.109 25757 3821 1 5 . 1 1 92 92 PHE N N 92 119.026 119.026 117.888 1.138 25757 3822 1 5 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.315 0.047 25757 3823 1 5 . 1 1 92 92 PHE C C 92 177.639 177.639 176.232 1.407 25757 3824 1 5 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.714 -0.993 25757 3825 1 5 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.701 -0.274 25757 3826 1 5 . 1 1 92 92 PHE H H 92 7.886 7.886 7.473 0.413 25757 3827 1 5 . 1 1 93 93 ASP N N 93 118.238 118.238 118.930 -0.692 25757 3828 1 5 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.717 -0.255 25757 3829 1 5 . 1 1 93 93 ASP C C 93 176.979 176.979 176.326 0.653 25757 3830 1 5 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.371 -1.224 25757 3831 1 5 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.562 -1.413 25757 3832 1 5 . 1 1 93 93 ASP H H 93 8.009 8.009 7.373 0.636 25757 3833 1 5 . 1 1 94 94 LYS N N 94 125.792 125.792 125.011 0.781 25757 3834 1 5 . 1 1 94 94 LYS C C 94 178.213 178.213 177.984 0.229 25757 3835 1 5 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.977 0.341 25757 3836 1 5 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.571 -1.543 25757 3837 1 5 . 1 1 94 94 LYS H H 94 7.428 7.428 8.072 -0.644 25757 3838 1 5 . 1 1 95 95 ASP N N 95 113.833 113.833 115.814 -1.981 25757 3839 1 5 . 1 1 95 95 ASP C C 95 177.718 177.718 177.387 0.331 25757 3840 1 5 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.282 -1.337 25757 3841 1 5 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.536 -0.793 25757 3842 1 5 . 1 1 95 95 ASP H H 95 8.159 8.159 7.912 0.247 25757 3843 1 5 . 1 1 96 96 GLY N N 96 109.414 109.414 107.649 1.765 25757 3844 1 5 . 1 1 96 96 GLY C C 96 175.093 175.093 175.231 -0.138 25757 3845 1 5 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.822 1.432 25757 3846 1 5 . 1 1 96 96 GLY H H 96 7.848 7.848 8.046 -0.198 25757 3847 1 5 . 1 1 97 97 ASN N N 97 119.590 119.590 118.575 1.015 25757 3848 1 5 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.513 0.099 25757 3849 1 5 . 1 1 97 97 ASN C C 97 175.937 175.937 176.561 -0.624 25757 3850 1 5 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.838 -0.950 25757 3851 1 5 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.698 -1.378 25757 3852 1 5 . 1 1 97 97 ASN H H 97 8.338 8.338 8.525 -0.187 25757 3853 1 5 . 1 1 98 98 GLY N N 98 112.940 112.940 107.887 5.053 25757 3854 1 5 . 1 1 98 98 GLY C C 98 172.429 172.429 172.741 -0.312 25757 3855 1 5 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.030 0.062 25757 3856 1 5 . 1 1 98 98 GLY H H 98 10.695 10.695 8.887 1.808 25757 3857 1 5 . 1 1 99 99 TYR N N 99 115.544 115.544 118.264 -2.720 25757 3858 1 5 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.203 -0.116 25757 3859 1 5 . 1 1 99 99 TYR C C 99 174.859 174.859 174.725 0.134 25757 3860 1 5 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.472 -1.454 25757 3861 1 5 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.010 1.343 25757 3862 1 5 . 1 1 99 99 TYR H H 99 7.597 7.597 8.565 -0.968 25757 3863 1 5 . 1 1 100 100 ILE N N 100 127.078 127.078 125.482 1.596 25757 3864 1 5 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.605 0.184 25757 3865 1 5 . 1 1 100 100 ILE C C 100 175.387 175.387 175.851 -0.464 25757 3866 1 5 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.207 -0.201 25757 3867 1 5 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.310 -0.520 25757 3868 1 5 . 1 1 100 100 ILE H H 100 10.267 10.267 9.401 0.866 25757 3869 1 5 . 1 1 101 101 SER N N 101 124.102 124.102 122.593 1.509 25757 3870 1 5 . 1 1 101 101 SER HA H 101 4.417 4.417 5.016 -0.599 25757 3871 1 5 . 1 1 101 101 SER C C 101 175.360 175.360 175.443 -0.083 25757 3872 1 5 . 1 1 101 101 SER CA C 101 56.036 56.036 56.184 -0.147 25757 3873 1 5 . 1 1 101 101 SER CB C 101 66.896 66.896 65.465 1.431 25757 3874 1 5 . 1 1 101 101 SER H H 101 8.985 8.985 8.857 0.128 25757 3875 1 5 . 1 1 102 102 ALA N N 102 122.780 122.780 124.319 -1.539 25757 3876 1 5 . 1 1 102 102 ALA HA H 102 3.744 3.744 4.169 -0.425 25757 3877 1 5 . 1 1 102 102 ALA C C 102 179.175 179.175 178.959 0.216 25757 3878 1 5 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.109 1.181 25757 3879 1 5 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.443 -0.416 25757 3880 1 5 . 1 1 102 102 ALA H H 102 9.269 9.269 8.905 0.364 25757 3881 1 5 . 1 1 103 103 ALA N N 103 118.513 118.513 121.718 -3.205 25757 3882 1 5 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.752 0.259 25757 3883 1 5 . 1 1 103 103 ALA C C 103 181.521 181.521 179.116 2.405 25757 3884 1 5 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.201 0.153 25757 3885 1 5 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.241 0.050 25757 3886 1 5 . 1 1 103 103 ALA H H 103 8.321 8.321 8.269 0.052 25757 3887 1 5 . 1 1 104 104 GLU N N 104 119.550 119.550 118.623 0.927 25757 3888 1 5 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.080 -0.074 25757 3889 1 5 . 1 1 104 104 GLU C C 104 179.750 179.750 179.117 0.633 25757 3890 1 5 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.502 -0.333 25757 3891 1 5 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.276 -0.061 25757 3892 1 5 . 1 1 104 104 GLU H H 104 7.867 7.867 8.482 -0.615 25757 3893 1 5 . 1 1 105 105 LEU N N 105 122.688 122.688 120.415 2.273 25757 3894 1 5 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.934 -0.016 25757 3895 1 5 . 1 1 105 105 LEU C C 105 178.233 178.233 178.055 0.178 25757 3896 1 5 . 1 1 105 105 LEU CA C 105 57.734 57.734 57.868 -0.134 25757 3897 1 5 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.786 0.234 25757 3898 1 5 . 1 1 105 105 LEU H H 105 8.746 8.746 7.717 1.029 25757 3899 1 5 . 1 1 106 106 ARG N N 106 118.835 118.835 118.045 0.790 25757 3900 1 5 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.787 -0.137 25757 3901 1 5 . 1 1 106 106 ARG C C 106 178.742 178.742 178.581 0.161 25757 3902 1 5 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.287 0.676 25757 3903 1 5 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.300 0.746 25757 3904 1 5 . 1 1 106 106 ARG H H 106 8.684 8.684 8.233 0.451 25757 3905 1 5 . 1 1 107 107 HIS N N 107 119.258 119.258 118.852 0.406 25757 3906 1 5 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.479 -0.212 25757 3907 1 5 . 1 1 107 107 HIS C C 107 177.244 177.244 177.984 -0.740 25757 3908 1 5 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.056 2.096 25757 3909 1 5 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.459 1.117 25757 3910 1 5 . 1 1 107 107 HIS H H 107 7.691 7.691 8.154 -0.463 25757 3911 1 5 . 1 1 108 108 VAL N N 108 118.996 118.996 121.575 -2.579 25757 3912 1 5 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.814 -0.376 25757 3913 1 5 . 1 1 108 108 VAL C C 108 177.998 177.998 178.320 -0.322 25757 3914 1 5 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.148 0.283 25757 3915 1 5 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.338 0.086 25757 3916 1 5 . 1 1 108 108 VAL H H 108 7.599 7.599 8.124 -0.525 25757 3917 1 5 . 1 1 109 109 MET N N 109 114.880 114.880 117.784 -2.904 25757 3918 1 5 . 1 1 109 109 MET C C 109 179.119 179.119 178.185 0.934 25757 3919 1 5 . 1 1 109 109 MET CA C 109 56.979 56.979 59.283 -2.304 25757 3920 1 5 . 1 1 109 109 MET CB C 109 29.253 29.253 32.889 -3.636 25757 3921 1 5 . 1 1 109 109 MET H H 109 7.911 7.911 8.230 -0.319 25757 3922 1 5 . 1 1 110 110 THR N N 110 116.943 116.943 115.704 1.239 25757 3923 1 5 . 1 1 110 110 THR HA H 110 4.229 4.229 4.381 -0.152 25757 3924 1 5 . 1 1 110 110 THR C C 110 178.506 178.506 177.472 1.034 25757 3925 1 5 . 1 1 110 110 THR CA C 110 66.573 66.573 66.074 0.499 25757 3926 1 5 . 1 1 110 110 THR CB C 110 68.575 68.575 68.386 0.189 25757 3927 1 5 . 1 1 110 110 THR H H 110 8.353 8.353 7.955 0.398 25757 3928 1 5 . 1 1 111 111 ASN N N 111 123.829 123.829 120.898 2.931 25757 3929 1 5 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.465 -0.103 25757 3930 1 5 . 1 1 111 111 ASN C C 111 177.197 177.197 177.453 -0.256 25757 3931 1 5 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.996 -0.037 25757 3932 1 5 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.430 -1.207 25757 3933 1 5 . 1 1 111 111 ASN H H 111 8.053 8.053 8.158 -0.105 25757 3934 1 5 . 1 1 112 112 LEU N N 112 119.036 119.036 117.292 1.744 25757 3935 1 5 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.085 0.085 25757 3936 1 5 . 1 1 112 112 LEU C C 112 176.377 176.377 177.289 -0.912 25757 3937 1 5 . 1 1 112 112 LEU CA C 112 55.505 55.505 55.993 -0.488 25757 3938 1 5 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.417 -0.057 25757 3939 1 5 . 1 1 112 112 LEU H H 112 7.794 7.794 7.415 0.379 25757 3940 1 5 . 1 1 113 113 GLY N N 113 106.045 106.045 105.195 0.850 25757 3941 1 5 . 1 1 113 113 GLY C C 113 174.248 174.248 175.138 -0.890 25757 3942 1 5 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.469 0.838 25757 3943 1 5 . 1 1 113 113 GLY H H 113 7.741 7.741 7.755 -0.014 25757 3944 1 5 . 1 1 114 114 GLU N N 114 120.556 120.556 121.140 -0.584 25757 3945 1 5 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.393 -0.083 25757 3946 1 5 . 1 1 114 114 GLU C C 114 174.993 174.993 175.581 -0.588 25757 3947 1 5 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.430 -1.793 25757 3948 1 5 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.403 0.814 25757 3949 1 5 . 1 1 114 114 GLU H H 114 7.980 7.980 7.945 0.035 25757 3950 1 5 . 1 1 115 115 LYS N N 115 124.986 124.986 121.242 3.744 25757 3951 1 5 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.593 -0.259 25757 3952 1 5 . 1 1 115 115 LYS C C 115 175.285 175.285 175.315 -0.030 25757 3953 1 5 . 1 1 115 115 LYS CA C 115 55.581 55.581 55.602 -0.021 25757 3954 1 5 . 1 1 115 115 LYS CB C 115 31.973 31.973 34.015 -2.042 25757 3955 1 5 . 1 1 115 115 LYS H H 115 8.613 8.613 8.307 0.306 25757 3956 1 5 . 1 1 116 116 LEU N N 116 125.243 125.243 119.607 5.636 25757 3957 1 5 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.809 -0.121 25757 3958 1 5 . 1 1 116 116 LEU C C 116 178.365 178.365 175.293 3.072 25757 3959 1 5 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.194 0.154 25757 3960 1 5 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.009 1.280 25757 3961 1 5 . 1 1 116 116 LEU H H 116 8.066 8.066 8.213 -0.147 25757 3962 1 5 . 1 1 117 117 THR N N 117 114.324 114.324 115.135 -0.811 25757 3963 1 5 . 1 1 117 117 THR HA H 117 4.713 4.713 4.589 0.124 25757 3964 1 5 . 1 1 117 117 THR C C 117 175.539 175.539 174.990 0.549 25757 3965 1 5 . 1 1 117 117 THR CA C 117 60.756 60.756 60.471 0.285 25757 3966 1 5 . 1 1 117 117 THR CB C 117 71.144 71.144 70.539 0.605 25757 3967 1 5 . 1 1 117 117 THR H H 117 9.228 9.228 7.930 1.298 25757 3968 1 5 . 1 1 118 118 ASP N N 118 121.016 121.016 122.321 -1.305 25757 3969 1 5 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.288 -0.133 25757 3970 1 5 . 1 1 118 118 ASP H H 118 8.919 8.919 8.696 0.223 25757 3971 1 5 . 1 1 119 119 GLU N N 119 121.016 121.016 118.445 2.571 25757 3972 1 5 . 1 1 119 119 GLU C C 119 179.204 179.204 178.771 0.433 25757 3973 1 5 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.261 -1.191 25757 3974 1 5 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.190 -0.146 25757 3975 1 5 . 1 1 119 119 GLU H H 119 8.919 8.919 8.780 0.139 25757 3976 1 5 . 1 1 120 120 GLU N N 120 120.566 120.566 119.812 0.754 25757 3977 1 5 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.992 0.009 25757 3978 1 5 . 1 1 120 120 GLU C C 120 180.329 180.329 178.843 1.486 25757 3979 1 5 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.048 0.043 25757 3980 1 5 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.161 1.477 25757 3981 1 5 . 1 1 120 120 GLU H H 120 7.732 7.732 7.679 0.053 25757 3982 1 5 . 1 1 121 121 VAL N N 121 121.875 121.875 120.051 1.824 25757 3983 1 5 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.521 -0.056 25757 3984 1 5 . 1 1 121 121 VAL C C 121 177.477 177.477 178.133 -0.656 25757 3985 1 5 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.832 0.339 25757 3986 1 5 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.692 -0.258 25757 3987 1 5 . 1 1 121 121 VAL H H 121 8.104 8.104 7.448 0.656 25757 3988 1 5 . 1 1 122 122 ASP N N 122 120.566 120.566 118.665 1.901 25757 3989 1 5 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.298 0.037 25757 3990 1 5 . 1 1 122 122 ASP C C 122 179.298 179.298 178.512 0.786 25757 3991 1 5 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.468 0.371 25757 3992 1 5 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.779 -0.466 25757 3993 1 5 . 1 1 122 122 ASP H H 122 8.089 8.089 8.111 -0.022 25757 3994 1 5 . 1 1 123 123 GLU N N 123 119.821 119.821 120.911 -1.090 25757 3995 1 5 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.084 -0.035 25757 3996 1 5 . 1 1 123 123 GLU C C 123 178.749 178.749 178.893 -0.144 25757 3997 1 5 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.993 0.325 25757 3998 1 5 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.506 -0.121 25757 3999 1 5 . 1 1 123 123 GLU H H 123 8.105 8.105 7.862 0.243 25757 4000 1 5 . 1 1 124 124 MET N N 124 119.288 119.288 118.193 1.095 25757 4001 1 5 . 1 1 124 124 MET C C 124 180.865 180.865 179.012 1.853 25757 4002 1 5 . 1 1 124 124 MET CA C 124 60.684 60.684 59.134 1.550 25757 4003 1 5 . 1 1 124 124 MET CB C 124 33.141 33.141 31.977 1.165 25757 4004 1 5 . 1 1 124 124 MET H H 124 7.726 7.726 8.059 -0.333 25757 4005 1 5 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.047 -0.318 25757 4006 1 5 . 1 1 125 125 ILE C C 125 177.341 177.341 177.865 -0.524 25757 4007 1 5 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.595 0.206 25757 4008 1 5 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.040 -1.475 25757 4009 1 5 . 1 1 126 126 ARG N N 126 118.555 118.555 119.543 -0.988 25757 4010 1 5 . 1 1 126 126 ARG C C 126 179.164 179.164 179.035 0.129 25757 4011 1 5 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.069 0.855 25757 4012 1 5 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.343 -0.478 25757 4013 1 5 . 1 1 126 126 ARG H H 126 8.380 8.380 7.974 0.406 25757 4014 1 5 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.352 -0.427 25757 4015 1 5 . 1 1 127 127 GLU CA C 127 59.057 59.057 58.118 0.939 25757 4016 1 5 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.038 0.790 25757 4017 1 5 . 1 1 128 128 ALA N N 128 116.764 116.764 120.072 -3.308 25757 4018 1 5 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.278 0.139 25757 4019 1 5 . 1 1 128 128 ALA C C 128 177.885 177.885 176.226 1.659 25757 4020 1 5 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.137 -0.182 25757 4021 1 5 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.633 2.934 25757 4022 1 5 . 1 1 128 128 ALA H H 128 7.152 7.152 7.674 -0.522 25757 4023 1 5 . 1 1 129 129 ASP N N 129 117.762 117.762 117.561 0.201 25757 4024 1 5 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.148 -0.671 25757 4025 1 5 . 1 1 129 129 ASP C C 129 175.935 175.935 176.431 -0.496 25757 4026 1 5 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.234 2.280 25757 4027 1 5 . 1 1 129 129 ASP CB C 129 40.745 40.745 43.363 -2.618 25757 4028 1 5 . 1 1 129 129 ASP H H 129 8.007 8.007 7.429 0.578 25757 4029 1 5 . 1 1 130 130 ILE N N 130 128.249 128.249 123.426 4.823 25757 4030 1 5 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.977 -0.113 25757 4031 1 5 . 1 1 130 130 ILE C C 130 177.764 177.764 177.287 0.477 25757 4032 1 5 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.728 0.820 25757 4033 1 5 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.992 0.656 25757 4034 1 5 . 1 1 130 130 ILE H H 130 8.412 8.412 8.141 0.271 25757 4035 1 5 . 1 1 131 131 ASP N N 131 116.430 116.430 116.291 0.139 25757 4036 1 5 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.690 -0.156 25757 4037 1 5 . 1 1 131 131 ASP C C 131 178.313 178.313 177.082 1.231 25757 4038 1 5 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.651 -0.767 25757 4039 1 5 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.513 -1.551 25757 4040 1 5 . 1 1 131 131 ASP H H 131 8.254 8.254 7.998 0.256 25757 4041 1 5 . 1 1 132 132 GLY N N 132 108.460 108.460 109.907 -1.447 25757 4042 1 5 . 1 1 132 132 GLY C C 132 175.211 175.211 174.476 0.735 25757 4043 1 5 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.832 1.771 25757 4044 1 5 . 1 1 132 132 GLY H H 132 7.547 7.547 7.992 -0.445 25757 4045 1 5 . 1 1 133 133 ASP N N 133 120.909 120.909 119.989 0.920 25757 4046 1 5 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.597 -0.134 25757 4047 1 5 . 1 1 133 133 ASP C C 133 177.691 177.691 177.582 0.109 25757 4048 1 5 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.308 0.506 25757 4049 1 5 . 1 1 133 133 ASP CB C 133 40.298 40.298 41.680 -1.382 25757 4050 1 5 . 1 1 133 133 ASP H H 133 8.339 8.339 8.573 -0.234 25757 4051 1 5 . 1 1 134 134 GLY N N 134 112.704 112.704 108.468 4.236 25757 4052 1 5 . 1 1 134 134 GLY C C 134 172.722 172.722 173.417 -0.695 25757 4053 1 5 . 1 1 134 134 GLY CA C 134 46.037 46.037 44.976 1.061 25757 4054 1 5 . 1 1 134 134 GLY H H 134 10.396 10.396 8.837 1.559 25757 4055 1 5 . 1 1 135 135 GLN N N 135 114.799 114.799 119.282 -4.483 25757 4056 1 5 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.061 -0.197 25757 4057 1 5 . 1 1 135 135 GLN C C 135 174.760 174.760 175.136 -0.376 25757 4058 1 5 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.541 -1.220 25757 4059 1 5 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.523 -0.458 25757 4060 1 5 . 1 1 135 135 GLN H H 135 7.975 7.975 8.536 -0.561 25757 4061 1 5 . 1 1 136 136 VAL N N 136 125.364 125.364 126.610 -1.246 25757 4062 1 5 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.599 0.609 25757 4063 1 5 . 1 1 136 136 VAL C C 136 175.831 175.831 175.176 0.655 25757 4064 1 5 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.644 0.173 25757 4065 1 5 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.210 0.464 25757 4066 1 5 . 1 1 136 136 VAL H H 136 9.169 9.169 8.970 0.199 25757 4067 1 5 . 1 1 137 137 ASN N N 137 129.155 129.155 125.665 3.490 25757 4068 1 5 . 1 1 137 137 ASN C C 137 174.737 174.737 175.432 -0.695 25757 4069 1 5 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.601 0.750 25757 4070 1 5 . 1 1 137 137 ASN CB C 137 38.323 38.323 40.761 -2.438 25757 4071 1 5 . 1 1 137 137 ASN H H 137 9.652 9.652 8.254 1.398 25757 4072 1 5 . 1 1 138 138 TYR N N 138 118.504 118.504 121.533 -3.029 25757 4073 1 5 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.752 -0.473 25757 4074 1 5 . 1 1 138 138 TYR C C 138 176.174 176.174 177.314 -1.140 25757 4075 1 5 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.329 1.245 25757 4076 1 5 . 1 1 138 138 TYR CB C 138 37.730 37.730 37.805 -0.075 25757 4077 1 5 . 1 1 138 138 TYR H H 138 8.460 8.460 8.395 0.065 25757 4078 1 5 . 1 1 139 139 GLU N N 139 118.644 118.644 117.333 1.311 25757 4079 1 5 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.732 -0.184 25757 4080 1 5 . 1 1 139 139 GLU C C 139 180.265 180.265 178.527 1.738 25757 4081 1 5 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.870 0.616 25757 4082 1 5 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.418 0.573 25757 4083 1 5 . 1 1 139 139 GLU H H 139 8.136 8.136 8.895 -0.759 25757 4084 1 5 . 1 1 140 140 GLU N N 140 120.030 120.030 116.872 3.158 25757 4085 1 5 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.092 -0.204 25757 4086 1 5 . 1 1 140 140 GLU C C 140 179.627 179.627 177.959 1.668 25757 4087 1 5 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.789 0.888 25757 4088 1 5 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.411 0.316 25757 4089 1 5 . 1 1 140 140 GLU H H 140 8.798 8.798 8.425 0.373 25757 4090 1 5 . 1 1 141 141 PHE N N 141 123.154 123.154 121.506 1.648 25757 4091 1 5 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.998 -0.301 25757 4092 1 5 . 1 1 141 141 PHE C C 141 176.952 176.952 177.923 -0.971 25757 4093 1 5 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.643 1.409 25757 4094 1 5 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.918 0.213 25757 4095 1 5 . 1 1 141 141 PHE H H 141 8.633 8.633 7.699 0.934 25757 4096 1 5 . 1 1 142 142 VAL N N 142 120.046 120.046 116.608 3.438 25757 4097 1 5 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.539 -0.583 25757 4098 1 5 . 1 1 142 142 VAL C C 142 179.627 179.627 177.327 2.300 25757 4099 1 5 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.670 1.573 25757 4100 1 5 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.161 -0.021 25757 4101 1 5 . 1 1 142 142 VAL H H 142 8.894 8.894 8.441 0.453 25757 4102 1 5 . 1 1 143 143 GLN N N 143 118.996 118.996 120.472 -1.476 25757 4103 1 5 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.954 -0.178 25757 4104 1 5 . 1 1 143 143 GLN C C 143 178.443 178.443 177.836 0.607 25757 4105 1 5 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.294 0.835 25757 4106 1 5 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.190 -0.447 25757 4107 1 5 . 1 1 143 143 GLN H H 143 7.627 7.627 7.865 -0.238 25757 4108 1 5 . 1 1 144 144 MET N N 144 116.361 116.361 117.757 -1.396 25757 4109 1 5 . 1 1 144 144 MET HA H 144 4.169 4.169 4.089 0.080 25757 4110 1 5 . 1 1 144 144 MET C C 144 178.418 178.418 177.020 1.398 25757 4111 1 5 . 1 1 144 144 MET CA C 144 56.137 56.137 57.556 -1.419 25757 4112 1 5 . 1 1 144 144 MET CB C 144 31.095 31.095 32.266 -1.171 25757 4113 1 5 . 1 1 144 144 MET H H 144 7.179 7.179 7.228 -0.049 25757 4114 1 5 . 1 1 145 145 MET N N 145 115.373 115.373 117.017 -1.644 25757 4115 1 5 . 1 1 145 145 MET HA H 145 4.334 4.334 4.546 -0.212 25757 4116 1 5 . 1 1 145 145 MET C C 145 177.217 177.217 175.847 1.370 25757 4117 1 5 . 1 1 145 145 MET CA C 145 55.296 55.296 54.132 1.164 25757 4118 1 5 . 1 1 145 145 MET CB C 145 34.458 34.458 33.591 0.867 25757 4119 1 5 . 1 1 145 145 MET H H 145 7.776 7.776 7.808 -0.032 25757 4120 1 5 . 1 1 146 146 THR N N 146 107.988 107.988 111.982 -3.994 25757 4121 1 5 . 1 1 146 146 THR HA H 146 4.239 4.239 4.450 -0.211 25757 4122 1 5 . 1 1 146 146 THR C C 146 175.378 175.378 174.872 0.506 25757 4123 1 5 . 1 1 146 146 THR CA C 146 61.625 61.625 60.885 0.741 25757 4124 1 5 . 1 1 146 146 THR CB C 146 70.817 70.817 68.435 2.382 25757 4125 1 5 . 1 1 146 146 THR H H 146 7.736 7.736 7.676 0.060 25757 4126 1 5 . 1 1 147 147 GLY N N 147 110.157 110.157 109.915 0.242 25757 4127 1 5 . 1 1 147 147 GLY C C 147 174.046 174.046 174.387 -0.341 25757 4128 1 5 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.829 0.715 25757 4129 1 5 . 1 1 147 147 GLY H H 147 7.793 7.793 8.123 -0.330 25757 4130 1 5 . 1 1 150 150 THR HA H 150 4.239 4.239 4.329 -0.090 25757 4131 1 5 . 1 1 150 150 THR C C 150 174.397 174.397 174.511 -0.114 25757 4132 1 5 . 1 1 150 150 THR CA C 150 61.260 61.260 62.413 -1.153 25757 4133 1 5 . 1 1 150 150 THR CB C 150 70.358 70.358 69.143 1.215 25757 4134 1 5 . 1 1 151 151 ALA N N 151 126.304 126.304 122.932 3.372 25757 4135 1 5 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.427 -0.139 25757 4136 1 5 . 1 1 151 151 ALA C C 151 177.678 177.678 177.308 0.370 25757 4137 1 5 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.734 0.414 25757 4138 1 5 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.802 -0.383 25757 4139 1 5 . 1 1 151 151 ALA H H 151 8.618 8.618 6.925 1.693 25757 4140 1 5 . 1 1 152 152 ALA N N 152 123.861 123.861 121.259 2.602 25757 4141 1 5 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.340 -0.222 25757 4142 1 5 . 1 1 152 152 ALA C C 152 178.823 178.823 178.322 0.501 25757 4143 1 5 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.510 1.984 25757 4144 1 5 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.266 0.491 25757 4145 1 5 . 1 1 152 152 ALA H H 152 8.354 8.354 8.696 -0.342 25757 4146 1 5 . 1 1 153 153 GLY N N 153 109.984 109.984 107.458 2.526 25757 4147 1 5 . 1 1 153 153 GLY C C 153 174.389 174.389 175.647 -1.258 25757 4148 1 5 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.139 -2.008 25757 4149 1 5 . 1 1 153 153 GLY H H 153 9.028 9.028 8.230 0.798 25757 4150 1 5 . 1 1 154 154 SER N N 154 113.934 113.934 118.273 -4.339 25757 4151 1 5 . 1 1 154 154 SER HA H 154 4.255 4.255 3.978 0.277 25757 4152 1 5 . 1 1 154 154 SER C C 154 177.929 177.929 176.869 1.060 25757 4153 1 5 . 1 1 154 154 SER CA C 154 59.379 59.379 61.709 -2.330 25757 4154 1 5 . 1 1 154 154 SER CB C 154 64.090 64.090 62.749 1.341 25757 4155 1 5 . 1 1 154 154 SER H H 154 7.962 7.962 8.154 -0.192 25757 4156 1 5 . 1 1 155 155 GLY N N 155 115.337 115.337 108.956 6.381 25757 4157 1 5 . 1 1 155 155 GLY C C 155 175.891 175.891 175.437 0.454 25757 4158 1 5 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.709 0.937 25757 4159 1 5 . 1 1 155 155 GLY H H 155 9.451 9.451 7.704 1.747 25757 4160 1 5 . 1 1 156 156 TRP N N 156 119.600 119.600 121.954 -2.354 25757 4161 1 5 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.263 0.008 25757 4162 1 5 . 1 1 156 156 TRP C C 156 178.947 178.947 179.074 -0.127 25757 4163 1 5 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.520 -0.356 25757 4164 1 5 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.076 0.527 25757 4165 1 5 . 1 1 156 156 TRP H H 156 8.542 8.542 7.335 1.207 25757 4166 1 5 . 1 1 157 157 ARG N N 157 118.583 118.583 119.582 -0.999 25757 4167 1 5 . 1 1 157 157 ARG HA H 157 3.982 3.982 3.915 0.067 25757 4168 1 5 . 1 1 157 157 ARG C C 157 177.894 177.894 178.543 -0.649 25757 4169 1 5 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.501 -1.163 25757 4170 1 5 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.223 -0.166 25757 4171 1 5 . 1 1 157 157 ARG H H 157 7.747 7.747 8.636 -0.889 25757 4172 1 5 . 1 1 158 158 LYS N N 158 117.033 117.033 120.461 -3.428 25757 4173 1 5 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.178 -0.235 25757 4174 1 5 . 1 1 158 158 LYS C C 158 176.973 176.973 179.116 -2.143 25757 4175 1 5 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.753 0.621 25757 4176 1 5 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.366 -0.075 25757 4177 1 5 . 1 1 158 158 LYS H H 158 7.529 7.529 8.120 -0.591 25757 4178 1 5 . 1 1 159 159 ILE N N 159 116.553 116.553 120.523 -3.970 25757 4179 1 5 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.753 -0.209 25757 4180 1 5 . 1 1 159 159 ILE C C 159 176.894 176.894 177.286 -0.392 25757 4181 1 5 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.076 0.440 25757 4182 1 5 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.029 -0.225 25757 4183 1 5 . 1 1 159 159 ILE H H 159 7.348 7.348 8.249 -0.901 25757 4184 1 5 . 1 1 160 160 LYS N N 160 119.278 119.278 120.017 -0.739 25757 4185 1 5 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.362 -0.323 25757 4186 1 5 . 1 1 160 160 LYS C C 160 178.566 178.566 179.489 -0.923 25757 4187 1 5 . 1 1 160 160 LYS CA C 160 60.374 60.374 60.012 0.362 25757 4188 1 5 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.683 0.135 25757 4189 1 5 . 1 1 160 160 LYS H H 160 8.225 8.225 8.101 0.124 25757 4190 1 5 . 1 1 161 161 LEU N N 161 117.056 117.056 120.189 -3.133 25757 4191 1 5 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.152 -0.092 25757 4192 1 5 . 1 1 161 161 LEU C C 161 178.977 178.977 179.080 -0.103 25757 4193 1 5 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.273 -0.249 25757 4194 1 5 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.891 0.091 25757 4195 1 5 . 1 1 161 161 LEU H H 161 8.057 8.057 8.491 -0.434 25757 4196 1 5 . 1 1 162 162 ALA N N 162 121.814 121.814 122.561 -0.747 25757 4197 1 5 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.396 -0.304 25757 4198 1 5 . 1 1 162 162 ALA C C 162 178.374 178.374 179.787 -1.413 25757 4199 1 5 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.354 0.436 25757 4200 1 5 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.707 -0.382 25757 4201 1 5 . 1 1 162 162 ALA H H 162 8.170 8.170 8.422 -0.252 25757 4202 1 5 . 1 1 163 163 VAL N N 163 115.449 115.449 116.665 -1.216 25757 4203 1 5 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.871 -0.253 25757 4204 1 5 . 1 1 163 163 VAL C C 163 178.362 178.362 177.513 0.849 25757 4205 1 5 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.098 1.174 25757 4206 1 5 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.777 1.260 25757 4207 1 5 . 1 1 163 163 VAL H H 163 8.499 8.499 8.162 0.337 25757 4208 1 5 . 1 1 164 164 ARG N N 164 115.775 115.775 121.517 -5.742 25757 4209 1 5 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.334 -0.137 25757 4210 1 5 . 1 1 164 164 ARG C C 164 178.938 178.938 179.126 -0.188 25757 4211 1 5 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.080 -1.397 25757 4212 1 5 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.450 -0.615 25757 4213 1 5 . 1 1 164 164 ARG H H 164 8.165 8.165 8.288 -0.123 25757 4214 1 5 . 1 1 165 165 GLY N N 165 105.570 105.570 106.860 -1.290 25757 4215 1 5 . 1 1 165 165 GLY C C 165 173.134 173.134 175.042 -1.908 25757 4216 1 5 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.219 0.523 25757 4217 1 5 . 1 1 165 165 GLY H H 165 8.455 8.455 8.393 0.062 25757 4218 1 5 . 1 1 166 166 ALA N N 166 120.648 120.648 122.507 -1.859 25757 4219 1 5 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.397 -0.055 25757 4220 1 5 . 1 1 166 166 ALA C C 166 176.155 176.155 177.647 -1.492 25757 4221 1 5 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.135 -2.362 25757 4222 1 5 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.053 0.425 25757 4223 1 5 . 1 1 166 166 ALA H H 166 7.826 7.826 8.051 -0.225 25757 4224 1 5 . 1 1 167 167 GLN N N 167 117.315 117.315 116.707 0.608 25757 4225 1 5 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.529 -0.252 25757 4226 1 5 . 1 1 167 167 GLN C C 167 175.571 175.571 175.459 0.112 25757 4227 1 5 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.617 1.310 25757 4228 1 5 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.988 -0.803 25757 4229 1 5 . 1 1 167 167 GLN H H 167 7.498 7.498 7.499 -0.001 25757 4230 1 5 . 1 1 168 168 ALA N N 168 126.706 126.706 121.160 5.546 25757 4231 1 5 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.352 -0.073 25757 4232 1 5 . 1 1 168 168 ALA C C 168 177.227 177.227 177.716 -0.489 25757 4233 1 5 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.396 -1.330 25757 4234 1 5 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.512 0.194 25757 4235 1 5 . 1 1 168 168 ALA H H 168 8.534 8.534 8.444 0.090 25757 4236 1 6 . 1 1 9 9 ILE N N 9 116.733 116.733 120.288 -3.555 25757 4237 1 6 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.143 -0.386 25757 4238 1 6 . 1 1 9 9 ILE C C 9 177.828 177.828 176.981 0.847 25757 4239 1 6 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.173 3.431 25757 4240 1 6 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.865 -0.267 25757 4241 1 6 . 1 1 9 9 ILE H H 9 7.366 7.366 8.054 -0.688 25757 4242 1 6 . 1 1 10 10 ALA N N 10 121.080 121.080 124.609 -3.529 25757 4243 1 6 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.038 0.037 25757 4244 1 6 . 1 1 10 10 ALA C C 10 180.921 180.921 178.883 2.038 25757 4245 1 6 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.380 0.223 25757 4246 1 6 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.585 0.399 25757 4247 1 6 . 1 1 10 10 ALA H H 10 8.039 8.039 8.298 -0.259 25757 4248 1 6 . 1 1 11 11 GLU N N 11 119.580 119.580 117.890 1.690 25757 4249 1 6 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.890 0.199 25757 4250 1 6 . 1 1 11 11 GLU C C 11 179.561 179.561 178.628 0.933 25757 4251 1 6 . 1 1 11 11 GLU CA C 11 59.885 59.885 58.907 0.978 25757 4252 1 6 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.534 0.929 25757 4253 1 6 . 1 1 11 11 GLU H H 11 7.741 7.741 8.662 -0.921 25757 4254 1 6 . 1 1 12 12 PHE N N 12 118.509 118.509 119.101 -0.592 25757 4255 1 6 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.187 0.639 25757 4256 1 6 . 1 1 12 12 PHE C C 12 179.000 179.000 178.354 0.646 25757 4257 1 6 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.325 0.839 25757 4258 1 6 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.095 0.015 25757 4259 1 6 . 1 1 12 12 PHE H H 12 8.470 8.470 6.858 1.612 25757 4260 1 6 . 1 1 13 13 LYS N N 13 123.523 123.523 120.143 3.380 25757 4261 1 6 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.145 -0.119 25757 4262 1 6 . 1 1 13 13 LYS C C 13 179.260 179.260 179.128 0.132 25757 4263 1 6 . 1 1 13 13 LYS CA C 13 60.164 60.164 60.017 0.147 25757 4264 1 6 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.278 -0.445 25757 4265 1 6 . 1 1 13 13 LYS H H 13 9.171 9.171 8.405 0.766 25757 4266 1 6 . 1 1 14 14 GLU N N 14 120.415 120.415 118.933 1.482 25757 4267 1 6 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.141 -0.046 25757 4268 1 6 . 1 1 14 14 GLU C C 14 179.851 179.851 179.010 0.841 25757 4269 1 6 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.486 0.100 25757 4270 1 6 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.288 0.273 25757 4271 1 6 . 1 1 14 14 GLU H H 14 7.822 7.822 8.238 -0.416 25757 4272 1 6 . 1 1 15 15 ALA N N 15 122.143 122.143 123.331 -1.188 25757 4273 1 6 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.138 -0.008 25757 4274 1 6 . 1 1 15 15 ALA C C 15 178.222 178.222 179.938 -1.716 25757 4275 1 6 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.095 0.095 25757 4276 1 6 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.505 -0.003 25757 4277 1 6 . 1 1 15 15 ALA H H 15 8.244 8.244 8.027 0.217 25757 4278 1 6 . 1 1 16 16 PHE N N 16 119.809 119.809 116.939 2.870 25757 4279 1 6 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.499 -0.487 25757 4280 1 6 . 1 1 16 16 PHE C C 16 177.444 177.444 177.691 -0.247 25757 4281 1 6 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.174 1.890 25757 4282 1 6 . 1 1 16 16 PHE CB C 16 39.432 39.432 38.563 0.869 25757 4283 1 6 . 1 1 16 16 PHE H H 16 8.891 8.891 8.293 0.598 25757 4284 1 6 . 1 1 17 17 SER N N 17 112.631 112.631 116.139 -3.508 25757 4285 1 6 . 1 1 17 17 SER HA H 17 4.034 4.034 4.208 -0.174 25757 4286 1 6 . 1 1 17 17 SER C C 17 174.675 174.675 176.406 -1.731 25757 4287 1 6 . 1 1 17 17 SER CA C 17 61.507 61.507 61.772 -0.265 25757 4288 1 6 . 1 1 17 17 SER CB C 17 63.414 63.414 63.594 -0.180 25757 4289 1 6 . 1 1 17 17 SER H H 17 7.910 7.910 8.408 -0.498 25757 4290 1 6 . 1 1 18 18 LEU N N 18 120.614 120.614 117.328 3.286 25757 4291 1 6 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.334 -0.322 25757 4292 1 6 . 1 1 18 18 LEU C C 18 177.366 177.366 178.022 -0.656 25757 4293 1 6 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.186 0.200 25757 4294 1 6 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.944 -0.349 25757 4295 1 6 . 1 1 18 18 LEU H H 18 7.423 7.423 7.984 -0.561 25757 4296 1 6 . 1 1 19 19 PHE N N 19 114.602 114.602 119.109 -4.507 25757 4297 1 6 . 1 1 19 19 PHE C C 19 176.961 176.961 176.105 0.856 25757 4298 1 6 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.629 -1.145 25757 4299 1 6 . 1 1 19 19 PHE CB C 19 40.769 40.769 40.026 0.743 25757 4300 1 6 . 1 1 19 19 PHE H H 19 7.254 7.254 7.469 -0.215 25757 4301 1 6 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.545 0.030 25757 4302 1 6 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.082 -1.434 25757 4303 1 6 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.083 -0.073 25757 4304 1 6 . 1 1 23 23 GLY N N 23 108.244 108.244 109.154 -0.910 25757 4305 1 6 . 1 1 23 23 GLY C C 23 175.188 175.188 174.857 0.331 25757 4306 1 6 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.318 1.085 25757 4307 1 6 . 1 1 23 23 GLY H H 23 7.555 7.555 7.980 -0.425 25757 4308 1 6 . 1 1 24 24 ASP N N 24 120.667 120.667 118.775 1.892 25757 4309 1 6 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.632 -0.163 25757 4310 1 6 . 1 1 24 24 ASP C C 24 177.457 177.457 177.044 0.413 25757 4311 1 6 . 1 1 24 24 ASP CA C 24 53.792 53.792 52.996 0.796 25757 4312 1 6 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.187 -0.671 25757 4313 1 6 . 1 1 24 24 ASP H H 24 8.397 8.397 7.884 0.513 25757 4314 1 6 . 1 1 25 25 GLY N N 25 112.989 112.989 108.456 4.533 25757 4315 1 6 . 1 1 25 25 GLY C C 25 173.639 173.639 173.462 0.177 25757 4316 1 6 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.084 0.417 25757 4317 1 6 . 1 1 25 25 GLY H H 25 10.592 10.592 8.460 2.132 25757 4318 1 6 . 1 1 26 26 THR N N 26 112.948 112.948 113.691 -0.743 25757 4319 1 6 . 1 1 26 26 THR HA H 26 5.282 5.282 5.034 0.248 25757 4320 1 6 . 1 1 26 26 THR C C 26 172.853 172.853 173.049 -0.196 25757 4321 1 6 . 1 1 26 26 THR CA C 26 59.817 59.817 60.353 -0.536 25757 4322 1 6 . 1 1 26 26 THR CB C 26 72.465 72.465 71.558 0.907 25757 4323 1 6 . 1 1 26 26 THR H H 26 8.121 8.121 8.037 0.084 25757 4324 1 6 . 1 1 27 27 ILE N N 27 127.195 127.195 124.532 2.663 25757 4325 1 6 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.661 0.252 25757 4326 1 6 . 1 1 27 27 ILE C C 27 176.091 176.091 175.096 0.995 25757 4327 1 6 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.120 0.645 25757 4328 1 6 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.826 -2.121 25757 4329 1 6 . 1 1 27 27 ILE H H 27 9.867 9.867 8.404 1.463 25757 4330 1 6 . 1 1 28 28 THR N N 28 116.655 116.655 121.290 -4.635 25757 4331 1 6 . 1 1 28 28 THR HA H 28 4.790 4.790 4.680 0.110 25757 4332 1 6 . 1 1 28 28 THR C C 28 176.696 176.696 176.163 0.533 25757 4333 1 6 . 1 1 28 28 THR CA C 28 59.590 59.590 61.434 -1.844 25757 4334 1 6 . 1 1 28 28 THR CB C 28 72.457 72.457 70.424 2.033 25757 4335 1 6 . 1 1 28 28 THR H H 28 8.457 8.457 8.431 0.026 25757 4336 1 6 . 1 1 29 29 THR N N 29 111.878 111.878 117.604 -5.726 25757 4337 1 6 . 1 1 29 29 THR HA H 29 4.188 4.188 3.914 0.274 25757 4338 1 6 . 1 1 29 29 THR C C 29 177.399 177.399 176.134 1.265 25757 4339 1 6 . 1 1 29 29 THR CA C 29 66.386 66.386 67.175 -0.789 25757 4340 1 6 . 1 1 29 29 THR CB C 29 67.726 67.726 68.405 -0.679 25757 4341 1 6 . 1 1 29 29 THR H H 29 9.211 9.211 8.967 0.244 25757 4342 1 6 . 1 1 30 30 LYS N N 30 121.140 121.140 121.382 -0.242 25757 4343 1 6 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.863 0.214 25757 4344 1 6 . 1 1 30 30 LYS C C 30 179.793 179.793 178.711 1.082 25757 4345 1 6 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.585 -0.293 25757 4346 1 6 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.064 0.383 25757 4347 1 6 . 1 1 30 30 LYS H H 30 7.580 7.580 8.486 -0.906 25757 4348 1 6 . 1 1 31 31 GLU N N 31 121.865 121.865 119.013 2.852 25757 4349 1 6 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.059 -0.065 25757 4350 1 6 . 1 1 31 31 GLU C C 31 179.355 179.355 178.593 0.762 25757 4351 1 6 . 1 1 31 31 GLU CA C 31 59.633 59.633 60.227 -0.594 25757 4352 1 6 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.549 0.303 25757 4353 1 6 . 1 1 31 31 GLU H H 31 7.708 7.708 8.194 -0.486 25757 4354 1 6 . 1 1 32 32 LEU N N 32 120.597 120.597 117.367 3.230 25757 4355 1 6 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.241 -0.125 25757 4356 1 6 . 1 1 32 32 LEU C C 32 178.885 178.885 179.247 -0.362 25757 4357 1 6 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.136 0.225 25757 4358 1 6 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.359 1.677 25757 4359 1 6 . 1 1 32 32 LEU H H 32 8.688 8.688 7.741 0.947 25757 4360 1 6 . 1 1 33 33 GLY N N 33 104.837 104.837 108.446 -3.609 25757 4361 1 6 . 1 1 33 33 GLY C C 33 175.123 175.123 175.836 -0.713 25757 4362 1 6 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.557 0.690 25757 4363 1 6 . 1 1 33 33 GLY H H 33 8.694 8.694 8.536 0.158 25757 4364 1 6 . 1 1 34 34 THR N N 34 117.631 117.631 119.312 -1.681 25757 4365 1 6 . 1 1 34 34 THR HA H 34 3.899 3.899 3.993 -0.094 25757 4366 1 6 . 1 1 34 34 THR C C 34 176.951 176.951 177.044 -0.093 25757 4367 1 6 . 1 1 34 34 THR CA C 34 67.234 67.234 66.574 0.660 25757 4368 1 6 . 1 1 34 34 THR CB C 34 68.863 68.863 68.475 0.388 25757 4369 1 6 . 1 1 34 34 THR H H 34 7.960 7.960 8.032 -0.072 25757 4370 1 6 . 1 1 35 35 VAL N N 35 121.659 121.659 121.483 0.176 25757 4371 1 6 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.541 -0.024 25757 4372 1 6 . 1 1 35 35 VAL C C 35 178.265 178.265 177.490 0.775 25757 4373 1 6 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.821 -0.146 25757 4374 1 6 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.012 0.281 25757 4375 1 6 . 1 1 35 35 VAL H H 35 7.358 7.358 8.118 -0.760 25757 4376 1 6 . 1 1 36 36 MET N N 36 117.456 117.456 117.677 -0.221 25757 4377 1 6 . 1 1 36 36 MET C C 36 179.088 179.088 178.662 0.426 25757 4378 1 6 . 1 1 36 36 MET CA C 36 60.477 60.477 58.450 2.027 25757 4379 1 6 . 1 1 36 36 MET CB C 36 32.443 32.443 32.796 -0.353 25757 4380 1 6 . 1 1 36 36 MET H H 36 8.194 8.194 7.868 0.326 25757 4381 1 6 . 1 1 37 37 ARG CA C 37 59.147 59.147 59.049 0.098 25757 4382 1 6 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.924 0.426 25757 4383 1 6 . 1 1 38 38 SER HA H 38 4.085 4.085 4.342 -0.257 25757 4384 1 6 . 1 1 38 38 SER C C 38 173.788 173.788 174.933 -1.145 25757 4385 1 6 . 1 1 38 38 SER CA C 38 61.617 61.617 61.415 0.202 25757 4386 1 6 . 1 1 38 38 SER CB C 38 62.943 62.943 63.015 -0.072 25757 4387 1 6 . 1 1 39 39 LEU N N 39 119.003 119.003 119.131 -0.128 25757 4388 1 6 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.437 0.057 25757 4389 1 6 . 1 1 39 39 LEU C C 39 176.470 176.470 177.607 -1.137 25757 4390 1 6 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.316 0.363 25757 4391 1 6 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.123 1.391 25757 4392 1 6 . 1 1 39 39 LEU H H 39 7.230 7.230 7.520 -0.290 25757 4393 1 6 . 1 1 40 40 GLY N N 40 105.026 105.026 107.296 -2.270 25757 4394 1 6 . 1 1 40 40 GLY C C 40 174.322 174.322 174.849 -0.527 25757 4395 1 6 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.081 1.134 25757 4396 1 6 . 1 1 40 40 GLY H H 40 7.698 7.698 8.034 -0.336 25757 4397 1 6 . 1 1 41 41 GLN N N 41 117.929 117.929 120.168 -2.239 25757 4398 1 6 . 1 1 41 41 GLN C C 41 174.557 174.557 174.655 -0.098 25757 4399 1 6 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.434 1.410 25757 4400 1 6 . 1 1 41 41 GLN H H 41 7.866 7.866 8.133 -0.267 25757 4401 1 6 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.573 0.163 25757 4402 1 6 . 1 1 43 43 PRO C C 43 177.805 177.805 176.259 1.546 25757 4403 1 6 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.031 -0.526 25757 4404 1 6 . 1 1 43 43 PRO CB C 43 32.162 32.162 33.043 -0.881 25757 4405 1 6 . 1 1 44 44 THR N N 44 113.167 113.167 112.455 0.712 25757 4406 1 6 . 1 1 44 44 THR HA H 44 4.684 4.684 4.550 0.134 25757 4407 1 6 . 1 1 44 44 THR C C 44 175.139 175.139 175.969 -0.830 25757 4408 1 6 . 1 1 44 44 THR CA C 44 60.556 60.556 59.090 1.466 25757 4409 1 6 . 1 1 44 44 THR CB C 44 71.064 71.064 71.199 -0.135 25757 4410 1 6 . 1 1 44 44 THR H H 44 8.798 8.798 7.824 0.974 25757 4411 1 6 . 1 1 45 45 GLU N N 45 120.673 120.673 120.979 -0.306 25757 4412 1 6 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.937 0.054 25757 4413 1 6 . 1 1 45 45 GLU C C 45 178.940 178.940 178.916 0.024 25757 4414 1 6 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.221 -0.320 25757 4415 1 6 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.088 -0.059 25757 4416 1 6 . 1 1 45 45 GLU H H 45 8.812 8.812 8.921 -0.109 25757 4417 1 6 . 1 1 46 46 ALA N N 46 120.576 120.576 120.226 0.350 25757 4418 1 6 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.114 -0.147 25757 4419 1 6 . 1 1 46 46 ALA C C 46 180.290 180.290 179.972 0.318 25757 4420 1 6 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.060 -0.141 25757 4421 1 6 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.250 -0.089 25757 4422 1 6 . 1 1 46 46 ALA H H 46 8.276 8.276 8.416 -0.140 25757 4423 1 6 . 1 1 47 47 GLU N N 47 116.104 116.104 119.484 -3.380 25757 4424 1 6 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.064 -0.064 25757 4425 1 6 . 1 1 47 47 GLU C C 47 180.224 180.224 178.807 1.417 25757 4426 1 6 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.206 -0.275 25757 4427 1 6 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.313 0.676 25757 4428 1 6 . 1 1 47 47 GLU H H 47 7.425 7.425 7.681 -0.256 25757 4429 1 6 . 1 1 48 48 LEU N N 48 120.425 120.425 119.511 0.914 25757 4430 1 6 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.903 0.147 25757 4431 1 6 . 1 1 48 48 LEU C C 48 178.551 178.551 179.122 -0.571 25757 4432 1 6 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.451 -0.612 25757 4433 1 6 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.422 1.147 25757 4434 1 6 . 1 1 48 48 LEU H H 48 8.121 8.121 7.917 0.204 25757 4435 1 6 . 1 1 49 49 GLN N N 49 118.372 118.372 118.687 -0.315 25757 4436 1 6 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.854 -0.092 25757 4437 1 6 . 1 1 49 49 GLN C C 49 178.567 178.567 178.283 0.284 25757 4438 1 6 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.291 -0.428 25757 4439 1 6 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.485 -0.243 25757 4440 1 6 . 1 1 49 49 GLN H H 49 8.302 8.302 8.286 0.016 25757 4441 1 6 . 1 1 50 50 ASP N N 50 119.992 119.992 120.339 -0.347 25757 4442 1 6 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.352 0.008 25757 4443 1 6 . 1 1 50 50 ASP C C 50 178.600 178.600 178.281 0.319 25757 4444 1 6 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.082 0.621 25757 4445 1 6 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.849 -0.382 25757 4446 1 6 . 1 1 50 50 ASP H H 50 8.150 8.150 8.228 -0.078 25757 4447 1 6 . 1 1 51 51 MET N N 51 119.238 119.238 119.215 0.023 25757 4448 1 6 . 1 1 51 51 MET HA H 51 3.981 3.981 4.010 -0.029 25757 4449 1 6 . 1 1 51 51 MET C C 51 179.006 179.006 178.749 0.257 25757 4450 1 6 . 1 1 51 51 MET CA C 51 59.443 59.443 59.364 0.079 25757 4451 1 6 . 1 1 51 51 MET CB C 51 33.380 33.380 32.856 0.524 25757 4452 1 6 . 1 1 51 51 MET H H 51 7.844 7.844 7.937 -0.093 25757 4453 1 6 . 1 1 52 52 ILE N N 52 118.161 118.161 118.052 0.109 25757 4454 1 6 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.590 -0.112 25757 4455 1 6 . 1 1 52 52 ILE C C 52 177.847 177.847 178.579 -0.732 25757 4456 1 6 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.744 0.251 25757 4457 1 6 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.484 0.639 25757 4458 1 6 . 1 1 52 52 ILE H H 52 7.686 7.686 8.264 -0.578 25757 4459 1 6 . 1 1 53 53 ASN N N 53 117.884 117.884 117.649 0.235 25757 4460 1 6 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.419 -0.054 25757 4461 1 6 . 1 1 53 53 ASN C C 53 177.515 177.515 177.681 -0.166 25757 4462 1 6 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.942 0.265 25757 4463 1 6 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.540 -0.462 25757 4464 1 6 . 1 1 53 53 ASN H H 53 8.713 8.713 8.325 0.388 25757 4465 1 6 . 1 1 54 54 GLU N N 54 116.178 116.178 118.601 -2.423 25757 4466 1 6 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.283 -0.294 25757 4467 1 6 . 1 1 54 54 GLU C C 54 177.557 177.557 177.348 0.209 25757 4468 1 6 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.495 1.495 25757 4469 1 6 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.219 0.244 25757 4470 1 6 . 1 1 54 54 GLU H H 54 7.530 7.530 8.000 -0.470 25757 4471 1 6 . 1 1 55 55 VAL N N 55 107.164 107.164 110.884 -3.720 25757 4472 1 6 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.362 0.160 25757 4473 1 6 . 1 1 55 55 VAL C C 55 175.602 175.602 174.667 0.935 25757 4474 1 6 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.830 -0.478 25757 4475 1 6 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.030 0.573 25757 4476 1 6 . 1 1 55 55 VAL H H 55 7.175 7.175 7.542 -0.367 25757 4477 1 6 . 1 1 56 56 ASP N N 56 122.126 122.126 121.298 0.828 25757 4478 1 6 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.130 -0.531 25757 4479 1 6 . 1 1 56 56 ASP C C 56 176.182 176.182 175.846 0.336 25757 4480 1 6 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.529 0.278 25757 4481 1 6 . 1 1 56 56 ASP CB C 56 40.270 40.270 41.399 -1.129 25757 4482 1 6 . 1 1 56 56 ASP H H 56 7.569 7.569 7.417 0.152 25757 4483 1 6 . 1 1 57 57 ALA N N 57 103.782 103.782 127.946 -24.164 25757 4484 1 6 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.144 0.036 25757 4485 1 6 . 1 1 57 57 ALA C C 57 178.584 178.584 178.072 0.512 25757 4486 1 6 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.826 0.518 25757 4487 1 6 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.364 0.160 25757 4488 1 6 . 1 1 57 57 ALA H H 57 8.515 8.515 8.530 -0.015 25757 4489 1 6 . 1 1 58 58 ASP N N 58 113.602 113.602 116.472 -2.870 25757 4490 1 6 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.586 -0.000 25757 4491 1 6 . 1 1 58 58 ASP C C 58 177.756 177.756 176.994 0.762 25757 4492 1 6 . 1 1 58 58 ASP CA C 58 52.762 52.762 53.708 -0.946 25757 4493 1 6 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.242 -1.564 25757 4494 1 6 . 1 1 58 58 ASP H H 58 8.130 8.130 7.750 0.380 25757 4495 1 6 . 1 1 59 59 GLY N N 59 109.195 109.195 109.553 -0.358 25757 4496 1 6 . 1 1 59 59 GLY C C 59 175.139 175.139 175.237 -0.098 25757 4497 1 6 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.987 1.277 25757 4498 1 6 . 1 1 59 59 GLY H H 59 7.694 7.694 8.361 -0.667 25757 4499 1 6 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.548 0.057 25757 4500 1 6 . 1 1 61 61 GLY N N 61 113.316 113.316 109.708 3.608 25757 4501 1 6 . 1 1 61 61 GLY C C 61 173.234 173.234 173.008 0.226 25757 4502 1 6 . 1 1 61 61 GLY CA C 61 45.698 45.698 44.958 0.740 25757 4503 1 6 . 1 1 61 61 GLY H H 61 10.633 10.633 8.463 2.170 25757 4504 1 6 . 1 1 62 62 THR N N 62 108.892 108.892 110.819 -1.927 25757 4505 1 6 . 1 1 62 62 THR HA H 62 4.736 4.736 4.726 0.010 25757 4506 1 6 . 1 1 62 62 THR C C 62 173.091 173.091 172.924 0.167 25757 4507 1 6 . 1 1 62 62 THR CA C 62 59.617 59.617 60.008 -0.391 25757 4508 1 6 . 1 1 62 62 THR CB C 62 72.004 72.004 72.367 -0.363 25757 4509 1 6 . 1 1 62 62 THR H H 62 7.673 7.673 8.219 -0.546 25757 4510 1 6 . 1 1 63 63 ILE N N 63 123.324 123.324 122.904 0.420 25757 4511 1 6 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.550 0.579 25757 4512 1 6 . 1 1 63 63 ILE C C 63 175.652 175.652 175.321 0.331 25757 4513 1 6 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.523 -0.037 25757 4514 1 6 . 1 1 63 63 ILE CB C 63 39.957 39.957 39.974 -0.017 25757 4515 1 6 . 1 1 63 63 ILE H H 63 8.907 8.907 8.642 0.265 25757 4516 1 6 . 1 1 64 64 ASP N N 64 128.253 128.253 128.742 -0.489 25757 4517 1 6 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.598 0.723 25757 4518 1 6 . 1 1 64 64 ASP C C 64 176.431 176.431 176.649 -0.218 25757 4519 1 6 . 1 1 64 64 ASP CA C 64 52.331 52.331 54.226 -1.895 25757 4520 1 6 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.573 -0.520 25757 4521 1 6 . 1 1 64 64 ASP H H 64 8.864 8.864 9.094 -0.230 25757 4522 1 6 . 1 1 65 65 PHE N N 65 118.583 118.583 121.002 -2.419 25757 4523 1 6 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.157 -0.297 25757 4524 1 6 . 1 1 65 65 PHE C C 65 173.458 173.458 174.976 -1.518 25757 4525 1 6 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.319 2.479 25757 4526 1 6 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.343 -1.463 25757 4527 1 6 . 1 1 65 65 PHE H H 65 8.962 8.962 8.633 0.329 25757 4528 1 6 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.644 0.474 25757 4529 1 6 . 1 1 66 66 PRO C C 66 180.038 180.038 178.606 1.432 25757 4530 1 6 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.909 1.780 25757 4531 1 6 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.901 -0.224 25757 4532 1 6 . 1 1 67 67 GLU N N 67 118.402 118.402 119.603 -1.201 25757 4533 1 6 . 1 1 67 67 GLU C C 67 178.737 178.737 178.699 0.038 25757 4534 1 6 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.710 -0.702 25757 4535 1 6 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.161 0.524 25757 4536 1 6 . 1 1 67 67 GLU H H 67 7.953 7.953 7.887 0.066 25757 4537 1 6 . 1 1 68 68 PHE N N 68 123.421 123.421 119.298 4.123 25757 4538 1 6 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.224 -0.252 25757 4539 1 6 . 1 1 68 68 PHE C C 68 177.184 177.184 177.636 -0.452 25757 4540 1 6 . 1 1 68 68 PHE CA C 68 61.338 61.338 60.730 0.608 25757 4541 1 6 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.184 0.785 25757 4542 1 6 . 1 1 68 68 PHE H H 68 8.928 8.928 7.588 1.340 25757 4543 1 6 . 1 1 69 69 LEU N N 69 119.284 119.284 119.078 0.206 25757 4544 1 6 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.656 -0.321 25757 4545 1 6 . 1 1 69 69 LEU C C 69 178.987 178.987 178.508 0.479 25757 4546 1 6 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.278 -0.416 25757 4547 1 6 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.385 -0.553 25757 4548 1 6 . 1 1 69 69 LEU H H 69 8.374 8.374 7.629 0.745 25757 4549 1 6 . 1 1 70 70 THR N N 70 116.017 116.017 116.573 -0.556 25757 4550 1 6 . 1 1 70 70 THR HA H 70 4.338 4.338 3.926 0.412 25757 4551 1 6 . 1 1 70 70 THR C C 70 176.169 176.169 176.316 -0.147 25757 4552 1 6 . 1 1 70 70 THR CA C 70 66.700 66.700 67.270 -0.570 25757 4553 1 6 . 1 1 70 70 THR CB C 70 68.379 68.379 68.852 -0.473 25757 4554 1 6 . 1 1 70 70 THR H H 70 7.493 7.493 7.960 -0.467 25757 4555 1 6 . 1 1 71 71 MET N N 71 121.915 121.915 119.544 2.371 25757 4556 1 6 . 1 1 71 71 MET HA H 71 3.718 3.718 4.246 -0.528 25757 4557 1 6 . 1 1 71 71 MET C C 71 178.190 178.190 176.790 1.400 25757 4558 1 6 . 1 1 71 71 MET CA C 71 59.335 59.335 58.036 1.299 25757 4559 1 6 . 1 1 71 71 MET CB C 71 33.894 33.894 32.209 1.685 25757 4560 1 6 . 1 1 71 71 MET H H 71 7.924 7.924 7.994 -0.070 25757 4561 1 6 . 1 1 72 72 MET N N 72 116.973 116.973 118.302 -1.329 25757 4562 1 6 . 1 1 72 72 MET HA H 72 3.968 3.968 4.230 -0.262 25757 4563 1 6 . 1 1 72 72 MET C C 72 178.211 178.211 177.938 0.273 25757 4564 1 6 . 1 1 72 72 MET CA C 72 56.059 56.059 57.412 -1.353 25757 4565 1 6 . 1 1 72 72 MET CB C 72 31.639 31.639 33.275 -1.636 25757 4566 1 6 . 1 1 72 72 MET H H 72 8.276 8.276 7.795 0.481 25757 4567 1 6 . 1 1 73 73 ALA N N 73 122.499 122.499 121.990 0.509 25757 4568 1 6 . 1 1 73 73 ALA HA H 73 3.950 3.950 4.024 -0.074 25757 4569 1 6 . 1 1 73 73 ALA C C 73 180.231 180.231 179.550 0.681 25757 4570 1 6 . 1 1 73 73 ALA CA C 73 54.953 54.953 55.015 -0.062 25757 4571 1 6 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.897 0.135 25757 4572 1 6 . 1 1 73 73 ALA H H 73 8.240 8.240 7.950 0.290 25757 4573 1 6 . 1 1 74 74 ARG N N 74 116.098 116.098 119.443 -3.345 25757 4574 1 6 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.015 -0.023 25757 4575 1 6 . 1 1 74 74 ARG C C 74 178.567 178.567 178.387 0.180 25757 4576 1 6 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.624 0.201 25757 4577 1 6 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.870 0.205 25757 4578 1 6 . 1 1 74 74 ARG H H 74 7.420 7.420 7.788 -0.368 25757 4579 1 6 . 1 1 75 75 LYS N N 75 119.046 119.046 120.481 -1.435 25757 4580 1 6 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.014 0.029 25757 4581 1 6 . 1 1 75 75 LYS C C 75 179.045 179.045 179.005 0.040 25757 4582 1 6 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.855 -0.966 25757 4583 1 6 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.697 0.069 25757 4584 1 6 . 1 1 75 75 LYS H H 75 7.862 7.862 8.054 -0.192 25757 4585 1 6 . 1 1 76 76 MET N N 76 116.772 116.772 118.832 -2.060 25757 4586 1 6 . 1 1 76 76 MET H H 76 8.099 8.099 8.285 -0.186 25757 4587 1 6 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.759 -0.125 25757 4588 1 6 . 1 1 78 78 ASP C C 78 176.395 176.395 176.878 -0.483 25757 4589 1 6 . 1 1 78 78 ASP CA C 78 54.644 54.644 53.162 1.482 25757 4590 1 6 . 1 1 78 78 ASP CB C 78 41.474 41.474 40.724 0.750 25757 4591 1 6 . 1 1 79 79 THR N N 79 113.904 113.904 116.037 -2.133 25757 4592 1 6 . 1 1 79 79 THR HA H 79 4.215 4.215 4.117 0.098 25757 4593 1 6 . 1 1 79 79 THR C C 79 174.204 174.204 175.074 -0.870 25757 4594 1 6 . 1 1 79 79 THR CA C 79 62.264 62.264 63.375 -1.111 25757 4595 1 6 . 1 1 79 79 THR CB C 79 69.884 69.884 69.183 0.701 25757 4596 1 6 . 1 1 79 79 THR H H 79 8.039 8.039 8.159 -0.120 25757 4597 1 6 . 1 1 80 80 ASP N N 80 123.572 123.572 124.127 -0.555 25757 4598 1 6 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.768 -0.048 25757 4599 1 6 . 1 1 80 80 ASP C C 80 176.221 176.221 176.118 0.103 25757 4600 1 6 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.234 0.081 25757 4601 1 6 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.581 0.846 25757 4602 1 6 . 1 1 80 80 ASP H H 80 8.441 8.441 7.909 0.532 25757 4603 1 6 . 1 1 81 81 SER N N 81 117.879 117.879 118.149 -0.270 25757 4604 1 6 . 1 1 81 81 SER HA H 81 3.925 3.925 4.501 -0.576 25757 4605 1 6 . 1 1 81 81 SER C C 81 175.264 175.264 175.625 -0.361 25757 4606 1 6 . 1 1 81 81 SER CA C 81 58.860 58.860 58.928 -0.068 25757 4607 1 6 . 1 1 81 81 SER CB C 81 63.790 63.790 63.375 0.415 25757 4608 1 6 . 1 1 81 81 SER H H 81 8.503 8.503 8.318 0.185 25757 4609 1 6 . 1 1 82 82 GLU N N 82 123.206 123.206 120.508 2.698 25757 4610 1 6 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.048 0.010 25757 4611 1 6 . 1 1 82 82 GLU C C 82 178.378 178.378 178.429 -0.051 25757 4612 1 6 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.330 0.256 25757 4613 1 6 . 1 1 82 82 GLU CB C 82 29.603 29.603 28.997 0.606 25757 4614 1 6 . 1 1 82 82 GLU H H 82 8.563 8.563 8.740 -0.177 25757 4615 1 6 . 1 1 83 83 GLU N N 83 119.262 119.262 120.136 -0.874 25757 4616 1 6 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.895 0.062 25757 4617 1 6 . 1 1 83 83 GLU C C 83 178.606 178.606 178.808 -0.202 25757 4618 1 6 . 1 1 83 83 GLU CA C 83 59.669 59.669 60.104 -0.435 25757 4619 1 6 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.179 0.176 25757 4620 1 6 . 1 1 83 83 GLU H H 83 7.728 7.728 8.199 -0.471 25757 4621 1 6 . 1 1 84 84 GLU N N 84 118.432 118.432 119.256 -0.824 25757 4622 1 6 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.034 0.073 25757 4623 1 6 . 1 1 84 84 GLU C C 84 179.436 179.436 178.920 0.516 25757 4624 1 6 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.881 0.622 25757 4625 1 6 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.181 -0.074 25757 4626 1 6 . 1 1 84 84 GLU H H 84 8.346 8.346 8.288 0.058 25757 4627 1 6 . 1 1 85 85 ILE N N 85 120.925 120.925 121.808 -0.883 25757 4628 1 6 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.768 -0.020 25757 4629 1 6 . 1 1 85 85 ILE C C 85 177.661 177.661 178.290 -0.629 25757 4630 1 6 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.516 -0.026 25757 4631 1 6 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.780 -0.349 25757 4632 1 6 . 1 1 85 85 ILE H H 85 7.821 7.821 8.292 -0.471 25757 4633 1 6 . 1 1 86 86 ARG N N 86 121.916 121.916 118.734 3.182 25757 4634 1 6 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.929 0.207 25757 4635 1 6 . 1 1 86 86 ARG C C 86 179.208 179.208 178.785 0.423 25757 4636 1 6 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.650 0.721 25757 4637 1 6 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.872 0.226 25757 4638 1 6 . 1 1 86 86 ARG H H 86 8.432 8.432 8.158 0.274 25757 4639 1 6 . 1 1 87 87 GLU N N 87 118.261 118.261 118.858 -0.597 25757 4640 1 6 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.971 0.141 25757 4641 1 6 . 1 1 87 87 GLU C C 87 178.516 178.516 178.442 0.074 25757 4642 1 6 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.013 0.013 25757 4643 1 6 . 1 1 87 87 GLU CB C 87 29.170 29.170 28.974 0.196 25757 4644 1 6 . 1 1 87 87 GLU H H 87 8.225 8.225 8.120 0.105 25757 4645 1 6 . 1 1 88 88 ALA N N 88 121.009 121.009 122.454 -1.445 25757 4646 1 6 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.470 0.357 25757 4647 1 6 . 1 1 88 88 ALA C C 88 177.947 177.947 178.282 -0.335 25757 4648 1 6 . 1 1 88 88 ALA CA C 88 54.861 54.861 55.000 -0.139 25757 4649 1 6 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.225 -0.270 25757 4650 1 6 . 1 1 88 88 ALA H H 88 7.789 7.789 7.884 -0.095 25757 4651 1 6 . 1 1 89 89 PHE N N 89 117.164 117.164 118.711 -1.547 25757 4652 1 6 . 1 1 89 89 PHE C C 89 176.134 176.134 177.486 -1.352 25757 4653 1 6 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.633 2.017 25757 4654 1 6 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.891 0.003 25757 4655 1 6 . 1 1 89 89 PHE H H 89 8.337 8.337 7.676 0.661 25757 4656 1 6 . 1 1 90 90 ARG N N 90 114.900 114.900 117.654 -2.754 25757 4657 1 6 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.922 -0.008 25757 4658 1 6 . 1 1 90 90 ARG C C 90 178.296 178.296 177.383 0.913 25757 4659 1 6 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.825 0.254 25757 4660 1 6 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.631 -0.538 25757 4661 1 6 . 1 1 90 90 ARG H H 90 7.681 7.681 7.750 -0.069 25757 4662 1 6 . 1 1 91 91 VAL N N 91 116.927 116.927 115.479 1.448 25757 4663 1 6 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.899 -0.292 25757 4664 1 6 . 1 1 91 91 VAL C C 91 177.964 177.964 177.059 0.905 25757 4665 1 6 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.641 1.319 25757 4666 1 6 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.350 0.269 25757 4667 1 6 . 1 1 91 91 VAL H H 91 7.405 7.405 7.546 -0.141 25757 4668 1 6 . 1 1 92 92 PHE N N 92 119.026 119.026 118.094 0.932 25757 4669 1 6 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.285 0.077 25757 4670 1 6 . 1 1 92 92 PHE C C 92 177.639 177.639 176.216 1.423 25757 4671 1 6 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.543 -0.822 25757 4672 1 6 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.681 -0.254 25757 4673 1 6 . 1 1 92 92 PHE H H 92 7.886 7.886 7.513 0.373 25757 4674 1 6 . 1 1 93 93 ASP N N 93 118.238 118.238 118.824 -0.586 25757 4675 1 6 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.751 -0.289 25757 4676 1 6 . 1 1 93 93 ASP C C 93 176.979 176.979 176.689 0.290 25757 4677 1 6 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.767 -1.619 25757 4678 1 6 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.786 -1.637 25757 4679 1 6 . 1 1 93 93 ASP H H 93 8.009 8.009 7.345 0.664 25757 4680 1 6 . 1 1 94 94 LYS N N 94 125.792 125.792 125.471 0.321 25757 4681 1 6 . 1 1 94 94 LYS C C 94 178.213 178.213 177.772 0.441 25757 4682 1 6 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.785 0.533 25757 4683 1 6 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.459 -1.431 25757 4684 1 6 . 1 1 94 94 LYS H H 94 7.428 7.428 8.313 -0.885 25757 4685 1 6 . 1 1 95 95 ASP N N 95 113.833 113.833 116.330 -2.497 25757 4686 1 6 . 1 1 95 95 ASP C C 95 177.718 177.718 177.033 0.685 25757 4687 1 6 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.694 -1.749 25757 4688 1 6 . 1 1 95 95 ASP CB C 95 39.743 39.743 41.559 -1.817 25757 4689 1 6 . 1 1 95 95 ASP H H 95 8.159 8.159 7.999 0.160 25757 4690 1 6 . 1 1 96 96 GLY N N 96 109.414 109.414 109.554 -0.140 25757 4691 1 6 . 1 1 96 96 GLY C C 96 175.093 175.093 175.292 -0.199 25757 4692 1 6 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.608 1.646 25757 4693 1 6 . 1 1 96 96 GLY H H 96 7.848 7.848 7.769 0.079 25757 4694 1 6 . 1 1 97 97 ASN N N 97 119.590 119.590 119.528 0.062 25757 4695 1 6 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.590 0.022 25757 4696 1 6 . 1 1 97 97 ASN C C 97 175.937 175.937 176.738 -0.801 25757 4697 1 6 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.079 -0.191 25757 4698 1 6 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.431 -1.111 25757 4699 1 6 . 1 1 97 97 ASN H H 97 8.338 8.338 8.389 -0.051 25757 4700 1 6 . 1 1 98 98 GLY N N 98 112.940 112.940 107.756 5.184 25757 4701 1 6 . 1 1 98 98 GLY C C 98 172.429 172.429 172.594 -0.165 25757 4702 1 6 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.990 0.101 25757 4703 1 6 . 1 1 98 98 GLY H H 98 10.695 10.695 8.794 1.901 25757 4704 1 6 . 1 1 99 99 TYR N N 99 115.544 115.544 117.600 -2.056 25757 4705 1 6 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.292 -0.205 25757 4706 1 6 . 1 1 99 99 TYR C C 99 174.859 174.859 174.659 0.200 25757 4707 1 6 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.994 -0.976 25757 4708 1 6 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.517 0.837 25757 4709 1 6 . 1 1 99 99 TYR H H 99 7.597 7.597 8.547 -0.950 25757 4710 1 6 . 1 1 100 100 ILE N N 100 127.078 127.078 123.702 3.376 25757 4711 1 6 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.706 0.083 25757 4712 1 6 . 1 1 100 100 ILE C C 100 175.387 175.387 175.875 -0.488 25757 4713 1 6 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.651 0.355 25757 4714 1 6 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.629 -0.839 25757 4715 1 6 . 1 1 100 100 ILE H H 100 10.267 10.267 9.250 1.017 25757 4716 1 6 . 1 1 101 101 SER N N 101 124.102 124.102 122.912 1.190 25757 4717 1 6 . 1 1 101 101 SER HA H 101 4.417 4.417 5.222 -0.805 25757 4718 1 6 . 1 1 101 101 SER C C 101 175.360 175.360 175.369 -0.009 25757 4719 1 6 . 1 1 101 101 SER CA C 101 56.036 56.036 56.671 -0.635 25757 4720 1 6 . 1 1 101 101 SER CB C 101 66.896 66.896 65.457 1.439 25757 4721 1 6 . 1 1 101 101 SER H H 101 8.985 8.985 8.129 0.856 25757 4722 1 6 . 1 1 102 102 ALA N N 102 122.780 122.780 124.623 -1.843 25757 4723 1 6 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.940 -0.196 25757 4724 1 6 . 1 1 102 102 ALA C C 102 179.175 179.175 178.470 0.705 25757 4725 1 6 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.337 0.954 25757 4726 1 6 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.306 -0.279 25757 4727 1 6 . 1 1 102 102 ALA H H 102 9.269 9.269 9.007 0.262 25757 4728 1 6 . 1 1 103 103 ALA N N 103 118.513 118.513 120.840 -2.327 25757 4729 1 6 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.793 0.218 25757 4730 1 6 . 1 1 103 103 ALA C C 103 181.521 181.521 179.079 2.442 25757 4731 1 6 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.048 0.306 25757 4732 1 6 . 1 1 103 103 ALA CB C 103 18.291 18.291 17.995 0.296 25757 4733 1 6 . 1 1 103 103 ALA H H 103 8.321 8.321 8.363 -0.042 25757 4734 1 6 . 1 1 104 104 GLU N N 104 119.550 119.550 119.372 0.178 25757 4735 1 6 . 1 1 104 104 GLU HA H 104 4.006 4.006 3.930 0.076 25757 4736 1 6 . 1 1 104 104 GLU C C 104 179.750 179.750 179.306 0.444 25757 4737 1 6 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.725 -0.556 25757 4738 1 6 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.230 -0.015 25757 4739 1 6 . 1 1 104 104 GLU H H 104 7.867 7.867 8.339 -0.472 25757 4740 1 6 . 1 1 105 105 LEU N N 105 122.688 122.688 120.070 2.618 25757 4741 1 6 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.872 0.046 25757 4742 1 6 . 1 1 105 105 LEU C C 105 178.233 178.233 178.646 -0.413 25757 4743 1 6 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.118 -0.384 25757 4744 1 6 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.529 0.491 25757 4745 1 6 . 1 1 105 105 LEU H H 105 8.746 8.746 8.005 0.741 25757 4746 1 6 . 1 1 106 106 ARG N N 106 118.835 118.835 118.616 0.219 25757 4747 1 6 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.859 -0.209 25757 4748 1 6 . 1 1 106 106 ARG C C 106 178.742 178.742 179.216 -0.474 25757 4749 1 6 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.641 0.322 25757 4750 1 6 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.686 0.360 25757 4751 1 6 . 1 1 106 106 ARG H H 106 8.684 8.684 8.228 0.456 25757 4752 1 6 . 1 1 107 107 HIS N N 107 119.258 119.258 118.633 0.625 25757 4753 1 6 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.299 -0.032 25757 4754 1 6 . 1 1 107 107 HIS C C 107 177.244 177.244 178.169 -0.925 25757 4755 1 6 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.477 1.675 25757 4756 1 6 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.975 0.600 25757 4757 1 6 . 1 1 107 107 HIS H H 107 7.691 7.691 8.244 -0.553 25757 4758 1 6 . 1 1 108 108 VAL N N 108 118.996 118.996 120.873 -1.877 25757 4759 1 6 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.717 -0.279 25757 4760 1 6 . 1 1 108 108 VAL C C 108 177.998 177.998 178.080 -0.082 25757 4761 1 6 . 1 1 108 108 VAL CA C 108 66.431 66.431 67.304 -0.873 25757 4762 1 6 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.642 -0.218 25757 4763 1 6 . 1 1 108 108 VAL H H 108 7.599 7.599 8.241 -0.642 25757 4764 1 6 . 1 1 109 109 MET N N 109 114.880 114.880 117.983 -3.103 25757 4765 1 6 . 1 1 109 109 MET C C 109 179.119 179.119 178.401 0.718 25757 4766 1 6 . 1 1 109 109 MET CA C 109 56.979 56.979 59.156 -2.177 25757 4767 1 6 . 1 1 109 109 MET CB C 109 29.253 29.253 32.924 -3.671 25757 4768 1 6 . 1 1 109 109 MET H H 109 7.911 7.911 8.156 -0.245 25757 4769 1 6 . 1 1 110 110 THR N N 110 116.943 116.943 115.228 1.715 25757 4770 1 6 . 1 1 110 110 THR HA H 110 4.229 4.229 4.137 0.092 25757 4771 1 6 . 1 1 110 110 THR C C 110 178.506 178.506 177.345 1.161 25757 4772 1 6 . 1 1 110 110 THR CA C 110 66.573 66.573 65.936 0.637 25757 4773 1 6 . 1 1 110 110 THR CB C 110 68.575 68.575 68.636 -0.061 25757 4774 1 6 . 1 1 110 110 THR H H 110 8.353 8.353 8.319 0.034 25757 4775 1 6 . 1 1 111 111 ASN N N 111 123.829 123.829 120.589 3.240 25757 4776 1 6 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.414 -0.052 25757 4777 1 6 . 1 1 111 111 ASN C C 111 177.197 177.197 176.776 0.421 25757 4778 1 6 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.997 -0.038 25757 4779 1 6 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.569 -1.347 25757 4780 1 6 . 1 1 111 111 ASN H H 111 8.053 8.053 7.922 0.131 25757 4781 1 6 . 1 1 112 112 LEU N N 112 119.036 119.036 115.884 3.152 25757 4782 1 6 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.042 0.128 25757 4783 1 6 . 1 1 112 112 LEU C C 112 176.377 176.377 177.122 -0.745 25757 4784 1 6 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.346 -0.841 25757 4785 1 6 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.398 -0.038 25757 4786 1 6 . 1 1 112 112 LEU H H 112 7.794 7.794 7.628 0.166 25757 4787 1 6 . 1 1 113 113 GLY N N 113 106.045 106.045 104.389 1.656 25757 4788 1 6 . 1 1 113 113 GLY C C 113 174.248 174.248 174.131 0.117 25757 4789 1 6 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.505 0.802 25757 4790 1 6 . 1 1 113 113 GLY H H 113 7.741 7.741 7.726 0.015 25757 4791 1 6 . 1 1 114 114 GLU N N 114 120.556 120.556 119.921 0.635 25757 4792 1 6 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.077 0.233 25757 4793 1 6 . 1 1 114 114 GLU C C 114 174.993 174.993 175.368 -0.375 25757 4794 1 6 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.438 -1.801 25757 4795 1 6 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.146 1.071 25757 4796 1 6 . 1 1 114 114 GLU H H 114 7.980 7.980 8.015 -0.035 25757 4797 1 6 . 1 1 115 115 LYS N N 115 124.986 124.986 123.147 1.839 25757 4798 1 6 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.578 -0.244 25757 4799 1 6 . 1 1 115 115 LYS C C 115 175.285 175.285 175.601 -0.316 25757 4800 1 6 . 1 1 115 115 LYS CA C 115 55.581 55.581 55.464 0.117 25757 4801 1 6 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.968 -0.995 25757 4802 1 6 . 1 1 115 115 LYS H H 115 8.613 8.613 8.391 0.222 25757 4803 1 6 . 1 1 116 116 LEU N N 116 125.243 125.243 122.029 3.214 25757 4804 1 6 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.940 -0.252 25757 4805 1 6 . 1 1 116 116 LEU C C 116 178.365 178.365 176.123 2.242 25757 4806 1 6 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.328 1.020 25757 4807 1 6 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.483 0.806 25757 4808 1 6 . 1 1 116 116 LEU H H 116 8.066 8.066 8.211 -0.145 25757 4809 1 6 . 1 1 117 117 THR N N 117 114.324 114.324 109.367 4.957 25757 4810 1 6 . 1 1 117 117 THR HA H 117 4.713 4.713 4.598 0.115 25757 4811 1 6 . 1 1 117 117 THR C C 117 175.539 175.539 174.511 1.028 25757 4812 1 6 . 1 1 117 117 THR CA C 117 60.756 60.756 60.106 0.650 25757 4813 1 6 . 1 1 117 117 THR CB C 117 71.144 71.144 72.047 -0.903 25757 4814 1 6 . 1 1 117 117 THR H H 117 9.228 9.228 7.937 1.291 25757 4815 1 6 . 1 1 118 118 ASP N N 118 121.016 121.016 121.946 -0.930 25757 4816 1 6 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.271 -0.116 25757 4817 1 6 . 1 1 118 118 ASP H H 118 8.919 8.919 8.863 0.056 25757 4818 1 6 . 1 1 119 119 GLU N N 119 121.016 121.016 119.130 1.886 25757 4819 1 6 . 1 1 119 119 GLU C C 119 179.204 179.204 178.704 0.500 25757 4820 1 6 . 1 1 119 119 GLU CA C 119 58.070 58.070 58.963 -0.893 25757 4821 1 6 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.380 -0.336 25757 4822 1 6 . 1 1 119 119 GLU H H 119 8.919 8.919 8.725 0.194 25757 4823 1 6 . 1 1 120 120 GLU N N 120 120.566 120.566 119.763 0.803 25757 4824 1 6 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.988 0.013 25757 4825 1 6 . 1 1 120 120 GLU C C 120 180.329 180.329 178.991 1.338 25757 4826 1 6 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.195 -0.104 25757 4827 1 6 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.274 1.364 25757 4828 1 6 . 1 1 120 120 GLU H H 120 7.732 7.732 7.734 -0.002 25757 4829 1 6 . 1 1 121 121 VAL N N 121 121.875 121.875 119.501 2.374 25757 4830 1 6 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.611 -0.146 25757 4831 1 6 . 1 1 121 121 VAL C C 121 177.477 177.477 178.443 -0.966 25757 4832 1 6 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.463 0.708 25757 4833 1 6 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.486 -0.052 25757 4834 1 6 . 1 1 121 121 VAL H H 121 8.104 8.104 7.473 0.631 25757 4835 1 6 . 1 1 122 122 ASP N N 122 120.566 120.566 118.550 2.016 25757 4836 1 6 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.294 0.041 25757 4837 1 6 . 1 1 122 122 ASP C C 122 179.298 179.298 178.549 0.749 25757 4838 1 6 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.547 0.292 25757 4839 1 6 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.983 -0.671 25757 4840 1 6 . 1 1 122 122 ASP H H 122 8.089 8.089 8.137 -0.048 25757 4841 1 6 . 1 1 123 123 GLU N N 123 119.821 119.821 120.749 -0.928 25757 4842 1 6 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.037 0.012 25757 4843 1 6 . 1 1 123 123 GLU C C 123 178.749 178.749 178.721 0.028 25757 4844 1 6 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.303 0.015 25757 4845 1 6 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.809 -0.423 25757 4846 1 6 . 1 1 123 123 GLU H H 123 8.105 8.105 7.813 0.292 25757 4847 1 6 . 1 1 124 124 MET N N 124 119.288 119.288 118.393 0.895 25757 4848 1 6 . 1 1 124 124 MET C C 124 180.865 180.865 178.924 1.941 25757 4849 1 6 . 1 1 124 124 MET CA C 124 60.684 60.684 59.079 1.605 25757 4850 1 6 . 1 1 124 124 MET CB C 124 33.141 33.141 32.116 1.025 25757 4851 1 6 . 1 1 124 124 MET H H 124 7.726 7.726 8.120 -0.394 25757 4852 1 6 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.117 -0.388 25757 4853 1 6 . 1 1 125 125 ILE C C 125 177.341 177.341 177.908 -0.567 25757 4854 1 6 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.182 0.619 25757 4855 1 6 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.023 -1.458 25757 4856 1 6 . 1 1 126 126 ARG N N 126 118.555 118.555 120.363 -1.808 25757 4857 1 6 . 1 1 126 126 ARG C C 126 179.164 179.164 177.909 1.255 25757 4858 1 6 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.269 0.655 25757 4859 1 6 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.200 -0.335 25757 4860 1 6 . 1 1 126 126 ARG H H 126 8.380 8.380 7.939 0.441 25757 4861 1 6 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.357 -0.432 25757 4862 1 6 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.788 1.269 25757 4863 1 6 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.252 0.576 25757 4864 1 6 . 1 1 128 128 ALA N N 128 116.764 116.764 120.583 -3.819 25757 4865 1 6 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.138 0.279 25757 4866 1 6 . 1 1 128 128 ALA C C 128 177.885 177.885 177.295 0.590 25757 4867 1 6 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.083 -1.128 25757 4868 1 6 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.565 3.002 25757 4869 1 6 . 1 1 128 128 ALA H H 128 7.152 7.152 7.810 -0.658 25757 4870 1 6 . 1 1 129 129 ASP N N 129 117.762 117.762 118.312 -0.550 25757 4871 1 6 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.101 -0.624 25757 4872 1 6 . 1 1 129 129 ASP C C 129 175.935 175.935 176.526 -0.591 25757 4873 1 6 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.527 1.988 25757 4874 1 6 . 1 1 129 129 ASP CB C 129 40.745 40.745 40.640 0.105 25757 4875 1 6 . 1 1 129 129 ASP H H 129 8.007 8.007 7.932 0.075 25757 4876 1 6 . 1 1 130 130 ILE N N 130 128.249 128.249 125.068 3.181 25757 4877 1 6 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.853 0.011 25757 4878 1 6 . 1 1 130 130 ILE C C 130 177.764 177.764 177.280 0.484 25757 4879 1 6 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.837 -0.288 25757 4880 1 6 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.288 0.360 25757 4881 1 6 . 1 1 130 130 ILE H H 130 8.412 8.412 8.128 0.284 25757 4882 1 6 . 1 1 131 131 ASP N N 131 116.430 116.430 117.037 -0.607 25757 4883 1 6 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.665 -0.131 25757 4884 1 6 . 1 1 131 131 ASP C C 131 178.313 178.313 176.655 1.658 25757 4885 1 6 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.439 -0.555 25757 4886 1 6 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.847 -0.885 25757 4887 1 6 . 1 1 131 131 ASP H H 131 8.254 8.254 7.993 0.261 25757 4888 1 6 . 1 1 132 132 GLY N N 132 108.460 108.460 108.695 -0.235 25757 4889 1 6 . 1 1 132 132 GLY C C 132 175.211 175.211 174.499 0.712 25757 4890 1 6 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.705 1.898 25757 4891 1 6 . 1 1 132 132 GLY H H 132 7.547 7.547 7.970 -0.423 25757 4892 1 6 . 1 1 133 133 ASP N N 133 120.909 120.909 119.900 1.009 25757 4893 1 6 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.566 -0.103 25757 4894 1 6 . 1 1 133 133 ASP C C 133 177.691 177.691 177.677 0.014 25757 4895 1 6 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.743 1.071 25757 4896 1 6 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.402 -0.104 25757 4897 1 6 . 1 1 133 133 ASP H H 133 8.339 8.339 7.999 0.340 25757 4898 1 6 . 1 1 134 134 GLY N N 134 112.704 112.704 107.657 5.047 25757 4899 1 6 . 1 1 134 134 GLY C C 134 172.722 172.722 173.593 -0.871 25757 4900 1 6 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.666 0.370 25757 4901 1 6 . 1 1 134 134 GLY H H 134 10.396 10.396 7.949 2.447 25757 4902 1 6 . 1 1 135 135 GLN N N 135 114.799 114.799 117.895 -3.096 25757 4903 1 6 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.008 -0.144 25757 4904 1 6 . 1 1 135 135 GLN C C 135 174.760 174.760 174.677 0.083 25757 4905 1 6 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.708 -1.387 25757 4906 1 6 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.496 -1.431 25757 4907 1 6 . 1 1 135 135 GLN H H 135 7.975 7.975 8.692 -0.717 25757 4908 1 6 . 1 1 136 136 VAL N N 136 125.364 125.364 125.034 0.330 25757 4909 1 6 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.742 0.466 25757 4910 1 6 . 1 1 136 136 VAL C C 136 175.831 175.831 175.664 0.167 25757 4911 1 6 . 1 1 136 136 VAL CA C 136 61.817 61.817 60.825 0.992 25757 4912 1 6 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.665 1.009 25757 4913 1 6 . 1 1 136 136 VAL H H 136 9.169 9.169 9.064 0.105 25757 4914 1 6 . 1 1 137 137 ASN N N 137 129.155 129.155 125.899 3.256 25757 4915 1 6 . 1 1 137 137 ASN C C 137 174.737 174.737 175.659 -0.922 25757 4916 1 6 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.762 -0.411 25757 4917 1 6 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.400 -3.077 25757 4918 1 6 . 1 1 137 137 ASN H H 137 9.652 9.652 8.789 0.863 25757 4919 1 6 . 1 1 138 138 TYR N N 138 118.504 118.504 122.335 -3.831 25757 4920 1 6 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.519 -0.240 25757 4921 1 6 . 1 1 138 138 TYR C C 138 176.174 176.174 177.368 -1.194 25757 4922 1 6 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.821 0.754 25757 4923 1 6 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.102 -0.372 25757 4924 1 6 . 1 1 138 138 TYR H H 138 8.460 8.460 8.675 -0.215 25757 4925 1 6 . 1 1 139 139 GLU N N 139 118.644 118.644 117.537 1.107 25757 4926 1 6 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.817 -0.269 25757 4927 1 6 . 1 1 139 139 GLU C C 139 180.265 180.265 178.465 1.800 25757 4928 1 6 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.036 0.450 25757 4929 1 6 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.997 -0.006 25757 4930 1 6 . 1 1 139 139 GLU H H 139 8.136 8.136 8.129 0.007 25757 4931 1 6 . 1 1 140 140 GLU N N 140 120.030 120.030 116.745 3.285 25757 4932 1 6 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.052 -0.164 25757 4933 1 6 . 1 1 140 140 GLU C C 140 179.627 179.627 178.194 1.433 25757 4934 1 6 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.143 0.534 25757 4935 1 6 . 1 1 140 140 GLU CB C 140 29.727 29.727 28.971 0.756 25757 4936 1 6 . 1 1 140 140 GLU H H 140 8.798 8.798 8.384 0.414 25757 4937 1 6 . 1 1 141 141 PHE N N 141 123.154 123.154 122.535 0.619 25757 4938 1 6 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.836 -0.139 25757 4939 1 6 . 1 1 141 141 PHE C C 141 176.952 176.952 177.876 -0.924 25757 4940 1 6 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.746 1.306 25757 4941 1 6 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.317 0.814 25757 4942 1 6 . 1 1 141 141 PHE H H 141 8.633 8.633 8.048 0.585 25757 4943 1 6 . 1 1 142 142 VAL N N 142 120.046 120.046 116.659 3.387 25757 4944 1 6 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.550 -0.594 25757 4945 1 6 . 1 1 142 142 VAL C C 142 179.627 179.627 177.563 2.064 25757 4946 1 6 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.219 2.024 25757 4947 1 6 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.328 0.812 25757 4948 1 6 . 1 1 142 142 VAL H H 142 8.894 8.894 8.022 0.872 25757 4949 1 6 . 1 1 143 143 GLN N N 143 118.996 118.996 119.989 -0.993 25757 4950 1 6 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.975 -0.199 25757 4951 1 6 . 1 1 143 143 GLN C C 143 178.443 178.443 177.980 0.463 25757 4952 1 6 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.310 0.819 25757 4953 1 6 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.028 -0.285 25757 4954 1 6 . 1 1 143 143 GLN H H 143 7.627 7.627 7.342 0.285 25757 4955 1 6 . 1 1 144 144 MET N N 144 116.361 116.361 118.210 -1.849 25757 4956 1 6 . 1 1 144 144 MET HA H 144 4.169 4.169 4.048 0.121 25757 4957 1 6 . 1 1 144 144 MET C C 144 178.418 178.418 177.006 1.412 25757 4958 1 6 . 1 1 144 144 MET CA C 144 56.137 56.137 57.722 -1.585 25757 4959 1 6 . 1 1 144 144 MET CB C 144 31.095 31.095 32.335 -1.240 25757 4960 1 6 . 1 1 144 144 MET H H 144 7.179 7.179 7.363 -0.184 25757 4961 1 6 . 1 1 145 145 MET N N 145 115.373 115.373 117.049 -1.676 25757 4962 1 6 . 1 1 145 145 MET HA H 145 4.334 4.334 4.521 -0.187 25757 4963 1 6 . 1 1 145 145 MET C C 145 177.217 177.217 175.671 1.546 25757 4964 1 6 . 1 1 145 145 MET CA C 145 55.296 55.296 55.090 0.206 25757 4965 1 6 . 1 1 145 145 MET CB C 145 34.458 34.458 33.552 0.906 25757 4966 1 6 . 1 1 145 145 MET H H 145 7.776 7.776 7.630 0.146 25757 4967 1 6 . 1 1 146 146 THR N N 146 107.988 107.988 111.671 -3.683 25757 4968 1 6 . 1 1 146 146 THR HA H 146 4.239 4.239 4.439 -0.200 25757 4969 1 6 . 1 1 146 146 THR C C 146 175.378 175.378 174.799 0.579 25757 4970 1 6 . 1 1 146 146 THR CA C 146 61.625 61.625 61.149 0.476 25757 4971 1 6 . 1 1 146 146 THR CB C 146 70.817 70.817 68.608 2.209 25757 4972 1 6 . 1 1 146 146 THR H H 146 7.736 7.736 7.663 0.073 25757 4973 1 6 . 1 1 147 147 GLY N N 147 110.157 110.157 109.250 0.907 25757 4974 1 6 . 1 1 147 147 GLY C C 147 174.046 174.046 174.260 -0.214 25757 4975 1 6 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.801 0.743 25757 4976 1 6 . 1 1 147 147 GLY H H 147 7.793 7.793 8.029 -0.236 25757 4977 1 6 . 1 1 150 150 THR HA H 150 4.239 4.239 4.314 -0.075 25757 4978 1 6 . 1 1 150 150 THR C C 150 174.397 174.397 174.562 -0.165 25757 4979 1 6 . 1 1 150 150 THR CA C 150 61.260 61.260 62.343 -1.083 25757 4980 1 6 . 1 1 150 150 THR CB C 150 70.358 70.358 69.052 1.306 25757 4981 1 6 . 1 1 151 151 ALA N N 151 126.304 126.304 123.439 2.865 25757 4982 1 6 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.431 -0.143 25757 4983 1 6 . 1 1 151 151 ALA C C 151 177.678 177.678 177.351 0.327 25757 4984 1 6 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.387 0.761 25757 4985 1 6 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.988 -0.569 25757 4986 1 6 . 1 1 151 151 ALA H H 151 8.618 8.618 6.992 1.626 25757 4987 1 6 . 1 1 152 152 ALA N N 152 123.861 123.861 121.810 2.051 25757 4988 1 6 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.376 -0.258 25757 4989 1 6 . 1 1 152 152 ALA C C 152 178.823 178.823 178.421 0.402 25757 4990 1 6 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.580 1.914 25757 4991 1 6 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.182 0.575 25757 4992 1 6 . 1 1 152 152 ALA H H 152 8.354 8.354 8.640 -0.286 25757 4993 1 6 . 1 1 153 153 GLY N N 153 109.984 109.984 107.829 2.155 25757 4994 1 6 . 1 1 153 153 GLY C C 153 174.389 174.389 175.813 -1.424 25757 4995 1 6 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.010 -1.879 25757 4996 1 6 . 1 1 153 153 GLY H H 153 9.028 9.028 8.043 0.985 25757 4997 1 6 . 1 1 154 154 SER N N 154 113.934 113.934 118.460 -4.526 25757 4998 1 6 . 1 1 154 154 SER HA H 154 4.255 4.255 4.036 0.219 25757 4999 1 6 . 1 1 154 154 SER C C 154 177.929 177.929 176.608 1.321 25757 5000 1 6 . 1 1 154 154 SER CA C 154 59.379 59.379 62.703 -3.324 25757 5001 1 6 . 1 1 154 154 SER CB C 154 64.090 64.090 62.680 1.410 25757 5002 1 6 . 1 1 154 154 SER H H 154 7.962 7.962 8.180 -0.218 25757 5003 1 6 . 1 1 155 155 GLY N N 155 115.337 115.337 108.959 6.378 25757 5004 1 6 . 1 1 155 155 GLY C C 155 175.891 175.891 175.499 0.392 25757 5005 1 6 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.787 0.859 25757 5006 1 6 . 1 1 155 155 GLY H H 155 9.451 9.451 7.769 1.682 25757 5007 1 6 . 1 1 156 156 TRP N N 156 119.600 119.600 121.759 -2.159 25757 5008 1 6 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.238 0.033 25757 5009 1 6 . 1 1 156 156 TRP C C 156 178.947 178.947 178.773 0.174 25757 5010 1 6 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.275 -0.111 25757 5011 1 6 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.062 0.541 25757 5012 1 6 . 1 1 156 156 TRP H H 156 8.542 8.542 7.246 1.296 25757 5013 1 6 . 1 1 157 157 ARG N N 157 118.583 118.583 119.445 -0.862 25757 5014 1 6 . 1 1 157 157 ARG HA H 157 3.982 3.982 3.983 -0.001 25757 5015 1 6 . 1 1 157 157 ARG C C 157 177.894 177.894 178.195 -0.301 25757 5016 1 6 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.849 -0.510 25757 5017 1 6 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.067 -0.010 25757 5018 1 6 . 1 1 157 157 ARG H H 157 7.747 7.747 8.514 -0.767 25757 5019 1 6 . 1 1 158 158 LYS N N 158 117.033 117.033 119.924 -2.891 25757 5020 1 6 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.965 -0.022 25757 5021 1 6 . 1 1 158 158 LYS C C 158 176.973 176.973 178.890 -1.917 25757 5022 1 6 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.167 0.207 25757 5023 1 6 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.282 0.009 25757 5024 1 6 . 1 1 158 158 LYS H H 158 7.529 7.529 8.042 -0.513 25757 5025 1 6 . 1 1 159 159 ILE N N 159 116.553 116.553 120.031 -3.478 25757 5026 1 6 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.683 -0.139 25757 5027 1 6 . 1 1 159 159 ILE C C 159 176.894 176.894 177.150 -0.256 25757 5028 1 6 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.867 0.649 25757 5029 1 6 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.973 -0.169 25757 5030 1 6 . 1 1 159 159 ILE H H 159 7.348 7.348 8.177 -0.829 25757 5031 1 6 . 1 1 160 160 LYS N N 160 119.278 119.278 120.375 -1.097 25757 5032 1 6 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.270 -0.231 25757 5033 1 6 . 1 1 160 160 LYS C C 160 178.566 178.566 179.076 -0.510 25757 5034 1 6 . 1 1 160 160 LYS CA C 160 60.374 60.374 60.047 0.327 25757 5035 1 6 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.479 0.339 25757 5036 1 6 . 1 1 160 160 LYS H H 160 8.225 8.225 8.129 0.096 25757 5037 1 6 . 1 1 161 161 LEU N N 161 117.056 117.056 119.739 -2.683 25757 5038 1 6 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.089 -0.029 25757 5039 1 6 . 1 1 161 161 LEU C C 161 178.977 178.977 179.080 -0.103 25757 5040 1 6 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.648 0.376 25757 5041 1 6 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.406 0.576 25757 5042 1 6 . 1 1 161 161 LEU H H 161 8.057 8.057 8.338 -0.281 25757 5043 1 6 . 1 1 162 162 ALA N N 162 121.814 121.814 122.487 -0.673 25757 5044 1 6 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.035 0.057 25757 5045 1 6 . 1 1 162 162 ALA C C 162 178.374 178.374 179.559 -1.185 25757 5046 1 6 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.313 0.477 25757 5047 1 6 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.549 -0.224 25757 5048 1 6 . 1 1 162 162 ALA H H 162 8.170 8.170 8.210 -0.040 25757 5049 1 6 . 1 1 163 163 VAL N N 163 115.449 115.449 116.678 -1.229 25757 5050 1 6 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.841 -0.223 25757 5051 1 6 . 1 1 163 163 VAL C C 163 178.362 178.362 177.558 0.804 25757 5052 1 6 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.169 1.103 25757 5053 1 6 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.883 1.154 25757 5054 1 6 . 1 1 163 163 VAL H H 163 8.499 8.499 8.059 0.440 25757 5055 1 6 . 1 1 164 164 ARG N N 164 115.775 115.775 120.385 -4.610 25757 5056 1 6 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.317 -0.120 25757 5057 1 6 . 1 1 164 164 ARG C C 164 178.938 178.938 178.851 0.087 25757 5058 1 6 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.144 -0.461 25757 5059 1 6 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.517 -0.683 25757 5060 1 6 . 1 1 164 164 ARG H H 164 8.165 8.165 8.386 -0.221 25757 5061 1 6 . 1 1 165 165 GLY N N 165 105.570 105.570 107.160 -1.590 25757 5062 1 6 . 1 1 165 165 GLY C C 165 173.134 173.134 175.190 -2.056 25757 5063 1 6 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.881 -0.139 25757 5064 1 6 . 1 1 165 165 GLY H H 165 8.455 8.455 8.355 0.100 25757 5065 1 6 . 1 1 166 166 ALA N N 166 120.648 120.648 123.561 -2.913 25757 5066 1 6 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.224 0.118 25757 5067 1 6 . 1 1 166 166 ALA C C 166 176.155 176.155 177.537 -1.382 25757 5068 1 6 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.831 -2.058 25757 5069 1 6 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.084 0.394 25757 5070 1 6 . 1 1 166 166 ALA H H 166 7.826 7.826 7.878 -0.052 25757 5071 1 6 . 1 1 167 167 GLN N N 167 117.315 117.315 116.516 0.799 25757 5072 1 6 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.526 -0.249 25757 5073 1 6 . 1 1 167 167 GLN C C 167 175.571 175.571 175.283 0.288 25757 5074 1 6 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.740 1.187 25757 5075 1 6 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.573 -0.388 25757 5076 1 6 . 1 1 167 167 GLN H H 167 7.498 7.498 7.673 -0.175 25757 5077 1 6 . 1 1 168 168 ALA N N 168 126.706 126.706 126.854 -0.148 25757 5078 1 6 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.069 0.210 25757 5079 1 6 . 1 1 168 168 ALA C C 168 177.227 177.227 177.544 -0.317 25757 5080 1 6 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.524 -2.458 25757 5081 1 6 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.002 0.704 25757 5082 1 6 . 1 1 168 168 ALA H H 168 8.534 8.534 8.675 -0.141 25757 5083 1 7 . 1 1 9 9 ILE N N 9 116.733 116.733 121.049 -4.316 25757 5084 1 7 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.975 -0.218 25757 5085 1 7 . 1 1 9 9 ILE C C 9 177.828 177.828 177.885 -0.057 25757 5086 1 7 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.244 3.360 25757 5087 1 7 . 1 1 9 9 ILE CB C 9 37.598 37.598 36.572 1.026 25757 5088 1 7 . 1 1 9 9 ILE H H 9 7.366 7.366 8.238 -0.872 25757 5089 1 7 . 1 1 10 10 ALA N N 10 121.080 121.080 123.058 -1.978 25757 5090 1 7 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.980 0.095 25757 5091 1 7 . 1 1 10 10 ALA C C 10 180.921 180.921 179.551 1.370 25757 5092 1 7 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.373 0.230 25757 5093 1 7 . 1 1 10 10 ALA CB C 10 17.984 17.984 18.156 -0.172 25757 5094 1 7 . 1 1 10 10 ALA H H 10 8.039 8.039 8.446 -0.407 25757 5095 1 7 . 1 1 11 11 GLU N N 11 119.580 119.580 119.085 0.495 25757 5096 1 7 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.913 0.176 25757 5097 1 7 . 1 1 11 11 GLU C C 11 179.561 179.561 179.213 0.348 25757 5098 1 7 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.117 0.768 25757 5099 1 7 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.127 0.336 25757 5100 1 7 . 1 1 11 11 GLU H H 11 7.741 7.741 7.702 0.039 25757 5101 1 7 . 1 1 12 12 PHE N N 12 118.509 118.509 118.004 0.505 25757 5102 1 7 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.358 0.468 25757 5103 1 7 . 1 1 12 12 PHE C C 12 179.000 179.000 178.106 0.894 25757 5104 1 7 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.860 0.304 25757 5105 1 7 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.030 0.080 25757 5106 1 7 . 1 1 12 12 PHE H H 12 8.470 8.470 7.053 1.417 25757 5107 1 7 . 1 1 13 13 LYS N N 13 123.523 123.523 119.893 3.630 25757 5108 1 7 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.123 -0.097 25757 5109 1 7 . 1 1 13 13 LYS C C 13 179.260 179.260 179.270 -0.010 25757 5110 1 7 . 1 1 13 13 LYS CA C 13 60.164 60.164 60.052 0.112 25757 5111 1 7 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.246 -0.413 25757 5112 1 7 . 1 1 13 13 LYS H H 13 9.171 9.171 8.777 0.394 25757 5113 1 7 . 1 1 14 14 GLU N N 14 120.415 120.415 118.957 1.458 25757 5114 1 7 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.220 -0.125 25757 5115 1 7 . 1 1 14 14 GLU C C 14 179.851 179.851 179.144 0.707 25757 5116 1 7 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.218 0.368 25757 5117 1 7 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.323 0.239 25757 5118 1 7 . 1 1 14 14 GLU H H 14 7.822 7.822 8.359 -0.537 25757 5119 1 7 . 1 1 15 15 ALA N N 15 122.143 122.143 123.471 -1.328 25757 5120 1 7 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.235 -0.105 25757 5121 1 7 . 1 1 15 15 ALA C C 15 178.222 178.222 179.430 -1.208 25757 5122 1 7 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.382 -0.192 25757 5123 1 7 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.898 -0.395 25757 5124 1 7 . 1 1 15 15 ALA H H 15 8.244 8.244 8.444 -0.200 25757 5125 1 7 . 1 1 16 16 PHE N N 16 119.809 119.809 118.034 1.775 25757 5126 1 7 . 1 1 16 16 PHE HA H 16 4.012 4.012 3.912 0.100 25757 5127 1 7 . 1 1 16 16 PHE C C 16 177.444 177.444 176.815 0.629 25757 5128 1 7 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.152 1.912 25757 5129 1 7 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.053 -0.621 25757 5130 1 7 . 1 1 16 16 PHE H H 16 8.891 8.891 8.539 0.352 25757 5131 1 7 . 1 1 17 17 SER N N 17 112.631 112.631 115.814 -3.183 25757 5132 1 7 . 1 1 17 17 SER HA H 17 4.034 4.034 3.904 0.130 25757 5133 1 7 . 1 1 17 17 SER C C 17 174.675 174.675 175.819 -1.144 25757 5134 1 7 . 1 1 17 17 SER CA C 17 61.507 61.507 61.381 0.126 25757 5135 1 7 . 1 1 17 17 SER CB C 17 63.414 63.414 63.460 -0.046 25757 5136 1 7 . 1 1 17 17 SER H H 17 7.910 7.910 8.389 -0.479 25757 5137 1 7 . 1 1 18 18 LEU N N 18 120.614 120.614 117.650 2.964 25757 5138 1 7 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.274 -0.262 25757 5139 1 7 . 1 1 18 18 LEU C C 18 177.366 177.366 177.592 -0.226 25757 5140 1 7 . 1 1 18 18 LEU CA C 18 57.386 57.386 56.959 0.427 25757 5141 1 7 . 1 1 18 18 LEU CB C 18 41.595 41.595 42.069 -0.474 25757 5142 1 7 . 1 1 18 18 LEU H H 18 7.423 7.423 7.938 -0.515 25757 5143 1 7 . 1 1 19 19 PHE N N 19 114.602 114.602 118.040 -3.438 25757 5144 1 7 . 1 1 19 19 PHE C C 19 176.961 176.961 176.108 0.853 25757 5145 1 7 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.654 -1.170 25757 5146 1 7 . 1 1 19 19 PHE CB C 19 40.769 40.769 38.889 1.881 25757 5147 1 7 . 1 1 19 19 PHE H H 19 7.254 7.254 7.245 0.009 25757 5148 1 7 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.595 -0.020 25757 5149 1 7 . 1 1 22 22 ASP CA C 22 52.648 52.648 53.542 -0.894 25757 5150 1 7 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.789 -0.779 25757 5151 1 7 . 1 1 23 23 GLY N N 23 108.244 108.244 108.005 0.239 25757 5152 1 7 . 1 1 23 23 GLY C C 23 175.188 175.188 175.434 -0.246 25757 5153 1 7 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.295 1.108 25757 5154 1 7 . 1 1 23 23 GLY H H 23 7.555 7.555 8.317 -0.762 25757 5155 1 7 . 1 1 24 24 ASP N N 24 120.667 120.667 120.116 0.551 25757 5156 1 7 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.479 -0.010 25757 5157 1 7 . 1 1 24 24 ASP C C 24 177.457 177.457 177.902 -0.445 25757 5158 1 7 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.714 0.078 25757 5159 1 7 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.217 -0.701 25757 5160 1 7 . 1 1 24 24 ASP H H 24 8.397 8.397 8.523 -0.126 25757 5161 1 7 . 1 1 25 25 GLY N N 25 112.989 112.989 108.512 4.477 25757 5162 1 7 . 1 1 25 25 GLY C C 25 173.639 173.639 173.498 0.141 25757 5163 1 7 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.056 0.445 25757 5164 1 7 . 1 1 25 25 GLY H H 25 10.592 10.592 8.056 2.536 25757 5165 1 7 . 1 1 26 26 THR N N 26 112.948 112.948 113.164 -0.216 25757 5166 1 7 . 1 1 26 26 THR HA H 26 5.282 5.282 5.025 0.257 25757 5167 1 7 . 1 1 26 26 THR C C 26 172.853 172.853 172.518 0.335 25757 5168 1 7 . 1 1 26 26 THR CA C 26 59.817 59.817 61.757 -1.940 25757 5169 1 7 . 1 1 26 26 THR CB C 26 72.465 72.465 71.012 1.453 25757 5170 1 7 . 1 1 26 26 THR H H 26 8.121 8.121 8.433 -0.312 25757 5171 1 7 . 1 1 27 27 ILE N N 27 127.195 127.195 122.799 4.396 25757 5172 1 7 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.800 0.113 25757 5173 1 7 . 1 1 27 27 ILE C C 27 176.091 176.091 174.989 1.102 25757 5174 1 7 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.214 0.551 25757 5175 1 7 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.863 -2.158 25757 5176 1 7 . 1 1 27 27 ILE H H 27 9.867 9.867 8.825 1.042 25757 5177 1 7 . 1 1 28 28 THR N N 28 116.655 116.655 120.936 -4.281 25757 5178 1 7 . 1 1 28 28 THR HA H 28 4.790 4.790 4.756 0.034 25757 5179 1 7 . 1 1 28 28 THR C C 28 176.696 176.696 176.298 0.398 25757 5180 1 7 . 1 1 28 28 THR CA C 28 59.590 59.590 60.630 -1.040 25757 5181 1 7 . 1 1 28 28 THR CB C 28 72.457 72.457 70.819 1.638 25757 5182 1 7 . 1 1 28 28 THR H H 28 8.457 8.457 8.426 0.031 25757 5183 1 7 . 1 1 29 29 THR N N 29 111.878 111.878 118.189 -6.311 25757 5184 1 7 . 1 1 29 29 THR HA H 29 4.188 4.188 4.009 0.179 25757 5185 1 7 . 1 1 29 29 THR C C 29 177.399 177.399 176.463 0.936 25757 5186 1 7 . 1 1 29 29 THR CA C 29 66.386 66.386 66.584 -0.198 25757 5187 1 7 . 1 1 29 29 THR CB C 29 67.726 67.726 68.044 -0.319 25757 5188 1 7 . 1 1 29 29 THR H H 29 9.211 9.211 8.962 0.249 25757 5189 1 7 . 1 1 30 30 LYS N N 30 121.140 121.140 121.573 -0.433 25757 5190 1 7 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.998 0.079 25757 5191 1 7 . 1 1 30 30 LYS C C 30 179.793 179.793 178.913 0.880 25757 5192 1 7 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.648 -0.356 25757 5193 1 7 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.810 0.637 25757 5194 1 7 . 1 1 30 30 LYS H H 30 7.580 7.580 7.905 -0.325 25757 5195 1 7 . 1 1 31 31 GLU N N 31 121.865 121.865 119.025 2.840 25757 5196 1 7 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.894 0.100 25757 5197 1 7 . 1 1 31 31 GLU C C 31 179.355 179.355 178.583 0.772 25757 5198 1 7 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.998 -0.365 25757 5199 1 7 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.285 0.567 25757 5200 1 7 . 1 1 31 31 GLU H H 31 7.708 7.708 8.227 -0.519 25757 5201 1 7 . 1 1 32 32 LEU N N 32 120.597 120.597 120.169 0.428 25757 5202 1 7 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.769 0.347 25757 5203 1 7 . 1 1 32 32 LEU C C 32 178.885 178.885 178.708 0.177 25757 5204 1 7 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.048 0.313 25757 5205 1 7 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.895 1.141 25757 5206 1 7 . 1 1 32 32 LEU H H 32 8.688 8.688 7.699 0.989 25757 5207 1 7 . 1 1 33 33 GLY N N 33 104.837 104.837 106.454 -1.617 25757 5208 1 7 . 1 1 33 33 GLY C C 33 175.123 175.123 175.447 -0.324 25757 5209 1 7 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.301 0.946 25757 5210 1 7 . 1 1 33 33 GLY H H 33 8.694 8.694 8.503 0.191 25757 5211 1 7 . 1 1 34 34 THR N N 34 117.631 117.631 117.449 0.182 25757 5212 1 7 . 1 1 34 34 THR HA H 34 3.899 3.899 3.868 0.031 25757 5213 1 7 . 1 1 34 34 THR C C 34 176.951 176.951 176.599 0.352 25757 5214 1 7 . 1 1 34 34 THR CA C 34 67.234 67.234 65.808 1.426 25757 5215 1 7 . 1 1 34 34 THR CB C 34 68.863 68.863 68.757 0.106 25757 5216 1 7 . 1 1 34 34 THR H H 34 7.960 7.960 7.937 0.023 25757 5217 1 7 . 1 1 35 35 VAL N N 35 121.659 121.659 121.229 0.430 25757 5218 1 7 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.438 0.079 25757 5219 1 7 . 1 1 35 35 VAL C C 35 178.265 178.265 177.535 0.730 25757 5220 1 7 . 1 1 35 35 VAL CA C 35 66.675 66.675 67.175 -0.500 25757 5221 1 7 . 1 1 35 35 VAL CB C 35 31.293 31.293 30.761 0.532 25757 5222 1 7 . 1 1 35 35 VAL H H 35 7.358 7.358 8.389 -1.031 25757 5223 1 7 . 1 1 36 36 MET N N 36 117.456 117.456 118.680 -1.224 25757 5224 1 7 . 1 1 36 36 MET C C 36 179.088 179.088 179.093 -0.005 25757 5225 1 7 . 1 1 36 36 MET CA C 36 60.477 60.477 59.526 0.952 25757 5226 1 7 . 1 1 36 36 MET CB C 36 32.443 32.443 32.551 -0.108 25757 5227 1 7 . 1 1 36 36 MET H H 36 8.194 8.194 8.362 -0.168 25757 5228 1 7 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.877 0.270 25757 5229 1 7 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.169 0.181 25757 5230 1 7 . 1 1 38 38 SER HA H 38 4.085 4.085 4.276 -0.191 25757 5231 1 7 . 1 1 38 38 SER C C 38 173.788 173.788 175.200 -1.412 25757 5232 1 7 . 1 1 38 38 SER CA C 38 61.617 61.617 61.664 -0.047 25757 5233 1 7 . 1 1 38 38 SER CB C 38 62.943 62.943 62.957 -0.014 25757 5234 1 7 . 1 1 39 39 LEU N N 39 119.003 119.003 118.977 0.026 25757 5235 1 7 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.542 -0.048 25757 5236 1 7 . 1 1 39 39 LEU C C 39 176.470 176.470 177.792 -1.322 25757 5237 1 7 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.209 0.471 25757 5238 1 7 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.216 1.298 25757 5239 1 7 . 1 1 39 39 LEU H H 39 7.230 7.230 7.420 -0.190 25757 5240 1 7 . 1 1 40 40 GLY N N 40 105.026 105.026 107.661 -2.635 25757 5241 1 7 . 1 1 40 40 GLY C C 40 174.322 174.322 174.778 -0.456 25757 5242 1 7 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.120 1.095 25757 5243 1 7 . 1 1 40 40 GLY H H 40 7.698 7.698 8.291 -0.593 25757 5244 1 7 . 1 1 41 41 GLN N N 41 117.929 117.929 119.452 -1.523 25757 5245 1 7 . 1 1 41 41 GLN C C 41 174.557 174.557 175.293 -0.736 25757 5246 1 7 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.434 1.410 25757 5247 1 7 . 1 1 41 41 GLN H H 41 7.866 7.866 7.853 0.013 25757 5248 1 7 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.518 0.218 25757 5249 1 7 . 1 1 43 43 PRO C C 43 177.805 177.805 176.230 1.575 25757 5250 1 7 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.862 -0.357 25757 5251 1 7 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.596 -0.434 25757 5252 1 7 . 1 1 44 44 THR N N 44 113.167 113.167 117.290 -4.123 25757 5253 1 7 . 1 1 44 44 THR HA H 44 4.684 4.684 4.524 0.160 25757 5254 1 7 . 1 1 44 44 THR C C 44 175.139 175.139 175.696 -0.557 25757 5255 1 7 . 1 1 44 44 THR CA C 44 60.556 60.556 59.257 1.299 25757 5256 1 7 . 1 1 44 44 THR CB C 44 71.064 71.064 70.582 0.482 25757 5257 1 7 . 1 1 44 44 THR H H 44 8.798 8.798 7.849 0.949 25757 5258 1 7 . 1 1 45 45 GLU N N 45 120.673 120.673 121.556 -0.883 25757 5259 1 7 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.928 0.063 25757 5260 1 7 . 1 1 45 45 GLU C C 45 178.940 178.940 178.183 0.757 25757 5261 1 7 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.582 -0.681 25757 5262 1 7 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.546 -0.517 25757 5263 1 7 . 1 1 45 45 GLU H H 45 8.812 8.812 9.048 -0.236 25757 5264 1 7 . 1 1 46 46 ALA N N 46 120.576 120.576 120.883 -0.307 25757 5265 1 7 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.008 -0.041 25757 5266 1 7 . 1 1 46 46 ALA C C 46 180.290 180.290 179.871 0.419 25757 5267 1 7 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.264 -0.345 25757 5268 1 7 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.156 0.005 25757 5269 1 7 . 1 1 46 46 ALA H H 46 8.276 8.276 8.406 -0.130 25757 5270 1 7 . 1 1 47 47 GLU N N 47 116.104 116.104 119.037 -2.933 25757 5271 1 7 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.044 -0.044 25757 5272 1 7 . 1 1 47 47 GLU C C 47 180.224 180.224 179.176 1.048 25757 5273 1 7 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.412 -0.481 25757 5274 1 7 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.299 0.690 25757 5275 1 7 . 1 1 47 47 GLU H H 47 7.425 7.425 7.520 -0.095 25757 5276 1 7 . 1 1 48 48 LEU N N 48 120.425 120.425 120.428 -0.003 25757 5277 1 7 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.859 0.191 25757 5278 1 7 . 1 1 48 48 LEU C C 48 178.551 178.551 179.242 -0.691 25757 5279 1 7 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.636 -0.798 25757 5280 1 7 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.297 1.272 25757 5281 1 7 . 1 1 48 48 LEU H H 48 8.121 8.121 8.389 -0.268 25757 5282 1 7 . 1 1 49 49 GLN N N 49 118.372 118.372 116.755 1.617 25757 5283 1 7 . 1 1 49 49 GLN HA H 49 3.762 3.762 4.006 -0.244 25757 5284 1 7 . 1 1 49 49 GLN C C 49 178.567 178.567 178.979 -0.412 25757 5285 1 7 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.485 0.378 25757 5286 1 7 . 1 1 49 49 GLN CB C 49 28.242 28.242 27.507 0.735 25757 5287 1 7 . 1 1 49 49 GLN H H 49 8.302 8.302 8.207 0.095 25757 5288 1 7 . 1 1 50 50 ASP N N 50 119.992 119.992 120.873 -0.881 25757 5289 1 7 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.373 -0.013 25757 5290 1 7 . 1 1 50 50 ASP C C 50 178.600 178.600 178.461 0.139 25757 5291 1 7 . 1 1 50 50 ASP CA C 50 57.703 57.703 56.944 0.759 25757 5292 1 7 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.476 -0.009 25757 5293 1 7 . 1 1 50 50 ASP H H 50 8.150 8.150 8.081 0.069 25757 5294 1 7 . 1 1 51 51 MET N N 51 119.238 119.238 120.136 -0.898 25757 5295 1 7 . 1 1 51 51 MET HA H 51 3.981 3.981 4.032 -0.051 25757 5296 1 7 . 1 1 51 51 MET C C 51 179.006 179.006 178.414 0.592 25757 5297 1 7 . 1 1 51 51 MET CA C 51 59.443 59.443 58.360 1.083 25757 5298 1 7 . 1 1 51 51 MET CB C 51 33.380 33.380 32.639 0.742 25757 5299 1 7 . 1 1 51 51 MET H H 51 7.844 7.844 8.179 -0.335 25757 5300 1 7 . 1 1 52 52 ILE N N 52 118.161 118.161 118.633 -0.472 25757 5301 1 7 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.624 -0.146 25757 5302 1 7 . 1 1 52 52 ILE C C 52 177.847 177.847 178.718 -0.871 25757 5303 1 7 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.655 0.340 25757 5304 1 7 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.526 0.597 25757 5305 1 7 . 1 1 52 52 ILE H H 52 7.686 7.686 8.420 -0.734 25757 5306 1 7 . 1 1 53 53 ASN N N 53 117.884 117.884 117.197 0.687 25757 5307 1 7 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.508 -0.143 25757 5308 1 7 . 1 1 53 53 ASN C C 53 177.515 177.515 177.935 -0.420 25757 5309 1 7 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.512 0.695 25757 5310 1 7 . 1 1 53 53 ASN CB C 53 38.078 38.078 37.860 0.218 25757 5311 1 7 . 1 1 53 53 ASN H H 53 8.713 8.713 8.368 0.345 25757 5312 1 7 . 1 1 54 54 GLU N N 54 116.178 116.178 118.410 -2.232 25757 5313 1 7 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.225 -0.236 25757 5314 1 7 . 1 1 54 54 GLU C C 54 177.557 177.557 177.276 0.281 25757 5315 1 7 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.991 0.999 25757 5316 1 7 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.353 0.110 25757 5317 1 7 . 1 1 54 54 GLU H H 54 7.530 7.530 8.015 -0.485 25757 5318 1 7 . 1 1 55 55 VAL N N 55 107.164 107.164 111.405 -4.241 25757 5319 1 7 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.331 0.191 25757 5320 1 7 . 1 1 55 55 VAL C C 55 175.602 175.602 174.563 1.039 25757 5321 1 7 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.476 -0.124 25757 5322 1 7 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.139 0.464 25757 5323 1 7 . 1 1 55 55 VAL H H 55 7.175 7.175 7.504 -0.329 25757 5324 1 7 . 1 1 56 56 ASP N N 56 122.126 122.126 120.855 1.271 25757 5325 1 7 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.171 -0.572 25757 5326 1 7 . 1 1 56 56 ASP C C 56 176.182 176.182 175.998 0.184 25757 5327 1 7 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.236 0.570 25757 5328 1 7 . 1 1 56 56 ASP CB C 56 40.270 40.270 41.886 -1.616 25757 5329 1 7 . 1 1 56 56 ASP H H 56 7.569 7.569 7.434 0.135 25757 5330 1 7 . 1 1 57 57 ALA N N 57 103.782 103.782 129.269 -25.487 25757 5331 1 7 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.244 -0.064 25757 5332 1 7 . 1 1 57 57 ALA C C 57 178.584 178.584 178.688 -0.104 25757 5333 1 7 . 1 1 57 57 ALA CA C 57 54.344 54.344 54.036 0.308 25757 5334 1 7 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.836 -0.312 25757 5335 1 7 . 1 1 57 57 ALA H H 57 8.515 8.515 9.369 -0.854 25757 5336 1 7 . 1 1 58 58 ASP N N 58 113.602 113.602 117.059 -3.457 25757 5337 1 7 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.596 -0.010 25757 5338 1 7 . 1 1 58 58 ASP C C 58 177.756 177.756 177.166 0.590 25757 5339 1 7 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.307 -1.545 25757 5340 1 7 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.655 -1.977 25757 5341 1 7 . 1 1 58 58 ASP H H 58 8.130 8.130 8.189 -0.059 25757 5342 1 7 . 1 1 59 59 GLY N N 59 109.195 109.195 110.979 -1.784 25757 5343 1 7 . 1 1 59 59 GLY C C 59 175.139 175.139 174.385 0.754 25757 5344 1 7 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.227 2.037 25757 5345 1 7 . 1 1 59 59 GLY H H 59 7.694 7.694 8.161 -0.467 25757 5346 1 7 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.779 -0.174 25757 5347 1 7 . 1 1 61 61 GLY N N 61 113.316 113.316 110.310 3.006 25757 5348 1 7 . 1 1 61 61 GLY C C 61 173.234 173.234 172.978 0.256 25757 5349 1 7 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.156 0.542 25757 5350 1 7 . 1 1 61 61 GLY H H 61 10.633 10.633 9.267 1.366 25757 5351 1 7 . 1 1 62 62 THR N N 62 108.892 108.892 110.063 -1.171 25757 5352 1 7 . 1 1 62 62 THR HA H 62 4.736 4.736 4.835 -0.099 25757 5353 1 7 . 1 1 62 62 THR C C 62 173.091 173.091 172.976 0.115 25757 5354 1 7 . 1 1 62 62 THR CA C 62 59.617 59.617 59.442 0.175 25757 5355 1 7 . 1 1 62 62 THR CB C 62 72.004 72.004 72.317 -0.313 25757 5356 1 7 . 1 1 62 62 THR H H 62 7.673 7.673 8.069 -0.396 25757 5357 1 7 . 1 1 63 63 ILE N N 63 123.324 123.324 122.445 0.879 25757 5358 1 7 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.826 0.303 25757 5359 1 7 . 1 1 63 63 ILE C C 63 175.652 175.652 175.029 0.623 25757 5360 1 7 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.565 -0.079 25757 5361 1 7 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.599 -0.642 25757 5362 1 7 . 1 1 63 63 ILE H H 63 8.907 8.907 8.853 0.054 25757 5363 1 7 . 1 1 64 64 ASP N N 64 128.253 128.253 128.097 0.156 25757 5364 1 7 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.902 0.419 25757 5365 1 7 . 1 1 64 64 ASP C C 64 176.431 176.431 177.112 -0.681 25757 5366 1 7 . 1 1 64 64 ASP CA C 64 52.331 52.331 52.855 -0.524 25757 5367 1 7 . 1 1 64 64 ASP CB C 64 42.053 42.053 43.087 -1.034 25757 5368 1 7 . 1 1 64 64 ASP H H 64 8.864 8.864 9.072 -0.208 25757 5369 1 7 . 1 1 65 65 PHE N N 65 118.583 118.583 120.680 -2.097 25757 5370 1 7 . 1 1 65 65 PHE HA H 65 3.860 3.860 3.922 -0.062 25757 5371 1 7 . 1 1 65 65 PHE C C 65 173.458 173.458 174.236 -0.778 25757 5372 1 7 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.393 2.406 25757 5373 1 7 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.651 -0.771 25757 5374 1 7 . 1 1 65 65 PHE H H 65 8.962 8.962 8.935 0.027 25757 5375 1 7 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.632 0.486 25757 5376 1 7 . 1 1 66 66 PRO C C 66 180.038 180.038 178.463 1.575 25757 5377 1 7 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.071 1.619 25757 5378 1 7 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.710 -0.033 25757 5379 1 7 . 1 1 67 67 GLU N N 67 118.402 118.402 118.996 -0.594 25757 5380 1 7 . 1 1 67 67 GLU C C 67 178.737 178.737 178.691 0.046 25757 5381 1 7 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.785 -0.777 25757 5382 1 7 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.152 0.533 25757 5383 1 7 . 1 1 67 67 GLU H H 67 7.953 7.953 8.431 -0.478 25757 5384 1 7 . 1 1 68 68 PHE N N 68 123.421 123.421 120.323 3.098 25757 5385 1 7 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.004 -0.032 25757 5386 1 7 . 1 1 68 68 PHE C C 68 177.184 177.184 177.095 0.089 25757 5387 1 7 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.304 0.034 25757 5388 1 7 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.929 1.040 25757 5389 1 7 . 1 1 68 68 PHE H H 68 8.928 8.928 7.472 1.456 25757 5390 1 7 . 1 1 69 69 LEU N N 69 119.284 119.284 119.504 -0.220 25757 5391 1 7 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.521 -0.186 25757 5392 1 7 . 1 1 69 69 LEU C C 69 178.987 178.987 178.383 0.604 25757 5393 1 7 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.535 -0.673 25757 5394 1 7 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.597 -0.765 25757 5395 1 7 . 1 1 69 69 LEU H H 69 8.374 8.374 7.527 0.847 25757 5396 1 7 . 1 1 70 70 THR N N 70 116.017 116.017 114.745 1.272 25757 5397 1 7 . 1 1 70 70 THR HA H 70 4.338 4.338 3.634 0.704 25757 5398 1 7 . 1 1 70 70 THR C C 70 176.169 176.169 176.467 -0.298 25757 5399 1 7 . 1 1 70 70 THR CA C 70 66.700 66.700 66.525 0.175 25757 5400 1 7 . 1 1 70 70 THR CB C 70 68.379 68.379 68.669 -0.290 25757 5401 1 7 . 1 1 70 70 THR H H 70 7.493 7.493 8.016 -0.523 25757 5402 1 7 . 1 1 71 71 MET N N 71 121.915 121.915 121.748 0.167 25757 5403 1 7 . 1 1 71 71 MET HA H 71 3.718 3.718 3.913 -0.195 25757 5404 1 7 . 1 1 71 71 MET C C 71 178.190 178.190 177.593 0.597 25757 5405 1 7 . 1 1 71 71 MET CA C 71 59.335 59.335 58.395 0.940 25757 5406 1 7 . 1 1 71 71 MET CB C 71 33.894 33.894 32.214 1.680 25757 5407 1 7 . 1 1 71 71 MET H H 71 7.924 7.924 7.904 0.020 25757 5408 1 7 . 1 1 72 72 MET N N 72 116.973 116.973 117.927 -0.954 25757 5409 1 7 . 1 1 72 72 MET HA H 72 3.968 3.968 4.076 -0.108 25757 5410 1 7 . 1 1 72 72 MET C C 72 178.211 178.211 178.229 -0.018 25757 5411 1 7 . 1 1 72 72 MET CA C 72 56.059 56.059 57.522 -1.463 25757 5412 1 7 . 1 1 72 72 MET CB C 72 31.639 31.639 31.669 -0.030 25757 5413 1 7 . 1 1 72 72 MET H H 72 8.276 8.276 7.811 0.465 25757 5414 1 7 . 1 1 73 73 ALA N N 73 122.499 122.499 120.836 1.663 25757 5415 1 7 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.851 0.099 25757 5416 1 7 . 1 1 73 73 ALA C C 73 180.231 180.231 178.759 1.472 25757 5417 1 7 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.803 0.150 25757 5418 1 7 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.739 0.293 25757 5419 1 7 . 1 1 73 73 ALA H H 73 8.240 8.240 8.093 0.147 25757 5420 1 7 . 1 1 74 74 ARG N N 74 116.098 116.098 118.017 -1.919 25757 5421 1 7 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.954 0.038 25757 5422 1 7 . 1 1 74 74 ARG C C 74 178.567 178.567 178.312 0.255 25757 5423 1 7 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.903 -0.078 25757 5424 1 7 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.430 0.645 25757 5425 1 7 . 1 1 74 74 ARG H H 74 7.420 7.420 7.397 0.023 25757 5426 1 7 . 1 1 75 75 LYS N N 75 119.046 119.046 119.385 -0.339 25757 5427 1 7 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.082 -0.039 25757 5428 1 7 . 1 1 75 75 LYS C C 75 179.045 179.045 178.434 0.611 25757 5429 1 7 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.207 -0.318 25757 5430 1 7 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.771 -0.005 25757 5431 1 7 . 1 1 75 75 LYS H H 75 7.862 7.862 7.871 -0.009 25757 5432 1 7 . 1 1 76 76 MET N N 76 116.772 116.772 119.226 -2.454 25757 5433 1 7 . 1 1 76 76 MET H H 76 8.099 8.099 8.226 -0.127 25757 5434 1 7 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.838 -0.204 25757 5435 1 7 . 1 1 78 78 ASP C C 78 176.395 176.395 175.648 0.747 25757 5436 1 7 . 1 1 78 78 ASP CA C 78 54.644 54.644 52.530 2.114 25757 5437 1 7 . 1 1 78 78 ASP CB C 78 41.474 41.474 43.425 -1.951 25757 5438 1 7 . 1 1 79 79 THR N N 79 113.904 113.904 114.321 -0.417 25757 5439 1 7 . 1 1 79 79 THR HA H 79 4.215 4.215 4.107 0.108 25757 5440 1 7 . 1 1 79 79 THR C C 79 174.204 174.204 174.384 -0.180 25757 5441 1 7 . 1 1 79 79 THR CA C 79 62.264 62.264 64.562 -2.298 25757 5442 1 7 . 1 1 79 79 THR CB C 79 69.884 69.884 68.963 0.921 25757 5443 1 7 . 1 1 79 79 THR H H 79 8.039 8.039 8.469 -0.430 25757 5444 1 7 . 1 1 80 80 ASP N N 80 123.572 123.572 117.624 5.948 25757 5445 1 7 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.313 0.407 25757 5446 1 7 . 1 1 80 80 ASP C C 80 176.221 176.221 175.633 0.588 25757 5447 1 7 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.850 -0.535 25757 5448 1 7 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.133 1.294 25757 5449 1 7 . 1 1 80 80 ASP H H 80 8.441 8.441 8.621 -0.180 25757 5450 1 7 . 1 1 81 81 SER N N 81 117.879 117.879 112.030 5.849 25757 5451 1 7 . 1 1 81 81 SER HA H 81 3.925 3.925 4.328 -0.403 25757 5452 1 7 . 1 1 81 81 SER C C 81 175.264 175.264 176.567 -1.303 25757 5453 1 7 . 1 1 81 81 SER CA C 81 58.860 58.860 59.361 -0.501 25757 5454 1 7 . 1 1 81 81 SER CB C 81 63.790 63.790 64.353 -0.563 25757 5455 1 7 . 1 1 81 81 SER H H 81 8.503 8.503 7.858 0.645 25757 5456 1 7 . 1 1 82 82 GLU N N 82 123.206 123.206 122.603 0.603 25757 5457 1 7 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.962 0.096 25757 5458 1 7 . 1 1 82 82 GLU C C 82 178.378 178.378 178.449 -0.071 25757 5459 1 7 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.989 -0.403 25757 5460 1 7 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.342 0.261 25757 5461 1 7 . 1 1 82 82 GLU H H 82 8.563 8.563 8.796 -0.233 25757 5462 1 7 . 1 1 83 83 GLU N N 83 119.262 119.262 119.081 0.181 25757 5463 1 7 . 1 1 83 83 GLU HA H 83 3.957 3.957 4.027 -0.070 25757 5464 1 7 . 1 1 83 83 GLU C C 83 178.606 178.606 178.975 -0.369 25757 5465 1 7 . 1 1 83 83 GLU CA C 83 59.669 59.669 60.180 -0.511 25757 5466 1 7 . 1 1 83 83 GLU CB C 83 29.355 29.355 28.947 0.408 25757 5467 1 7 . 1 1 83 83 GLU H H 83 7.728 7.728 8.793 -1.065 25757 5468 1 7 . 1 1 84 84 GLU N N 84 118.432 118.432 117.854 0.578 25757 5469 1 7 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.127 -0.020 25757 5470 1 7 . 1 1 84 84 GLU C C 84 179.436 179.436 179.498 -0.062 25757 5471 1 7 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.327 0.176 25757 5472 1 7 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.198 -0.091 25757 5473 1 7 . 1 1 84 84 GLU H H 84 8.346 8.346 8.492 -0.146 25757 5474 1 7 . 1 1 85 85 ILE N N 85 120.925 120.925 119.993 0.932 25757 5475 1 7 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.874 -0.126 25757 5476 1 7 . 1 1 85 85 ILE C C 85 177.661 177.661 178.084 -0.423 25757 5477 1 7 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.663 -0.173 25757 5478 1 7 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.813 -0.382 25757 5479 1 7 . 1 1 85 85 ILE H H 85 7.821 7.821 8.356 -0.535 25757 5480 1 7 . 1 1 86 86 ARG N N 86 121.916 121.916 118.890 3.026 25757 5481 1 7 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.878 0.258 25757 5482 1 7 . 1 1 86 86 ARG C C 86 179.208 179.208 178.391 0.817 25757 5483 1 7 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.338 1.033 25757 5484 1 7 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.282 0.817 25757 5485 1 7 . 1 1 86 86 ARG H H 86 8.432 8.432 8.420 0.012 25757 5486 1 7 . 1 1 87 87 GLU N N 87 118.261 118.261 119.811 -1.550 25757 5487 1 7 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.907 0.205 25757 5488 1 7 . 1 1 87 87 GLU C C 87 178.516 178.516 178.403 0.113 25757 5489 1 7 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.220 -0.195 25757 5490 1 7 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.602 -0.431 25757 5491 1 7 . 1 1 87 87 GLU H H 87 8.225 8.225 8.264 -0.039 25757 5492 1 7 . 1 1 88 88 ALA N N 88 121.009 121.009 122.494 -1.485 25757 5493 1 7 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.455 0.372 25757 5494 1 7 . 1 1 88 88 ALA C C 88 177.947 177.947 178.252 -0.305 25757 5495 1 7 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.922 -0.061 25757 5496 1 7 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.247 -0.292 25757 5497 1 7 . 1 1 88 88 ALA H H 88 7.789 7.789 7.936 -0.147 25757 5498 1 7 . 1 1 89 89 PHE N N 89 117.164 117.164 118.599 -1.435 25757 5499 1 7 . 1 1 89 89 PHE C C 89 176.134 176.134 177.321 -1.187 25757 5500 1 7 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.604 2.046 25757 5501 1 7 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.952 -0.059 25757 5502 1 7 . 1 1 89 89 PHE H H 89 8.337 8.337 7.452 0.885 25757 5503 1 7 . 1 1 90 90 ARG N N 90 114.900 114.900 117.687 -2.787 25757 5504 1 7 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.897 0.017 25757 5505 1 7 . 1 1 90 90 ARG C C 90 178.296 178.296 177.503 0.793 25757 5506 1 7 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.898 1.181 25757 5507 1 7 . 1 1 90 90 ARG CB C 90 30.093 30.093 29.941 0.152 25757 5508 1 7 . 1 1 90 90 ARG H H 90 7.681 7.681 7.750 -0.069 25757 5509 1 7 . 1 1 91 91 VAL N N 91 116.927 116.927 115.388 1.539 25757 5510 1 7 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.875 -0.268 25757 5511 1 7 . 1 1 91 91 VAL C C 91 177.964 177.964 177.337 0.627 25757 5512 1 7 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.775 1.185 25757 5513 1 7 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.032 0.587 25757 5514 1 7 . 1 1 91 91 VAL H H 91 7.405 7.405 7.526 -0.121 25757 5515 1 7 . 1 1 92 92 PHE N N 92 119.026 119.026 117.669 1.357 25757 5516 1 7 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.344 0.018 25757 5517 1 7 . 1 1 92 92 PHE C C 92 177.639 177.639 176.014 1.625 25757 5518 1 7 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.250 -0.529 25757 5519 1 7 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.828 -0.401 25757 5520 1 7 . 1 1 92 92 PHE H H 92 7.886 7.886 7.385 0.501 25757 5521 1 7 . 1 1 93 93 ASP N N 93 118.238 118.238 118.826 -0.588 25757 5522 1 7 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.793 -0.331 25757 5523 1 7 . 1 1 93 93 ASP C C 93 176.979 176.979 176.749 0.230 25757 5524 1 7 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.118 -0.970 25757 5525 1 7 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.797 -1.648 25757 5526 1 7 . 1 1 93 93 ASP H H 93 8.009 8.009 7.389 0.620 25757 5527 1 7 . 1 1 94 94 LYS N N 94 125.792 125.792 125.203 0.589 25757 5528 1 7 . 1 1 94 94 LYS C C 94 178.213 178.213 177.926 0.287 25757 5529 1 7 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.928 0.390 25757 5530 1 7 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.420 -1.392 25757 5531 1 7 . 1 1 94 94 LYS H H 94 7.428 7.428 8.164 -0.736 25757 5532 1 7 . 1 1 95 95 ASP N N 95 113.833 113.833 116.132 -2.299 25757 5533 1 7 . 1 1 95 95 ASP C C 95 177.718 177.718 177.441 0.277 25757 5534 1 7 . 1 1 95 95 ASP CA C 95 52.945 52.945 53.964 -1.019 25757 5535 1 7 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.354 -0.611 25757 5536 1 7 . 1 1 95 95 ASP H H 95 8.159 8.159 8.107 0.052 25757 5537 1 7 . 1 1 96 96 GLY N N 96 109.414 109.414 108.182 1.232 25757 5538 1 7 . 1 1 96 96 GLY C C 96 175.093 175.093 175.080 0.013 25757 5539 1 7 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.807 1.447 25757 5540 1 7 . 1 1 96 96 GLY H H 96 7.848 7.848 8.183 -0.335 25757 5541 1 7 . 1 1 97 97 ASN N N 97 119.590 119.590 118.079 1.511 25757 5542 1 7 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.535 0.077 25757 5543 1 7 . 1 1 97 97 ASN C C 97 175.937 175.937 176.726 -0.789 25757 5544 1 7 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.429 -0.541 25757 5545 1 7 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.416 -1.096 25757 5546 1 7 . 1 1 97 97 ASN H H 97 8.338 8.338 8.141 0.197 25757 5547 1 7 . 1 1 98 98 GLY N N 98 112.940 112.940 107.685 5.255 25757 5548 1 7 . 1 1 98 98 GLY C C 98 172.429 172.429 172.684 -0.255 25757 5549 1 7 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.084 0.008 25757 5550 1 7 . 1 1 98 98 GLY H H 98 10.695 10.695 9.140 1.555 25757 5551 1 7 . 1 1 99 99 TYR N N 99 115.544 115.544 118.457 -2.913 25757 5552 1 7 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.191 -0.104 25757 5553 1 7 . 1 1 99 99 TYR C C 99 174.859 174.859 174.735 0.124 25757 5554 1 7 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.378 -1.360 25757 5555 1 7 . 1 1 99 99 TYR CB C 99 43.353 43.353 41.828 1.525 25757 5556 1 7 . 1 1 99 99 TYR H H 99 7.597 7.597 8.475 -0.878 25757 5557 1 7 . 1 1 100 100 ILE N N 100 127.078 127.078 124.873 2.205 25757 5558 1 7 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.794 -0.005 25757 5559 1 7 . 1 1 100 100 ILE C C 100 175.387 175.387 175.925 -0.538 25757 5560 1 7 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.860 0.146 25757 5561 1 7 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.840 -1.050 25757 5562 1 7 . 1 1 100 100 ILE H H 100 10.267 10.267 9.345 0.922 25757 5563 1 7 . 1 1 101 101 SER N N 101 124.102 124.102 122.423 1.679 25757 5564 1 7 . 1 1 101 101 SER HA H 101 4.417 4.417 5.495 -1.078 25757 5565 1 7 . 1 1 101 101 SER C C 101 175.360 175.360 175.434 -0.074 25757 5566 1 7 . 1 1 101 101 SER CA C 101 56.036 56.036 55.534 0.502 25757 5567 1 7 . 1 1 101 101 SER CB C 101 66.896 66.896 65.633 1.263 25757 5568 1 7 . 1 1 101 101 SER H H 101 8.985 8.985 8.925 0.060 25757 5569 1 7 . 1 1 102 102 ALA N N 102 122.780 122.780 125.318 -2.538 25757 5570 1 7 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.983 -0.239 25757 5571 1 7 . 1 1 102 102 ALA C C 102 179.175 179.175 178.662 0.513 25757 5572 1 7 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.117 1.173 25757 5573 1 7 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.550 -0.523 25757 5574 1 7 . 1 1 102 102 ALA H H 102 9.269 9.269 9.149 0.120 25757 5575 1 7 . 1 1 103 103 ALA N N 103 118.513 118.513 121.240 -2.727 25757 5576 1 7 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.879 0.132 25757 5577 1 7 . 1 1 103 103 ALA C C 103 181.521 181.521 178.901 2.620 25757 5578 1 7 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.278 0.076 25757 5579 1 7 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.127 0.164 25757 5580 1 7 . 1 1 103 103 ALA H H 103 8.321 8.321 7.854 0.467 25757 5581 1 7 . 1 1 104 104 GLU N N 104 119.550 119.550 119.575 -0.025 25757 5582 1 7 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.114 -0.108 25757 5583 1 7 . 1 1 104 104 GLU C C 104 179.750 179.750 179.440 0.310 25757 5584 1 7 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.578 -0.409 25757 5585 1 7 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.301 -0.086 25757 5586 1 7 . 1 1 104 104 GLU H H 104 7.867 7.867 8.412 -0.545 25757 5587 1 7 . 1 1 105 105 LEU N N 105 122.688 122.688 119.902 2.786 25757 5588 1 7 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.787 0.131 25757 5589 1 7 . 1 1 105 105 LEU C C 105 178.233 178.233 178.538 -0.305 25757 5590 1 7 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.172 -0.438 25757 5591 1 7 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.700 0.320 25757 5592 1 7 . 1 1 105 105 LEU H H 105 8.746 8.746 7.801 0.945 25757 5593 1 7 . 1 1 106 106 ARG N N 106 118.835 118.835 118.421 0.414 25757 5594 1 7 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.748 -0.098 25757 5595 1 7 . 1 1 106 106 ARG C C 106 178.742 178.742 178.819 -0.077 25757 5596 1 7 . 1 1 106 106 ARG CA C 106 59.963 59.963 60.232 -0.269 25757 5597 1 7 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.943 0.103 25757 5598 1 7 . 1 1 106 106 ARG H H 106 8.684 8.684 8.071 0.613 25757 5599 1 7 . 1 1 107 107 HIS N N 107 119.258 119.258 118.465 0.793 25757 5600 1 7 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.253 0.014 25757 5601 1 7 . 1 1 107 107 HIS C C 107 177.244 177.244 178.190 -0.946 25757 5602 1 7 . 1 1 107 107 HIS CA C 107 60.152 60.152 59.204 0.948 25757 5603 1 7 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.600 0.975 25757 5604 1 7 . 1 1 107 107 HIS H H 107 7.691 7.691 8.058 -0.367 25757 5605 1 7 . 1 1 108 108 VAL N N 108 118.996 118.996 121.363 -2.367 25757 5606 1 7 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.756 -0.318 25757 5607 1 7 . 1 1 108 108 VAL C C 108 177.998 177.998 177.906 0.092 25757 5608 1 7 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.805 -0.374 25757 5609 1 7 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.648 -0.224 25757 5610 1 7 . 1 1 108 108 VAL H H 108 7.599 7.599 8.179 -0.580 25757 5611 1 7 . 1 1 109 109 MET N N 109 114.880 114.880 117.360 -2.480 25757 5612 1 7 . 1 1 109 109 MET C C 109 179.119 179.119 178.256 0.863 25757 5613 1 7 . 1 1 109 109 MET CA C 109 56.979 56.979 58.968 -1.989 25757 5614 1 7 . 1 1 109 109 MET CB C 109 29.253 29.253 32.776 -3.523 25757 5615 1 7 . 1 1 109 109 MET H H 109 7.911 7.911 8.159 -0.248 25757 5616 1 7 . 1 1 110 110 THR N N 110 116.943 116.943 115.175 1.768 25757 5617 1 7 . 1 1 110 110 THR HA H 110 4.229 4.229 4.141 0.088 25757 5618 1 7 . 1 1 110 110 THR C C 110 178.506 178.506 177.074 1.432 25757 5619 1 7 . 1 1 110 110 THR CA C 110 66.573 66.573 65.905 0.668 25757 5620 1 7 . 1 1 110 110 THR CB C 110 68.575 68.575 68.364 0.211 25757 5621 1 7 . 1 1 110 110 THR H H 110 8.353 8.353 8.417 -0.064 25757 5622 1 7 . 1 1 111 111 ASN N N 111 123.829 123.829 120.677 3.152 25757 5623 1 7 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.514 -0.152 25757 5624 1 7 . 1 1 111 111 ASN C C 111 177.197 177.197 176.777 0.420 25757 5625 1 7 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.633 0.326 25757 5626 1 7 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.161 -0.938 25757 5627 1 7 . 1 1 111 111 ASN H H 111 8.053 8.053 8.209 -0.156 25757 5628 1 7 . 1 1 112 112 LEU N N 112 119.036 119.036 116.128 2.908 25757 5629 1 7 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.117 0.053 25757 5630 1 7 . 1 1 112 112 LEU C C 112 176.377 176.377 177.122 -0.745 25757 5631 1 7 . 1 1 112 112 LEU CA C 112 55.505 55.505 55.725 -0.220 25757 5632 1 7 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.783 -0.423 25757 5633 1 7 . 1 1 112 112 LEU H H 112 7.794 7.794 7.338 0.456 25757 5634 1 7 . 1 1 113 113 GLY N N 113 106.045 106.045 104.685 1.360 25757 5635 1 7 . 1 1 113 113 GLY C C 113 174.248 174.248 174.160 0.088 25757 5636 1 7 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.608 0.699 25757 5637 1 7 . 1 1 113 113 GLY H H 113 7.741 7.741 7.671 0.070 25757 5638 1 7 . 1 1 114 114 GLU N N 114 120.556 120.556 120.612 -0.056 25757 5639 1 7 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.455 -0.145 25757 5640 1 7 . 1 1 114 114 GLU C C 114 174.993 174.993 175.516 -0.523 25757 5641 1 7 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.587 0.050 25757 5642 1 7 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.535 0.682 25757 5643 1 7 . 1 1 114 114 GLU H H 114 7.980 7.980 7.871 0.109 25757 5644 1 7 . 1 1 115 115 LYS N N 115 124.986 124.986 126.143 -1.157 25757 5645 1 7 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.154 0.180 25757 5646 1 7 . 1 1 115 115 LYS C C 115 175.285 175.285 176.187 -0.902 25757 5647 1 7 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.818 -1.237 25757 5648 1 7 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.287 -0.314 25757 5649 1 7 . 1 1 115 115 LYS H H 115 8.613 8.613 8.449 0.164 25757 5650 1 7 . 1 1 116 116 LEU N N 116 125.243 125.243 122.172 3.071 25757 5651 1 7 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.672 0.016 25757 5652 1 7 . 1 1 116 116 LEU C C 116 178.365 178.365 175.587 2.778 25757 5653 1 7 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.155 1.193 25757 5654 1 7 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.043 0.246 25757 5655 1 7 . 1 1 116 116 LEU H H 116 8.066 8.066 8.234 -0.168 25757 5656 1 7 . 1 1 117 117 THR N N 117 114.324 114.324 113.029 1.295 25757 5657 1 7 . 1 1 117 117 THR HA H 117 4.713 4.713 4.517 0.196 25757 5658 1 7 . 1 1 117 117 THR C C 117 175.539 175.539 174.834 0.705 25757 5659 1 7 . 1 1 117 117 THR CA C 117 60.756 60.756 60.702 0.054 25757 5660 1 7 . 1 1 117 117 THR CB C 117 71.144 71.144 70.970 0.174 25757 5661 1 7 . 1 1 117 117 THR H H 117 9.228 9.228 7.917 1.311 25757 5662 1 7 . 1 1 118 118 ASP N N 118 121.016 121.016 123.190 -2.174 25757 5663 1 7 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.219 -0.064 25757 5664 1 7 . 1 1 118 118 ASP H H 118 8.919 8.919 8.932 -0.013 25757 5665 1 7 . 1 1 119 119 GLU N N 119 121.016 121.016 118.437 2.579 25757 5666 1 7 . 1 1 119 119 GLU C C 119 179.204 179.204 178.743 0.461 25757 5667 1 7 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.528 -1.458 25757 5668 1 7 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.464 -0.420 25757 5669 1 7 . 1 1 119 119 GLU H H 119 8.919 8.919 8.595 0.324 25757 5670 1 7 . 1 1 120 120 GLU N N 120 120.566 120.566 119.471 1.095 25757 5671 1 7 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.990 0.011 25757 5672 1 7 . 1 1 120 120 GLU C C 120 180.329 180.329 179.147 1.182 25757 5673 1 7 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.248 -0.157 25757 5674 1 7 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.004 1.634 25757 5675 1 7 . 1 1 120 120 GLU H H 120 7.732 7.732 7.476 0.256 25757 5676 1 7 . 1 1 121 121 VAL N N 121 121.875 121.875 119.218 2.657 25757 5677 1 7 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.485 -0.020 25757 5678 1 7 . 1 1 121 121 VAL C C 121 177.477 177.477 177.776 -0.299 25757 5679 1 7 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.519 0.652 25757 5680 1 7 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.447 -0.013 25757 5681 1 7 . 1 1 121 121 VAL H H 121 8.104 8.104 7.367 0.737 25757 5682 1 7 . 1 1 122 122 ASP N N 122 120.566 120.566 119.666 0.900 25757 5683 1 7 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.203 0.132 25757 5684 1 7 . 1 1 122 122 ASP C C 122 179.298 179.298 177.974 1.324 25757 5685 1 7 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.760 0.079 25757 5686 1 7 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.740 -0.428 25757 5687 1 7 . 1 1 122 122 ASP H H 122 8.089 8.089 8.166 -0.077 25757 5688 1 7 . 1 1 123 123 GLU N N 123 119.821 119.821 119.562 0.259 25757 5689 1 7 . 1 1 123 123 GLU HA H 123 4.049 4.049 3.931 0.118 25757 5690 1 7 . 1 1 123 123 GLU C C 123 178.749 178.749 178.954 -0.205 25757 5691 1 7 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.099 0.219 25757 5692 1 7 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.660 -0.274 25757 5693 1 7 . 1 1 123 123 GLU H H 123 8.105 8.105 8.185 -0.080 25757 5694 1 7 . 1 1 124 124 MET N N 124 119.288 119.288 119.713 -0.425 25757 5695 1 7 . 1 1 124 124 MET C C 124 180.865 180.865 178.751 2.114 25757 5696 1 7 . 1 1 124 124 MET CA C 124 60.684 60.684 59.488 1.196 25757 5697 1 7 . 1 1 124 124 MET CB C 124 33.141 33.141 32.555 0.586 25757 5698 1 7 . 1 1 124 124 MET H H 124 7.726 7.726 7.962 -0.236 25757 5699 1 7 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.996 -0.267 25757 5700 1 7 . 1 1 125 125 ILE C C 125 177.341 177.341 178.192 -0.851 25757 5701 1 7 . 1 1 125 125 ILE CA C 125 63.801 63.801 64.406 -0.605 25757 5702 1 7 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.775 -1.210 25757 5703 1 7 . 1 1 126 126 ARG N N 126 118.555 118.555 120.196 -1.641 25757 5704 1 7 . 1 1 126 126 ARG C C 126 179.164 179.164 177.844 1.320 25757 5705 1 7 . 1 1 126 126 ARG CA C 126 59.924 59.924 58.555 1.369 25757 5706 1 7 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.779 0.086 25757 5707 1 7 . 1 1 126 126 ARG H H 126 8.380 8.380 8.228 0.152 25757 5708 1 7 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.356 -0.431 25757 5709 1 7 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.588 1.469 25757 5710 1 7 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.263 0.565 25757 5711 1 7 . 1 1 128 128 ALA N N 128 116.764 116.764 120.585 -3.821 25757 5712 1 7 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.182 0.235 25757 5713 1 7 . 1 1 128 128 ALA C C 128 177.885 177.885 177.098 0.787 25757 5714 1 7 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.810 -0.855 25757 5715 1 7 . 1 1 128 128 ALA CB C 128 22.567 22.567 20.046 2.521 25757 5716 1 7 . 1 1 128 128 ALA H H 128 7.152 7.152 7.842 -0.690 25757 5717 1 7 . 1 1 129 129 ASP N N 129 117.762 117.762 118.616 -0.854 25757 5718 1 7 . 1 1 129 129 ASP HA H 129 4.477 4.477 4.980 -0.503 25757 5719 1 7 . 1 1 129 129 ASP C C 129 175.935 175.935 177.832 -1.897 25757 5720 1 7 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.085 2.430 25757 5721 1 7 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.945 -1.200 25757 5722 1 7 . 1 1 129 129 ASP H H 129 8.007 8.007 8.271 -0.264 25757 5723 1 7 . 1 1 130 130 ILE N N 130 128.249 128.249 122.880 5.369 25757 5724 1 7 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.953 -0.089 25757 5725 1 7 . 1 1 130 130 ILE C C 130 177.764 177.764 175.999 1.765 25757 5726 1 7 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.443 0.105 25757 5727 1 7 . 1 1 130 130 ILE CB C 130 38.648 38.648 36.980 1.667 25757 5728 1 7 . 1 1 130 130 ILE H H 130 8.412 8.412 8.773 -0.361 25757 5729 1 7 . 1 1 131 131 ASP N N 131 116.430 116.430 118.862 -2.432 25757 5730 1 7 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.692 -0.158 25757 5731 1 7 . 1 1 131 131 ASP C C 131 178.313 178.313 177.233 1.080 25757 5732 1 7 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.802 -0.918 25757 5733 1 7 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.420 -1.458 25757 5734 1 7 . 1 1 131 131 ASP H H 131 8.254 8.254 8.727 -0.473 25757 5735 1 7 . 1 1 132 132 GLY N N 132 108.460 108.460 109.412 -0.952 25757 5736 1 7 . 1 1 132 132 GLY C C 132 175.211 175.211 174.672 0.539 25757 5737 1 7 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.116 1.487 25757 5738 1 7 . 1 1 132 132 GLY H H 132 7.547 7.547 8.233 -0.686 25757 5739 1 7 . 1 1 133 133 ASP N N 133 120.909 120.909 118.559 2.350 25757 5740 1 7 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.574 -0.111 25757 5741 1 7 . 1 1 133 133 ASP C C 133 177.691 177.691 177.451 0.240 25757 5742 1 7 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.629 0.185 25757 5743 1 7 . 1 1 133 133 ASP CB C 133 40.298 40.298 41.435 -1.137 25757 5744 1 7 . 1 1 133 133 ASP H H 133 8.339 8.339 8.463 -0.124 25757 5745 1 7 . 1 1 134 134 GLY N N 134 112.704 112.704 107.559 5.145 25757 5746 1 7 . 1 1 134 134 GLY C C 134 172.722 172.722 173.482 -0.760 25757 5747 1 7 . 1 1 134 134 GLY CA C 134 46.037 46.037 44.895 1.142 25757 5748 1 7 . 1 1 134 134 GLY H H 134 10.396 10.396 7.948 2.448 25757 5749 1 7 . 1 1 135 135 GLN N N 135 114.799 114.799 119.803 -5.004 25757 5750 1 7 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.195 -0.331 25757 5751 1 7 . 1 1 135 135 GLN C C 135 174.760 174.760 174.985 -0.225 25757 5752 1 7 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.514 -1.194 25757 5753 1 7 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.582 -0.517 25757 5754 1 7 . 1 1 135 135 GLN H H 135 7.975 7.975 8.683 -0.708 25757 5755 1 7 . 1 1 136 136 VAL N N 136 125.364 125.364 126.110 -0.746 25757 5756 1 7 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.472 0.736 25757 5757 1 7 . 1 1 136 136 VAL C C 136 175.831 175.831 175.357 0.474 25757 5758 1 7 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.063 0.754 25757 5759 1 7 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.377 1.297 25757 5760 1 7 . 1 1 136 136 VAL H H 136 9.169 9.169 9.040 0.129 25757 5761 1 7 . 1 1 137 137 ASN N N 137 129.155 129.155 126.994 2.161 25757 5762 1 7 . 1 1 137 137 ASN C C 137 174.737 174.737 175.757 -1.020 25757 5763 1 7 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.850 0.501 25757 5764 1 7 . 1 1 137 137 ASN CB C 137 38.323 38.323 40.393 -2.070 25757 5765 1 7 . 1 1 137 137 ASN H H 137 9.652 9.652 8.308 1.344 25757 5766 1 7 . 1 1 138 138 TYR N N 138 118.504 118.504 121.669 -3.165 25757 5767 1 7 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.655 -0.376 25757 5768 1 7 . 1 1 138 138 TYR C C 138 176.174 176.174 177.373 -1.199 25757 5769 1 7 . 1 1 138 138 TYR CA C 138 62.574 62.574 60.883 1.691 25757 5770 1 7 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.124 -0.394 25757 5771 1 7 . 1 1 138 138 TYR H H 138 8.460 8.460 8.502 -0.042 25757 5772 1 7 . 1 1 139 139 GLU N N 139 118.644 118.644 118.168 0.476 25757 5773 1 7 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.742 -0.194 25757 5774 1 7 . 1 1 139 139 GLU C C 139 180.265 180.265 178.420 1.845 25757 5775 1 7 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.789 0.697 25757 5776 1 7 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.177 -0.186 25757 5777 1 7 . 1 1 139 139 GLU H H 139 8.136 8.136 8.457 -0.321 25757 5778 1 7 . 1 1 140 140 GLU N N 140 120.030 120.030 115.073 4.957 25757 5779 1 7 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.066 -0.178 25757 5780 1 7 . 1 1 140 140 GLU C C 140 179.627 179.627 177.233 2.394 25757 5781 1 7 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.731 0.946 25757 5782 1 7 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.599 0.128 25757 5783 1 7 . 1 1 140 140 GLU H H 140 8.798 8.798 8.177 0.621 25757 5784 1 7 . 1 1 141 141 PHE N N 141 123.154 123.154 120.447 2.707 25757 5785 1 7 . 1 1 141 141 PHE HA H 141 3.697 3.697 4.065 -0.368 25757 5786 1 7 . 1 1 141 141 PHE C C 141 176.952 176.952 177.647 -0.695 25757 5787 1 7 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.164 1.888 25757 5788 1 7 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.965 0.166 25757 5789 1 7 . 1 1 141 141 PHE H H 141 8.633 8.633 7.611 1.022 25757 5790 1 7 . 1 1 142 142 VAL N N 142 120.046 120.046 117.803 2.243 25757 5791 1 7 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.666 -0.710 25757 5792 1 7 . 1 1 142 142 VAL C C 142 179.627 179.627 177.281 2.346 25757 5793 1 7 . 1 1 142 142 VAL CA C 142 67.243 67.243 64.567 2.676 25757 5794 1 7 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.371 0.769 25757 5795 1 7 . 1 1 142 142 VAL H H 142 8.894 8.894 8.254 0.640 25757 5796 1 7 . 1 1 143 143 GLN N N 143 118.996 118.996 120.391 -1.395 25757 5797 1 7 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.981 -0.205 25757 5798 1 7 . 1 1 143 143 GLN C C 143 178.443 178.443 177.870 0.573 25757 5799 1 7 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.414 0.715 25757 5800 1 7 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.055 -0.312 25757 5801 1 7 . 1 1 143 143 GLN H H 143 7.627 7.627 7.679 -0.052 25757 5802 1 7 . 1 1 144 144 MET N N 144 116.361 116.361 118.191 -1.830 25757 5803 1 7 . 1 1 144 144 MET HA H 144 4.169 4.169 4.056 0.113 25757 5804 1 7 . 1 1 144 144 MET C C 144 178.418 178.418 176.932 1.486 25757 5805 1 7 . 1 1 144 144 MET CA C 144 56.137 56.137 57.847 -1.710 25757 5806 1 7 . 1 1 144 144 MET CB C 144 31.095 31.095 32.419 -1.324 25757 5807 1 7 . 1 1 144 144 MET H H 144 7.179 7.179 7.274 -0.095 25757 5808 1 7 . 1 1 145 145 MET N N 145 115.373 115.373 116.925 -1.552 25757 5809 1 7 . 1 1 145 145 MET HA H 145 4.334 4.334 4.540 -0.206 25757 5810 1 7 . 1 1 145 145 MET C C 145 177.217 177.217 175.643 1.574 25757 5811 1 7 . 1 1 145 145 MET CA C 145 55.296 55.296 55.257 0.039 25757 5812 1 7 . 1 1 145 145 MET CB C 145 34.458 34.458 34.059 0.398 25757 5813 1 7 . 1 1 145 145 MET H H 145 7.776 7.776 7.715 0.061 25757 5814 1 7 . 1 1 146 146 THR N N 146 107.988 107.988 112.793 -4.805 25757 5815 1 7 . 1 1 146 146 THR HA H 146 4.239 4.239 4.434 -0.195 25757 5816 1 7 . 1 1 146 146 THR C C 146 175.378 175.378 174.853 0.525 25757 5817 1 7 . 1 1 146 146 THR CA C 146 61.625 61.625 61.654 -0.029 25757 5818 1 7 . 1 1 146 146 THR CB C 146 70.817 70.817 68.400 2.417 25757 5819 1 7 . 1 1 146 146 THR H H 146 7.736 7.736 7.724 0.012 25757 5820 1 7 . 1 1 147 147 GLY N N 147 110.157 110.157 110.236 -0.079 25757 5821 1 7 . 1 1 147 147 GLY C C 147 174.046 174.046 174.109 -0.063 25757 5822 1 7 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.757 0.787 25757 5823 1 7 . 1 1 147 147 GLY H H 147 7.793 7.793 8.164 -0.371 25757 5824 1 7 . 1 1 150 150 THR HA H 150 4.239 4.239 4.399 -0.160 25757 5825 1 7 . 1 1 150 150 THR C C 150 174.397 174.397 173.487 0.910 25757 5826 1 7 . 1 1 150 150 THR CA C 150 61.260 61.260 61.264 -0.004 25757 5827 1 7 . 1 1 150 150 THR CB C 150 70.358 70.358 68.879 1.479 25757 5828 1 7 . 1 1 151 151 ALA N N 151 126.304 126.304 123.369 2.935 25757 5829 1 7 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.901 -0.613 25757 5830 1 7 . 1 1 151 151 ALA C C 151 177.678 177.678 176.349 1.329 25757 5831 1 7 . 1 1 151 151 ALA CA C 151 52.148 52.148 50.271 1.877 25757 5832 1 7 . 1 1 151 151 ALA CB C 151 19.419 19.419 21.299 -1.881 25757 5833 1 7 . 1 1 151 151 ALA H H 151 8.618 8.618 7.485 1.133 25757 5834 1 7 . 1 1 152 152 ALA N N 152 123.861 123.861 121.477 2.384 25757 5835 1 7 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.386 -0.268 25757 5836 1 7 . 1 1 152 152 ALA C C 152 178.823 178.823 178.305 0.518 25757 5837 1 7 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.561 1.933 25757 5838 1 7 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.319 0.438 25757 5839 1 7 . 1 1 152 152 ALA H H 152 8.354 8.354 8.743 -0.389 25757 5840 1 7 . 1 1 153 153 GLY N N 153 109.984 109.984 107.529 2.455 25757 5841 1 7 . 1 1 153 153 GLY C C 153 174.389 174.389 175.657 -1.268 25757 5842 1 7 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.120 -1.989 25757 5843 1 7 . 1 1 153 153 GLY H H 153 9.028 9.028 8.457 0.571 25757 5844 1 7 . 1 1 154 154 SER N N 154 113.934 113.934 118.304 -4.370 25757 5845 1 7 . 1 1 154 154 SER HA H 154 4.255 4.255 3.988 0.267 25757 5846 1 7 . 1 1 154 154 SER C C 154 177.929 177.929 176.879 1.050 25757 5847 1 7 . 1 1 154 154 SER CA C 154 59.379 59.379 61.504 -2.125 25757 5848 1 7 . 1 1 154 154 SER CB C 154 64.090 64.090 62.756 1.334 25757 5849 1 7 . 1 1 154 154 SER H H 154 7.962 7.962 8.174 -0.212 25757 5850 1 7 . 1 1 155 155 GLY N N 155 115.337 115.337 109.149 6.188 25757 5851 1 7 . 1 1 155 155 GLY C C 155 175.891 175.891 175.466 0.425 25757 5852 1 7 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.736 0.910 25757 5853 1 7 . 1 1 155 155 GLY H H 155 9.451 9.451 7.746 1.705 25757 5854 1 7 . 1 1 156 156 TRP N N 156 119.600 119.600 121.804 -2.204 25757 5855 1 7 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.352 -0.081 25757 5856 1 7 . 1 1 156 156 TRP C C 156 178.947 178.947 179.003 -0.056 25757 5857 1 7 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.477 -0.313 25757 5858 1 7 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.079 0.524 25757 5859 1 7 . 1 1 156 156 TRP H H 156 8.542 8.542 7.371 1.171 25757 5860 1 7 . 1 1 157 157 ARG N N 157 118.583 118.583 118.810 -0.227 25757 5861 1 7 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.149 -0.167 25757 5862 1 7 . 1 1 157 157 ARG C C 157 177.894 177.894 178.708 -0.814 25757 5863 1 7 . 1 1 157 157 ARG CA C 157 59.338 59.338 58.705 0.633 25757 5864 1 7 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.559 0.498 25757 5865 1 7 . 1 1 157 157 ARG H H 157 7.747 7.747 8.505 -0.758 25757 5866 1 7 . 1 1 158 158 LYS N N 158 117.033 117.033 120.765 -3.732 25757 5867 1 7 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.111 -0.168 25757 5868 1 7 . 1 1 158 158 LYS C C 158 176.973 176.973 178.791 -1.818 25757 5869 1 7 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.087 0.286 25757 5870 1 7 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.364 -0.073 25757 5871 1 7 . 1 1 158 158 LYS H H 158 7.529 7.529 7.948 -0.419 25757 5872 1 7 . 1 1 159 159 ILE N N 159 116.553 116.553 120.177 -3.624 25757 5873 1 7 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.769 -0.225 25757 5874 1 7 . 1 1 159 159 ILE C C 159 176.894 176.894 177.059 -0.165 25757 5875 1 7 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.249 0.267 25757 5876 1 7 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.069 -0.265 25757 5877 1 7 . 1 1 159 159 ILE H H 159 7.348 7.348 8.209 -0.861 25757 5878 1 7 . 1 1 160 160 LYS N N 160 119.278 119.278 119.769 -0.491 25757 5879 1 7 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.413 -0.374 25757 5880 1 7 . 1 1 160 160 LYS C C 160 178.566 178.566 179.176 -0.610 25757 5881 1 7 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.768 0.606 25757 5882 1 7 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.246 0.572 25757 5883 1 7 . 1 1 160 160 LYS H H 160 8.225 8.225 8.322 -0.097 25757 5884 1 7 . 1 1 161 161 LEU N N 161 117.056 117.056 121.168 -4.112 25757 5885 1 7 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.222 -0.162 25757 5886 1 7 . 1 1 161 161 LEU C C 161 178.977 178.977 178.952 0.025 25757 5887 1 7 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.849 0.175 25757 5888 1 7 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.880 0.101 25757 5889 1 7 . 1 1 161 161 LEU H H 161 8.057 8.057 8.084 -0.027 25757 5890 1 7 . 1 1 162 162 ALA N N 162 121.814 121.814 122.276 -0.462 25757 5891 1 7 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.421 -0.329 25757 5892 1 7 . 1 1 162 162 ALA C C 162 178.374 178.374 179.791 -1.417 25757 5893 1 7 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.279 0.512 25757 5894 1 7 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.873 -0.548 25757 5895 1 7 . 1 1 162 162 ALA H H 162 8.170 8.170 8.312 -0.142 25757 5896 1 7 . 1 1 163 163 VAL N N 163 115.449 115.449 115.688 -0.239 25757 5897 1 7 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.815 -0.197 25757 5898 1 7 . 1 1 163 163 VAL C C 163 178.362 178.362 177.596 0.766 25757 5899 1 7 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.837 0.435 25757 5900 1 7 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.439 0.598 25757 5901 1 7 . 1 1 163 163 VAL H H 163 8.499 8.499 8.212 0.287 25757 5902 1 7 . 1 1 164 164 ARG N N 164 115.775 115.775 121.670 -5.895 25757 5903 1 7 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.403 -0.206 25757 5904 1 7 . 1 1 164 164 ARG C C 164 178.938 178.938 179.425 -0.487 25757 5905 1 7 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.092 -1.409 25757 5906 1 7 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.516 -0.682 25757 5907 1 7 . 1 1 164 164 ARG H H 164 8.165 8.165 8.394 -0.229 25757 5908 1 7 . 1 1 165 165 GLY N N 165 105.570 105.570 107.174 -1.604 25757 5909 1 7 . 1 1 165 165 GLY C C 165 173.134 173.134 175.161 -2.027 25757 5910 1 7 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.370 0.372 25757 5911 1 7 . 1 1 165 165 GLY H H 165 8.455 8.455 8.200 0.255 25757 5912 1 7 . 1 1 166 166 ALA N N 166 120.648 120.648 123.208 -2.560 25757 5913 1 7 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.405 -0.063 25757 5914 1 7 . 1 1 166 166 ALA C C 166 176.155 176.155 177.609 -1.454 25757 5915 1 7 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.918 -2.145 25757 5916 1 7 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.257 0.221 25757 5917 1 7 . 1 1 166 166 ALA H H 166 7.826 7.826 7.995 -0.169 25757 5918 1 7 . 1 1 167 167 GLN N N 167 117.315 117.315 117.524 -0.209 25757 5919 1 7 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.456 -0.179 25757 5920 1 7 . 1 1 167 167 GLN C C 167 175.571 175.571 175.173 0.398 25757 5921 1 7 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.964 0.963 25757 5922 1 7 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.814 0.371 25757 5923 1 7 . 1 1 167 167 GLN H H 167 7.498 7.498 7.586 -0.088 25757 5924 1 7 . 1 1 168 168 ALA N N 168 126.706 126.706 128.412 -1.706 25757 5925 1 7 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.061 0.218 25757 5926 1 7 . 1 1 168 168 ALA C C 168 177.227 177.227 177.594 -0.367 25757 5927 1 7 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.400 -2.334 25757 5928 1 7 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.331 0.375 25757 5929 1 7 . 1 1 168 168 ALA H H 168 8.534 8.534 8.777 -0.243 25757 5930 1 8 . 1 1 9 9 ILE N N 9 116.733 116.733 121.824 -5.091 25757 5931 1 8 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.057 -0.300 25757 5932 1 8 . 1 1 9 9 ILE C C 9 177.828 177.828 177.539 0.289 25757 5933 1 8 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.217 3.387 25757 5934 1 8 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.341 0.257 25757 5935 1 8 . 1 1 9 9 ILE H H 9 7.366 7.366 8.150 -0.784 25757 5936 1 8 . 1 1 10 10 ALA N N 10 121.080 121.080 123.007 -1.927 25757 5937 1 8 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.035 0.040 25757 5938 1 8 . 1 1 10 10 ALA C C 10 180.921 180.921 179.615 1.306 25757 5939 1 8 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.309 0.294 25757 5940 1 8 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.847 0.137 25757 5941 1 8 . 1 1 10 10 ALA H H 10 8.039 8.039 8.306 -0.267 25757 5942 1 8 . 1 1 11 11 GLU N N 11 119.580 119.580 118.714 0.866 25757 5943 1 8 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.972 0.117 25757 5944 1 8 . 1 1 11 11 GLU C C 11 179.561 179.561 179.021 0.540 25757 5945 1 8 . 1 1 11 11 GLU CA C 11 59.885 59.885 58.988 0.897 25757 5946 1 8 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.660 0.803 25757 5947 1 8 . 1 1 11 11 GLU H H 11 7.741 7.741 8.004 -0.263 25757 5948 1 8 . 1 1 12 12 PHE N N 12 118.509 118.509 118.031 0.478 25757 5949 1 8 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.453 0.373 25757 5950 1 8 . 1 1 12 12 PHE C C 12 179.000 179.000 178.513 0.487 25757 5951 1 8 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.826 0.338 25757 5952 1 8 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.798 0.312 25757 5953 1 8 . 1 1 12 12 PHE H H 12 8.470 8.470 7.334 1.136 25757 5954 1 8 . 1 1 13 13 LYS N N 13 123.523 123.523 120.150 3.373 25757 5955 1 8 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.104 -0.078 25757 5956 1 8 . 1 1 13 13 LYS C C 13 179.260 179.260 178.872 0.388 25757 5957 1 8 . 1 1 13 13 LYS CA C 13 60.164 60.164 60.111 0.053 25757 5958 1 8 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.231 -0.398 25757 5959 1 8 . 1 1 13 13 LYS H H 13 9.171 9.171 8.719 0.452 25757 5960 1 8 . 1 1 14 14 GLU N N 14 120.415 120.415 119.001 1.414 25757 5961 1 8 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.175 -0.080 25757 5962 1 8 . 1 1 14 14 GLU C C 14 179.851 179.851 178.814 1.037 25757 5963 1 8 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.127 0.459 25757 5964 1 8 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.780 -0.219 25757 5965 1 8 . 1 1 14 14 GLU H H 14 7.822 7.822 8.202 -0.380 25757 5966 1 8 . 1 1 15 15 ALA N N 15 122.143 122.143 122.634 -0.491 25757 5967 1 8 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.117 0.013 25757 5968 1 8 . 1 1 15 15 ALA C C 15 178.222 178.222 178.780 -0.558 25757 5969 1 8 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.282 -0.092 25757 5970 1 8 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.909 -0.407 25757 5971 1 8 . 1 1 15 15 ALA H H 15 8.244 8.244 8.449 -0.205 25757 5972 1 8 . 1 1 16 16 PHE N N 16 119.809 119.809 117.331 2.478 25757 5973 1 8 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.607 -0.595 25757 5974 1 8 . 1 1 16 16 PHE C C 16 177.444 177.444 176.701 0.743 25757 5975 1 8 . 1 1 16 16 PHE CA C 16 62.064 62.064 59.844 2.220 25757 5976 1 8 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.654 -1.222 25757 5977 1 8 . 1 1 16 16 PHE H H 16 8.891 8.891 8.425 0.466 25757 5978 1 8 . 1 1 17 17 SER N N 17 112.631 112.631 116.329 -3.698 25757 5979 1 8 . 1 1 17 17 SER HA H 17 4.034 4.034 3.950 0.084 25757 5980 1 8 . 1 1 17 17 SER C C 17 174.675 174.675 175.694 -1.019 25757 5981 1 8 . 1 1 17 17 SER CA C 17 61.507 61.507 61.623 -0.116 25757 5982 1 8 . 1 1 17 17 SER CB C 17 63.414 63.414 63.505 -0.091 25757 5983 1 8 . 1 1 17 17 SER H H 17 7.910 7.910 8.368 -0.458 25757 5984 1 8 . 1 1 18 18 LEU N N 18 120.614 120.614 117.091 3.523 25757 5985 1 8 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.106 -0.094 25757 5986 1 8 . 1 1 18 18 LEU C C 18 177.366 177.366 176.710 0.656 25757 5987 1 8 . 1 1 18 18 LEU CA C 18 57.386 57.386 56.723 0.663 25757 5988 1 8 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.733 -0.138 25757 5989 1 8 . 1 1 18 18 LEU H H 18 7.423 7.423 7.748 -0.325 25757 5990 1 8 . 1 1 19 19 PHE N N 19 114.602 114.602 117.002 -2.400 25757 5991 1 8 . 1 1 19 19 PHE C C 19 176.961 176.961 176.404 0.557 25757 5992 1 8 . 1 1 19 19 PHE CA C 19 59.484 59.484 59.493 -0.009 25757 5993 1 8 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.313 1.456 25757 5994 1 8 . 1 1 19 19 PHE H H 19 7.254 7.254 7.259 -0.005 25757 5995 1 8 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.598 -0.023 25757 5996 1 8 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.366 -1.718 25757 5997 1 8 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.858 -0.848 25757 5998 1 8 . 1 1 23 23 GLY N N 23 108.244 108.244 107.834 0.410 25757 5999 1 8 . 1 1 23 23 GLY C C 23 175.188 175.188 174.500 0.688 25757 6000 1 8 . 1 1 23 23 GLY CA C 23 47.403 47.403 45.794 1.609 25757 6001 1 8 . 1 1 23 23 GLY H H 23 7.555 7.555 8.228 -0.673 25757 6002 1 8 . 1 1 24 24 ASP N N 24 120.667 120.667 120.399 0.268 25757 6003 1 8 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.619 -0.150 25757 6004 1 8 . 1 1 24 24 ASP C C 24 177.457 177.457 177.782 -0.325 25757 6005 1 8 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.255 0.537 25757 6006 1 8 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.729 -1.213 25757 6007 1 8 . 1 1 24 24 ASP H H 24 8.397 8.397 8.516 -0.119 25757 6008 1 8 . 1 1 25 25 GLY N N 25 112.989 112.989 109.219 3.770 25757 6009 1 8 . 1 1 25 25 GLY C C 25 173.639 173.639 173.516 0.123 25757 6010 1 8 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.578 -0.077 25757 6011 1 8 . 1 1 25 25 GLY H H 25 10.592 10.592 9.305 1.287 25757 6012 1 8 . 1 1 26 26 THR N N 26 112.948 112.948 113.285 -0.337 25757 6013 1 8 . 1 1 26 26 THR HA H 26 5.282 5.282 5.247 0.035 25757 6014 1 8 . 1 1 26 26 THR C C 26 172.853 172.853 173.054 -0.201 25757 6015 1 8 . 1 1 26 26 THR CA C 26 59.817 59.817 60.896 -1.079 25757 6016 1 8 . 1 1 26 26 THR CB C 26 72.465 72.465 71.620 0.845 25757 6017 1 8 . 1 1 26 26 THR H H 26 8.121 8.121 8.240 -0.119 25757 6018 1 8 . 1 1 27 27 ILE N N 27 127.195 127.195 124.561 2.634 25757 6019 1 8 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.711 0.202 25757 6020 1 8 . 1 1 27 27 ILE C C 27 176.091 176.091 175.218 0.873 25757 6021 1 8 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.384 0.381 25757 6022 1 8 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.941 -2.236 25757 6023 1 8 . 1 1 27 27 ILE H H 27 9.867 9.867 8.554 1.313 25757 6024 1 8 . 1 1 28 28 THR N N 28 116.655 116.655 121.571 -4.916 25757 6025 1 8 . 1 1 28 28 THR HA H 28 4.790 4.790 4.753 0.037 25757 6026 1 8 . 1 1 28 28 THR C C 28 176.696 176.696 176.233 0.463 25757 6027 1 8 . 1 1 28 28 THR CA C 28 59.590 59.590 61.368 -1.778 25757 6028 1 8 . 1 1 28 28 THR CB C 28 72.457 72.457 70.508 1.949 25757 6029 1 8 . 1 1 28 28 THR H H 28 8.457 8.457 8.651 -0.194 25757 6030 1 8 . 1 1 29 29 THR N N 29 111.878 111.878 117.399 -5.521 25757 6031 1 8 . 1 1 29 29 THR HA H 29 4.188 4.188 3.857 0.331 25757 6032 1 8 . 1 1 29 29 THR C C 29 177.399 177.399 176.123 1.276 25757 6033 1 8 . 1 1 29 29 THR CA C 29 66.386 66.386 67.629 -1.243 25757 6034 1 8 . 1 1 29 29 THR CB C 29 67.726 67.726 68.281 -0.555 25757 6035 1 8 . 1 1 29 29 THR H H 29 9.211 9.211 9.048 0.163 25757 6036 1 8 . 1 1 30 30 LYS N N 30 121.140 121.140 121.572 -0.432 25757 6037 1 8 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.935 0.142 25757 6038 1 8 . 1 1 30 30 LYS C C 30 179.793 179.793 178.278 1.515 25757 6039 1 8 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.382 -0.090 25757 6040 1 8 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.295 1.152 25757 6041 1 8 . 1 1 30 30 LYS H H 30 7.580 7.580 8.431 -0.852 25757 6042 1 8 . 1 1 31 31 GLU N N 31 121.865 121.865 120.065 1.800 25757 6043 1 8 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.011 -0.017 25757 6044 1 8 . 1 1 31 31 GLU C C 31 179.355 179.355 178.936 0.419 25757 6045 1 8 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.103 0.530 25757 6046 1 8 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.405 0.447 25757 6047 1 8 . 1 1 31 31 GLU H H 31 7.708 7.708 7.595 0.113 25757 6048 1 8 . 1 1 32 32 LEU N N 32 120.597 120.597 117.777 2.820 25757 6049 1 8 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.823 0.293 25757 6050 1 8 . 1 1 32 32 LEU C C 32 178.885 178.885 179.039 -0.154 25757 6051 1 8 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.114 0.247 25757 6052 1 8 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.705 2.331 25757 6053 1 8 . 1 1 32 32 LEU H H 32 8.688 8.688 7.554 1.134 25757 6054 1 8 . 1 1 33 33 GLY N N 33 104.837 104.837 107.725 -2.888 25757 6055 1 8 . 1 1 33 33 GLY C C 33 175.123 175.123 175.845 -0.722 25757 6056 1 8 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.639 0.608 25757 6057 1 8 . 1 1 33 33 GLY H H 33 8.694 8.694 8.707 -0.013 25757 6058 1 8 . 1 1 34 34 THR N N 34 117.631 117.631 119.291 -1.660 25757 6059 1 8 . 1 1 34 34 THR HA H 34 3.899 3.899 3.945 -0.046 25757 6060 1 8 . 1 1 34 34 THR C C 34 176.951 176.951 176.939 0.012 25757 6061 1 8 . 1 1 34 34 THR CA C 34 67.234 67.234 66.840 0.395 25757 6062 1 8 . 1 1 34 34 THR CB C 34 68.863 68.863 68.434 0.429 25757 6063 1 8 . 1 1 34 34 THR H H 34 7.960 7.960 7.967 -0.007 25757 6064 1 8 . 1 1 35 35 VAL N N 35 121.659 121.659 122.078 -0.419 25757 6065 1 8 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.678 -0.161 25757 6066 1 8 . 1 1 35 35 VAL C C 35 178.265 178.265 177.874 0.391 25757 6067 1 8 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.639 0.036 25757 6068 1 8 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.232 0.061 25757 6069 1 8 . 1 1 35 35 VAL H H 35 7.358 7.358 8.182 -0.824 25757 6070 1 8 . 1 1 36 36 MET N N 36 117.456 117.456 117.035 0.421 25757 6071 1 8 . 1 1 36 36 MET C C 36 179.088 179.088 178.832 0.256 25757 6072 1 8 . 1 1 36 36 MET CA C 36 60.477 60.477 58.383 2.094 25757 6073 1 8 . 1 1 36 36 MET CB C 36 32.443 32.443 31.899 0.544 25757 6074 1 8 . 1 1 36 36 MET H H 36 8.194 8.194 8.161 0.033 25757 6075 1 8 . 1 1 37 37 ARG CA C 37 59.147 59.147 59.210 -0.063 25757 6076 1 8 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.274 0.076 25757 6077 1 8 . 1 1 38 38 SER HA H 38 4.085 4.085 4.432 -0.347 25757 6078 1 8 . 1 1 38 38 SER C C 38 173.788 173.788 175.135 -1.347 25757 6079 1 8 . 1 1 38 38 SER CA C 38 61.617 61.617 59.829 1.788 25757 6080 1 8 . 1 1 38 38 SER CB C 38 62.943 62.943 63.231 -0.288 25757 6081 1 8 . 1 1 39 39 LEU N N 39 119.003 119.003 120.912 -1.909 25757 6082 1 8 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.515 -0.021 25757 6083 1 8 . 1 1 39 39 LEU C C 39 176.470 176.470 176.931 -0.461 25757 6084 1 8 . 1 1 39 39 LEU CA C 39 53.679 53.679 52.993 0.686 25757 6085 1 8 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.923 0.591 25757 6086 1 8 . 1 1 39 39 LEU H H 39 7.230 7.230 7.443 -0.213 25757 6087 1 8 . 1 1 40 40 GLY N N 40 105.026 105.026 106.634 -1.608 25757 6088 1 8 . 1 1 40 40 GLY C C 40 174.322 174.322 174.586 -0.264 25757 6089 1 8 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.344 0.871 25757 6090 1 8 . 1 1 40 40 GLY H H 40 7.698 7.698 7.598 0.100 25757 6091 1 8 . 1 1 41 41 GLN N N 41 117.929 117.929 120.084 -2.155 25757 6092 1 8 . 1 1 41 41 GLN C C 41 174.557 174.557 174.594 -0.037 25757 6093 1 8 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.700 -0.856 25757 6094 1 8 . 1 1 41 41 GLN H H 41 7.866 7.866 7.550 0.316 25757 6095 1 8 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.544 0.192 25757 6096 1 8 . 1 1 43 43 PRO C C 43 177.805 177.805 176.178 1.627 25757 6097 1 8 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.968 -0.463 25757 6098 1 8 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.482 -0.320 25757 6099 1 8 . 1 1 44 44 THR N N 44 113.167 113.167 116.092 -2.925 25757 6100 1 8 . 1 1 44 44 THR HA H 44 4.684 4.684 4.511 0.173 25757 6101 1 8 . 1 1 44 44 THR C C 44 175.139 175.139 175.711 -0.572 25757 6102 1 8 . 1 1 44 44 THR CA C 44 60.556 60.556 59.620 0.936 25757 6103 1 8 . 1 1 44 44 THR CB C 44 71.064 71.064 71.338 -0.274 25757 6104 1 8 . 1 1 44 44 THR H H 44 8.798 8.798 7.765 1.033 25757 6105 1 8 . 1 1 45 45 GLU N N 45 120.673 120.673 120.800 -0.127 25757 6106 1 8 . 1 1 45 45 GLU HA H 45 3.991 3.991 4.062 -0.071 25757 6107 1 8 . 1 1 45 45 GLU C C 45 178.940 178.940 178.892 0.048 25757 6108 1 8 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.910 -0.009 25757 6109 1 8 . 1 1 45 45 GLU CB C 45 29.029 29.029 28.945 0.084 25757 6110 1 8 . 1 1 45 45 GLU H H 45 8.812 8.812 8.998 -0.186 25757 6111 1 8 . 1 1 46 46 ALA N N 46 120.576 120.576 121.156 -0.580 25757 6112 1 8 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.143 -0.176 25757 6113 1 8 . 1 1 46 46 ALA C C 46 180.290 180.290 180.127 0.163 25757 6114 1 8 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.077 -0.158 25757 6115 1 8 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.196 -0.035 25757 6116 1 8 . 1 1 46 46 ALA H H 46 8.276 8.276 8.431 -0.155 25757 6117 1 8 . 1 1 47 47 GLU N N 47 116.104 116.104 119.086 -2.982 25757 6118 1 8 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.041 -0.041 25757 6119 1 8 . 1 1 47 47 GLU C C 47 180.224 180.224 179.046 1.178 25757 6120 1 8 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.012 -0.081 25757 6121 1 8 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.150 0.839 25757 6122 1 8 . 1 1 47 47 GLU H H 47 7.425 7.425 7.757 -0.332 25757 6123 1 8 . 1 1 48 48 LEU N N 48 120.425 120.425 119.759 0.666 25757 6124 1 8 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.908 0.142 25757 6125 1 8 . 1 1 48 48 LEU C C 48 178.551 178.551 179.176 -0.625 25757 6126 1 8 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.443 -0.604 25757 6127 1 8 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.272 1.298 25757 6128 1 8 . 1 1 48 48 LEU H H 48 8.121 8.121 7.950 0.171 25757 6129 1 8 . 1 1 49 49 GLN N N 49 118.372 118.372 118.438 -0.066 25757 6130 1 8 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.913 -0.151 25757 6131 1 8 . 1 1 49 49 GLN C C 49 178.567 178.567 178.279 0.288 25757 6132 1 8 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.031 -0.168 25757 6133 1 8 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.179 0.063 25757 6134 1 8 . 1 1 49 49 GLN H H 49 8.302 8.302 8.257 0.045 25757 6135 1 8 . 1 1 50 50 ASP N N 50 119.992 119.992 120.391 -0.399 25757 6136 1 8 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.358 0.002 25757 6137 1 8 . 1 1 50 50 ASP C C 50 178.600 178.600 178.267 0.333 25757 6138 1 8 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.182 0.521 25757 6139 1 8 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.847 -0.380 25757 6140 1 8 . 1 1 50 50 ASP H H 50 8.150 8.150 8.210 -0.060 25757 6141 1 8 . 1 1 51 51 MET N N 51 119.238 119.238 119.146 0.092 25757 6142 1 8 . 1 1 51 51 MET HA H 51 3.981 3.981 4.035 -0.054 25757 6143 1 8 . 1 1 51 51 MET C C 51 179.006 179.006 178.840 0.166 25757 6144 1 8 . 1 1 51 51 MET CA C 51 59.443 59.443 58.788 0.655 25757 6145 1 8 . 1 1 51 51 MET CB C 51 33.380 33.380 32.346 1.034 25757 6146 1 8 . 1 1 51 51 MET H H 51 7.844 7.844 8.006 -0.162 25757 6147 1 8 . 1 1 52 52 ILE N N 52 118.161 118.161 118.215 -0.054 25757 6148 1 8 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.592 -0.114 25757 6149 1 8 . 1 1 52 52 ILE C C 52 177.847 177.847 178.635 -0.788 25757 6150 1 8 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.504 0.491 25757 6151 1 8 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.469 0.654 25757 6152 1 8 . 1 1 52 52 ILE H H 52 7.686 7.686 8.261 -0.575 25757 6153 1 8 . 1 1 53 53 ASN N N 53 117.884 117.884 117.297 0.587 25757 6154 1 8 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.364 0.001 25757 6155 1 8 . 1 1 53 53 ASN C C 53 177.515 177.515 176.477 1.038 25757 6156 1 8 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.846 0.361 25757 6157 1 8 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.632 -0.554 25757 6158 1 8 . 1 1 53 53 ASN H H 53 8.713 8.713 8.223 0.490 25757 6159 1 8 . 1 1 54 54 GLU N N 54 116.178 116.178 117.878 -1.700 25757 6160 1 8 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.253 -0.264 25757 6161 1 8 . 1 1 54 54 GLU C C 54 177.557 177.557 177.215 0.342 25757 6162 1 8 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.539 1.451 25757 6163 1 8 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.442 0.021 25757 6164 1 8 . 1 1 54 54 GLU H H 54 7.530 7.530 8.013 -0.483 25757 6165 1 8 . 1 1 55 55 VAL N N 55 107.164 107.164 110.297 -3.133 25757 6166 1 8 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.372 0.150 25757 6167 1 8 . 1 1 55 55 VAL C C 55 175.602 175.602 173.940 1.662 25757 6168 1 8 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.253 0.099 25757 6169 1 8 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.837 0.766 25757 6170 1 8 . 1 1 55 55 VAL H H 55 7.175 7.175 7.514 -0.339 25757 6171 1 8 . 1 1 56 56 ASP N N 56 122.126 122.126 120.089 2.037 25757 6172 1 8 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.221 -0.622 25757 6173 1 8 . 1 1 56 56 ASP C C 56 176.182 176.182 176.024 0.158 25757 6174 1 8 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.209 0.598 25757 6175 1 8 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.742 -2.471 25757 6176 1 8 . 1 1 56 56 ASP H H 56 7.569 7.569 7.388 0.181 25757 6177 1 8 . 1 1 57 57 ALA N N 57 103.782 103.782 128.382 -24.600 25757 6178 1 8 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.314 -0.134 25757 6179 1 8 . 1 1 57 57 ALA C C 57 178.584 178.584 178.030 0.554 25757 6180 1 8 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.310 1.034 25757 6181 1 8 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.600 -0.076 25757 6182 1 8 . 1 1 57 57 ALA H H 57 8.515 8.515 8.549 -0.034 25757 6183 1 8 . 1 1 58 58 ASP N N 58 113.602 113.602 119.403 -5.801 25757 6184 1 8 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.546 0.040 25757 6185 1 8 . 1 1 58 58 ASP C C 58 177.756 177.756 177.214 0.542 25757 6186 1 8 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.822 -2.060 25757 6187 1 8 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.124 -1.446 25757 6188 1 8 . 1 1 58 58 ASP H H 58 8.130 8.130 8.287 -0.157 25757 6189 1 8 . 1 1 59 59 GLY N N 59 109.195 109.195 108.774 0.421 25757 6190 1 8 . 1 1 59 59 GLY C C 59 175.139 175.139 174.976 0.163 25757 6191 1 8 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.230 2.034 25757 6192 1 8 . 1 1 59 59 GLY H H 59 7.694 7.694 8.425 -0.731 25757 6193 1 8 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.715 -0.110 25757 6194 1 8 . 1 1 61 61 GLY N N 61 113.316 113.316 110.394 2.922 25757 6195 1 8 . 1 1 61 61 GLY C C 61 173.234 173.234 172.827 0.407 25757 6196 1 8 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.307 0.391 25757 6197 1 8 . 1 1 61 61 GLY H H 61 10.633 10.633 8.344 2.289 25757 6198 1 8 . 1 1 62 62 THR N N 62 108.892 108.892 111.460 -2.568 25757 6199 1 8 . 1 1 62 62 THR HA H 62 4.736 4.736 4.596 0.140 25757 6200 1 8 . 1 1 62 62 THR C C 62 173.091 173.091 172.937 0.154 25757 6201 1 8 . 1 1 62 62 THR CA C 62 59.617 59.617 60.192 -0.575 25757 6202 1 8 . 1 1 62 62 THR CB C 62 72.004 72.004 71.435 0.569 25757 6203 1 8 . 1 1 62 62 THR H H 62 7.673 7.673 7.262 0.411 25757 6204 1 8 . 1 1 63 63 ILE N N 63 123.324 123.324 126.038 -2.714 25757 6205 1 8 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.490 0.639 25757 6206 1 8 . 1 1 63 63 ILE C C 63 175.652 175.652 175.760 -0.108 25757 6207 1 8 . 1 1 63 63 ILE CA C 63 60.486 60.486 61.933 -1.447 25757 6208 1 8 . 1 1 63 63 ILE CB C 63 39.957 39.957 39.642 0.315 25757 6209 1 8 . 1 1 63 63 ILE H H 63 8.907 8.907 8.808 0.099 25757 6210 1 8 . 1 1 64 64 ASP N N 64 128.253 128.253 126.209 2.044 25757 6211 1 8 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.912 0.409 25757 6212 1 8 . 1 1 64 64 ASP C C 64 176.431 176.431 177.410 -0.979 25757 6213 1 8 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.315 -0.984 25757 6214 1 8 . 1 1 64 64 ASP CB C 64 42.053 42.053 43.003 -0.950 25757 6215 1 8 . 1 1 64 64 ASP H H 64 8.864 8.864 9.009 -0.145 25757 6216 1 8 . 1 1 65 65 PHE N N 65 118.583 118.583 121.183 -2.600 25757 6217 1 8 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.189 -0.329 25757 6218 1 8 . 1 1 65 65 PHE C C 65 173.458 173.458 174.294 -0.836 25757 6219 1 8 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.460 2.339 25757 6220 1 8 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.582 -0.702 25757 6221 1 8 . 1 1 65 65 PHE H H 65 8.962 8.962 8.792 0.170 25757 6222 1 8 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.630 0.488 25757 6223 1 8 . 1 1 66 66 PRO C C 66 180.038 180.038 178.482 1.556 25757 6224 1 8 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.724 1.966 25757 6225 1 8 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.877 -0.200 25757 6226 1 8 . 1 1 67 67 GLU N N 67 118.402 118.402 119.349 -0.947 25757 6227 1 8 . 1 1 67 67 GLU C C 67 178.737 178.737 178.467 0.270 25757 6228 1 8 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.597 -0.589 25757 6229 1 8 . 1 1 67 67 GLU CB C 67 29.685 29.685 28.994 0.691 25757 6230 1 8 . 1 1 67 67 GLU H H 67 7.953 7.953 7.985 -0.032 25757 6231 1 8 . 1 1 68 68 PHE N N 68 123.421 123.421 120.059 3.362 25757 6232 1 8 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.122 -0.150 25757 6233 1 8 . 1 1 68 68 PHE C C 68 177.184 177.184 176.990 0.194 25757 6234 1 8 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.113 0.225 25757 6235 1 8 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.034 0.935 25757 6236 1 8 . 1 1 68 68 PHE H H 68 8.928 8.928 7.488 1.440 25757 6237 1 8 . 1 1 69 69 LEU N N 69 119.284 119.284 119.464 -0.180 25757 6238 1 8 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.538 -0.203 25757 6239 1 8 . 1 1 69 69 LEU C C 69 178.987 178.987 178.160 0.827 25757 6240 1 8 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.746 -0.884 25757 6241 1 8 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.632 -0.800 25757 6242 1 8 . 1 1 69 69 LEU H H 69 8.374 8.374 7.548 0.826 25757 6243 1 8 . 1 1 70 70 THR N N 70 116.017 116.017 112.674 3.343 25757 6244 1 8 . 1 1 70 70 THR HA H 70 4.338 4.338 3.674 0.664 25757 6245 1 8 . 1 1 70 70 THR C C 70 176.169 176.169 176.553 -0.384 25757 6246 1 8 . 1 1 70 70 THR CA C 70 66.700 66.700 65.948 0.752 25757 6247 1 8 . 1 1 70 70 THR CB C 70 68.379 68.379 68.645 -0.266 25757 6248 1 8 . 1 1 70 70 THR H H 70 7.493 7.493 7.960 -0.467 25757 6249 1 8 . 1 1 71 71 MET N N 71 121.915 121.915 122.098 -0.183 25757 6250 1 8 . 1 1 71 71 MET HA H 71 3.718 3.718 3.907 -0.189 25757 6251 1 8 . 1 1 71 71 MET C C 71 178.190 178.190 177.497 0.693 25757 6252 1 8 . 1 1 71 71 MET CA C 71 59.335 59.335 59.071 0.264 25757 6253 1 8 . 1 1 71 71 MET CB C 71 33.894 33.894 32.502 1.393 25757 6254 1 8 . 1 1 71 71 MET H H 71 7.924 7.924 7.790 0.134 25757 6255 1 8 . 1 1 72 72 MET N N 72 116.973 116.973 117.537 -0.564 25757 6256 1 8 . 1 1 72 72 MET HA H 72 3.968 3.968 4.022 -0.054 25757 6257 1 8 . 1 1 72 72 MET C C 72 178.211 178.211 178.351 -0.140 25757 6258 1 8 . 1 1 72 72 MET CA C 72 56.059 56.059 58.584 -2.525 25757 6259 1 8 . 1 1 72 72 MET CB C 72 31.639 31.639 32.728 -1.089 25757 6260 1 8 . 1 1 72 72 MET H H 72 8.276 8.276 7.626 0.650 25757 6261 1 8 . 1 1 73 73 ALA N N 73 122.499 122.499 122.433 0.066 25757 6262 1 8 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.745 0.205 25757 6263 1 8 . 1 1 73 73 ALA C C 73 180.231 180.231 178.879 1.352 25757 6264 1 8 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.855 0.097 25757 6265 1 8 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.758 0.274 25757 6266 1 8 . 1 1 73 73 ALA H H 73 8.240 8.240 8.226 0.014 25757 6267 1 8 . 1 1 74 74 ARG N N 74 116.098 116.098 117.357 -1.259 25757 6268 1 8 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.944 0.048 25757 6269 1 8 . 1 1 74 74 ARG C C 74 178.567 178.567 177.938 0.629 25757 6270 1 8 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.575 0.250 25757 6271 1 8 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.912 0.163 25757 6272 1 8 . 1 1 74 74 ARG H H 74 7.420 7.420 7.850 -0.430 25757 6273 1 8 . 1 1 75 75 LYS N N 75 119.046 119.046 117.867 1.179 25757 6274 1 8 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.252 -0.209 25757 6275 1 8 . 1 1 75 75 LYS C C 75 179.045 179.045 179.045 0.000 25757 6276 1 8 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.265 -0.376 25757 6277 1 8 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.452 -0.686 25757 6278 1 8 . 1 1 75 75 LYS H H 75 7.862 7.862 7.994 -0.132 25757 6279 1 8 . 1 1 76 76 MET N N 76 116.772 116.772 120.528 -3.756 25757 6280 1 8 . 1 1 76 76 MET H H 76 8.099 8.099 7.485 0.614 25757 6281 1 8 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.605 0.029 25757 6282 1 8 . 1 1 78 78 ASP C C 78 176.395 176.395 176.800 -0.405 25757 6283 1 8 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.215 0.429 25757 6284 1 8 . 1 1 78 78 ASP CB C 78 41.474 41.474 40.836 0.638 25757 6285 1 8 . 1 1 79 79 THR N N 79 113.904 113.904 119.395 -5.491 25757 6286 1 8 . 1 1 79 79 THR HA H 79 4.215 4.215 4.023 0.192 25757 6287 1 8 . 1 1 79 79 THR C C 79 174.204 174.204 174.198 0.006 25757 6288 1 8 . 1 1 79 79 THR CA C 79 62.264 62.264 65.444 -3.180 25757 6289 1 8 . 1 1 79 79 THR CB C 79 69.884 69.884 69.296 0.588 25757 6290 1 8 . 1 1 79 79 THR H H 79 8.039 8.039 8.153 -0.114 25757 6291 1 8 . 1 1 80 80 ASP N N 80 123.572 123.572 121.968 1.604 25757 6292 1 8 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.718 0.002 25757 6293 1 8 . 1 1 80 80 ASP C C 80 176.221 176.221 176.273 -0.052 25757 6294 1 8 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.629 -0.314 25757 6295 1 8 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.739 0.688 25757 6296 1 8 . 1 1 80 80 ASP H H 80 8.441 8.441 8.127 0.314 25757 6297 1 8 . 1 1 81 81 SER N N 81 117.879 117.879 120.069 -2.190 25757 6298 1 8 . 1 1 81 81 SER HA H 81 3.925 3.925 4.568 -0.643 25757 6299 1 8 . 1 1 81 81 SER C C 81 175.264 175.264 175.502 -0.238 25757 6300 1 8 . 1 1 81 81 SER CA C 81 58.860 58.860 59.385 -0.525 25757 6301 1 8 . 1 1 81 81 SER CB C 81 63.790 63.790 63.737 0.053 25757 6302 1 8 . 1 1 81 81 SER H H 81 8.503 8.503 8.561 -0.058 25757 6303 1 8 . 1 1 82 82 GLU N N 82 123.206 123.206 120.789 2.417 25757 6304 1 8 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.049 0.009 25757 6305 1 8 . 1 1 82 82 GLU C C 82 178.378 178.378 178.399 -0.021 25757 6306 1 8 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.258 0.328 25757 6307 1 8 . 1 1 82 82 GLU CB C 82 29.603 29.603 28.912 0.691 25757 6308 1 8 . 1 1 82 82 GLU H H 82 8.563 8.563 8.774 -0.211 25757 6309 1 8 . 1 1 83 83 GLU N N 83 119.262 119.262 120.698 -1.436 25757 6310 1 8 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.933 0.024 25757 6311 1 8 . 1 1 83 83 GLU C C 83 178.606 178.606 178.581 0.025 25757 6312 1 8 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.427 0.242 25757 6313 1 8 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.176 0.179 25757 6314 1 8 . 1 1 83 83 GLU H H 83 7.728 7.728 8.015 -0.287 25757 6315 1 8 . 1 1 84 84 GLU N N 84 118.432 118.432 119.708 -1.276 25757 6316 1 8 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.016 0.091 25757 6317 1 8 . 1 1 84 84 GLU C C 84 179.436 179.436 179.275 0.161 25757 6318 1 8 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.670 -0.167 25757 6319 1 8 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.532 -0.425 25757 6320 1 8 . 1 1 84 84 GLU H H 84 8.346 8.346 8.270 0.076 25757 6321 1 8 . 1 1 85 85 ILE N N 85 120.925 120.925 120.322 0.603 25757 6322 1 8 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.742 0.006 25757 6323 1 8 . 1 1 85 85 ILE C C 85 177.661 177.661 178.069 -0.408 25757 6324 1 8 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.610 -0.120 25757 6325 1 8 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.739 -0.308 25757 6326 1 8 . 1 1 85 85 ILE H H 85 7.821 7.821 8.302 -0.481 25757 6327 1 8 . 1 1 86 86 ARG N N 86 121.916 121.916 118.727 3.189 25757 6328 1 8 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.828 0.308 25757 6329 1 8 . 1 1 86 86 ARG C C 86 179.208 179.208 179.001 0.207 25757 6330 1 8 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.535 0.836 25757 6331 1 8 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.779 0.319 25757 6332 1 8 . 1 1 86 86 ARG H H 86 8.432 8.432 8.231 0.201 25757 6333 1 8 . 1 1 87 87 GLU N N 87 118.261 118.261 118.625 -0.364 25757 6334 1 8 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.941 0.171 25757 6335 1 8 . 1 1 87 87 GLU C C 87 178.516 178.516 178.674 -0.158 25757 6336 1 8 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.211 -0.185 25757 6337 1 8 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.164 0.006 25757 6338 1 8 . 1 1 87 87 GLU H H 87 8.225 8.225 8.082 0.143 25757 6339 1 8 . 1 1 88 88 ALA N N 88 121.009 121.009 122.642 -1.633 25757 6340 1 8 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.521 0.306 25757 6341 1 8 . 1 1 88 88 ALA C C 88 177.947 177.947 178.191 -0.244 25757 6342 1 8 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.925 -0.064 25757 6343 1 8 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.312 -0.357 25757 6344 1 8 . 1 1 88 88 ALA H H 88 7.789 7.789 8.037 -0.248 25757 6345 1 8 . 1 1 89 89 PHE N N 89 117.164 117.164 118.383 -1.219 25757 6346 1 8 . 1 1 89 89 PHE C C 89 176.134 176.134 177.302 -1.168 25757 6347 1 8 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.355 2.296 25757 6348 1 8 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.847 0.046 25757 6349 1 8 . 1 1 89 89 PHE H H 89 8.337 8.337 7.517 0.820 25757 6350 1 8 . 1 1 90 90 ARG N N 90 114.900 114.900 117.479 -2.579 25757 6351 1 8 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.882 0.032 25757 6352 1 8 . 1 1 90 90 ARG C C 90 178.296 178.296 177.459 0.837 25757 6353 1 8 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.705 1.374 25757 6354 1 8 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.401 -0.308 25757 6355 1 8 . 1 1 90 90 ARG H H 90 7.681 7.681 7.828 -0.147 25757 6356 1 8 . 1 1 91 91 VAL N N 91 116.927 116.927 114.794 2.133 25757 6357 1 8 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.900 -0.293 25757 6358 1 8 . 1 1 91 91 VAL C C 91 177.964 177.964 177.270 0.694 25757 6359 1 8 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.663 0.297 25757 6360 1 8 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.811 -0.192 25757 6361 1 8 . 1 1 91 91 VAL H H 91 7.405 7.405 7.488 -0.083 25757 6362 1 8 . 1 1 92 92 PHE N N 92 119.026 119.026 116.542 2.484 25757 6363 1 8 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.370 -0.008 25757 6364 1 8 . 1 1 92 92 PHE C C 92 177.639 177.639 176.034 1.605 25757 6365 1 8 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.311 -0.590 25757 6366 1 8 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.844 -0.417 25757 6367 1 8 . 1 1 92 92 PHE H H 92 7.886 7.886 7.502 0.384 25757 6368 1 8 . 1 1 93 93 ASP N N 93 118.238 118.238 118.859 -0.621 25757 6369 1 8 . 1 1 93 93 ASP HA H 93 4.462 4.462 5.032 -0.570 25757 6370 1 8 . 1 1 93 93 ASP C C 93 176.979 176.979 176.397 0.582 25757 6371 1 8 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.358 -0.210 25757 6372 1 8 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.749 -1.600 25757 6373 1 8 . 1 1 93 93 ASP H H 93 8.009 8.009 7.498 0.511 25757 6374 1 8 . 1 1 94 94 LYS N N 94 125.792 125.792 124.092 1.700 25757 6375 1 8 . 1 1 94 94 LYS C C 94 178.213 178.213 177.782 0.431 25757 6376 1 8 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.993 0.325 25757 6377 1 8 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.542 -1.514 25757 6378 1 8 . 1 1 94 94 LYS H H 94 7.428 7.428 8.188 -0.760 25757 6379 1 8 . 1 1 95 95 ASP N N 95 113.833 113.833 116.054 -2.221 25757 6380 1 8 . 1 1 95 95 ASP C C 95 177.718 177.718 176.791 0.927 25757 6381 1 8 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.220 -1.275 25757 6382 1 8 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.499 -0.756 25757 6383 1 8 . 1 1 95 95 ASP H H 95 8.159 8.159 8.492 -0.333 25757 6384 1 8 . 1 1 96 96 GLY N N 96 109.414 109.414 109.172 0.242 25757 6385 1 8 . 1 1 96 96 GLY C C 96 175.093 175.093 175.051 0.042 25757 6386 1 8 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.975 1.279 25757 6387 1 8 . 1 1 96 96 GLY H H 96 7.848 7.848 7.836 0.012 25757 6388 1 8 . 1 1 97 97 ASN N N 97 119.590 119.590 117.585 2.005 25757 6389 1 8 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.542 0.070 25757 6390 1 8 . 1 1 97 97 ASN C C 97 175.937 175.937 176.209 -0.272 25757 6391 1 8 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.212 -0.325 25757 6392 1 8 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.168 -0.848 25757 6393 1 8 . 1 1 97 97 ASN H H 97 8.338 8.338 8.398 -0.060 25757 6394 1 8 . 1 1 98 98 GLY N N 98 112.940 112.940 108.063 4.877 25757 6395 1 8 . 1 1 98 98 GLY C C 98 172.429 172.429 172.511 -0.082 25757 6396 1 8 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.979 0.113 25757 6397 1 8 . 1 1 98 98 GLY H H 98 10.695 10.695 8.801 1.894 25757 6398 1 8 . 1 1 99 99 TYR N N 99 115.544 115.544 117.749 -2.205 25757 6399 1 8 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.376 -0.289 25757 6400 1 8 . 1 1 99 99 TYR C C 99 174.859 174.859 174.846 0.013 25757 6401 1 8 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.825 -0.807 25757 6402 1 8 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.072 1.281 25757 6403 1 8 . 1 1 99 99 TYR H H 99 7.597 7.597 8.144 -0.547 25757 6404 1 8 . 1 1 100 100 ILE N N 100 127.078 127.078 123.712 3.366 25757 6405 1 8 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.672 0.117 25757 6406 1 8 . 1 1 100 100 ILE C C 100 175.387 175.387 176.117 -0.730 25757 6407 1 8 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.216 -0.210 25757 6408 1 8 . 1 1 100 100 ILE CB C 100 38.790 38.790 40.135 -1.345 25757 6409 1 8 . 1 1 100 100 ILE H H 100 10.267 10.267 9.366 0.901 25757 6410 1 8 . 1 1 101 101 SER N N 101 124.102 124.102 122.084 2.018 25757 6411 1 8 . 1 1 101 101 SER HA H 101 4.417 4.417 5.004 -0.587 25757 6412 1 8 . 1 1 101 101 SER C C 101 175.360 175.360 175.460 -0.100 25757 6413 1 8 . 1 1 101 101 SER CA C 101 56.036 56.036 57.303 -1.267 25757 6414 1 8 . 1 1 101 101 SER CB C 101 66.896 66.896 66.399 0.497 25757 6415 1 8 . 1 1 101 101 SER H H 101 8.985 8.985 7.854 1.131 25757 6416 1 8 . 1 1 102 102 ALA N N 102 122.780 122.780 123.875 -1.095 25757 6417 1 8 . 1 1 102 102 ALA HA H 102 3.744 3.744 4.006 -0.262 25757 6418 1 8 . 1 1 102 102 ALA C C 102 179.175 179.175 178.195 0.980 25757 6419 1 8 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.106 1.184 25757 6420 1 8 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.337 -0.310 25757 6421 1 8 . 1 1 102 102 ALA H H 102 9.269 9.269 9.095 0.174 25757 6422 1 8 . 1 1 103 103 ALA N N 103 118.513 118.513 121.233 -2.720 25757 6423 1 8 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.784 0.227 25757 6424 1 8 . 1 1 103 103 ALA C C 103 181.521 181.521 178.908 2.613 25757 6425 1 8 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.026 0.327 25757 6426 1 8 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.150 0.141 25757 6427 1 8 . 1 1 103 103 ALA H H 103 8.321 8.321 8.208 0.113 25757 6428 1 8 . 1 1 104 104 GLU N N 104 119.550 119.550 118.905 0.645 25757 6429 1 8 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.045 -0.039 25757 6430 1 8 . 1 1 104 104 GLU C C 104 179.750 179.750 178.652 1.098 25757 6431 1 8 . 1 1 104 104 GLU CA C 104 59.169 59.169 58.731 0.438 25757 6432 1 8 . 1 1 104 104 GLU CB C 104 29.215 29.215 28.640 0.575 25757 6433 1 8 . 1 1 104 104 GLU H H 104 7.867 7.867 8.085 -0.218 25757 6434 1 8 . 1 1 105 105 LEU N N 105 122.688 122.688 121.837 0.851 25757 6435 1 8 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.864 0.054 25757 6436 1 8 . 1 1 105 105 LEU C C 105 178.233 178.233 178.699 -0.466 25757 6437 1 8 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.363 -0.629 25757 6438 1 8 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.715 0.305 25757 6439 1 8 . 1 1 105 105 LEU H H 105 8.746 8.746 8.002 0.744 25757 6440 1 8 . 1 1 106 106 ARG N N 106 118.835 118.835 117.959 0.876 25757 6441 1 8 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.732 -0.082 25757 6442 1 8 . 1 1 106 106 ARG C C 106 178.742 178.742 178.700 0.042 25757 6443 1 8 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.985 -0.022 25757 6444 1 8 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.870 0.176 25757 6445 1 8 . 1 1 106 106 ARG H H 106 8.684 8.684 7.782 0.902 25757 6446 1 8 . 1 1 107 107 HIS N N 107 119.258 119.258 118.201 1.057 25757 6447 1 8 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.373 -0.106 25757 6448 1 8 . 1 1 107 107 HIS C C 107 177.244 177.244 178.197 -0.953 25757 6449 1 8 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.777 1.375 25757 6450 1 8 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.491 1.084 25757 6451 1 8 . 1 1 107 107 HIS H H 107 7.691 7.691 7.963 -0.272 25757 6452 1 8 . 1 1 108 108 VAL N N 108 118.996 118.996 121.078 -2.082 25757 6453 1 8 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.698 -0.260 25757 6454 1 8 . 1 1 108 108 VAL C C 108 177.998 177.998 178.259 -0.261 25757 6455 1 8 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.940 -0.509 25757 6456 1 8 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.874 -0.450 25757 6457 1 8 . 1 1 108 108 VAL H H 108 7.599 7.599 8.408 -0.809 25757 6458 1 8 . 1 1 109 109 MET N N 109 114.880 114.880 118.160 -3.280 25757 6459 1 8 . 1 1 109 109 MET C C 109 179.119 179.119 178.219 0.900 25757 6460 1 8 . 1 1 109 109 MET CA C 109 56.979 56.979 58.627 -1.648 25757 6461 1 8 . 1 1 109 109 MET CB C 109 29.253 29.253 32.319 -3.066 25757 6462 1 8 . 1 1 109 109 MET H H 109 7.911 7.911 8.137 -0.226 25757 6463 1 8 . 1 1 110 110 THR N N 110 116.943 116.943 114.911 2.032 25757 6464 1 8 . 1 1 110 110 THR HA H 110 4.229 4.229 3.860 0.369 25757 6465 1 8 . 1 1 110 110 THR C C 110 178.506 178.506 176.749 1.757 25757 6466 1 8 . 1 1 110 110 THR CA C 110 66.573 66.573 65.752 0.821 25757 6467 1 8 . 1 1 110 110 THR CB C 110 68.575 68.575 68.563 0.012 25757 6468 1 8 . 1 1 110 110 THR H H 110 8.353 8.353 8.102 0.251 25757 6469 1 8 . 1 1 111 111 ASN N N 111 123.829 123.829 119.337 4.492 25757 6470 1 8 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.447 -0.085 25757 6471 1 8 . 1 1 111 111 ASN C C 111 177.197 177.197 177.179 0.018 25757 6472 1 8 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.870 0.089 25757 6473 1 8 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.550 -1.327 25757 6474 1 8 . 1 1 111 111 ASN H H 111 8.053 8.053 8.000 0.053 25757 6475 1 8 . 1 1 112 112 LEU N N 112 119.036 119.036 118.887 0.149 25757 6476 1 8 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.230 -0.060 25757 6477 1 8 . 1 1 112 112 LEU C C 112 176.377 176.377 177.788 -1.411 25757 6478 1 8 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.009 -0.504 25757 6479 1 8 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.455 -0.095 25757 6480 1 8 . 1 1 112 112 LEU H H 112 7.794 7.794 7.896 -0.102 25757 6481 1 8 . 1 1 113 113 GLY N N 113 106.045 106.045 105.527 0.518 25757 6482 1 8 . 1 1 113 113 GLY C C 113 174.248 174.248 173.917 0.331 25757 6483 1 8 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.502 0.805 25757 6484 1 8 . 1 1 113 113 GLY H H 113 7.741 7.741 7.429 0.312 25757 6485 1 8 . 1 1 114 114 GLU N N 114 120.556 120.556 121.514 -0.958 25757 6486 1 8 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.169 0.141 25757 6487 1 8 . 1 1 114 114 GLU C C 114 174.993 174.993 176.283 -1.290 25757 6488 1 8 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.728 -1.091 25757 6489 1 8 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.427 1.790 25757 6490 1 8 . 1 1 114 114 GLU H H 114 7.980 7.980 7.691 0.289 25757 6491 1 8 . 1 1 115 115 LYS N N 115 124.986 124.986 126.658 -1.672 25757 6492 1 8 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.066 0.268 25757 6493 1 8 . 1 1 115 115 LYS C C 115 175.285 175.285 175.243 0.042 25757 6494 1 8 . 1 1 115 115 LYS CA C 115 55.581 55.581 57.170 -1.589 25757 6495 1 8 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.062 -0.089 25757 6496 1 8 . 1 1 115 115 LYS H H 115 8.613 8.613 8.329 0.284 25757 6497 1 8 . 1 1 116 116 LEU N N 116 125.243 125.243 125.943 -0.700 25757 6498 1 8 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.540 0.148 25757 6499 1 8 . 1 1 116 116 LEU C C 116 178.365 178.365 176.171 2.194 25757 6500 1 8 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.777 -0.429 25757 6501 1 8 . 1 1 116 116 LEU CB C 116 44.289 44.289 45.472 -1.183 25757 6502 1 8 . 1 1 116 116 LEU H H 116 8.066 8.066 8.211 -0.145 25757 6503 1 8 . 1 1 117 117 THR N N 117 114.324 114.324 112.962 1.362 25757 6504 1 8 . 1 1 117 117 THR HA H 117 4.713 4.713 4.723 -0.010 25757 6505 1 8 . 1 1 117 117 THR C C 117 175.539 175.539 174.771 0.768 25757 6506 1 8 . 1 1 117 117 THR CA C 117 60.756 60.756 59.635 1.121 25757 6507 1 8 . 1 1 117 117 THR CB C 117 71.144 71.144 71.450 -0.306 25757 6508 1 8 . 1 1 117 117 THR H H 117 9.228 9.228 8.209 1.019 25757 6509 1 8 . 1 1 118 118 ASP N N 118 121.016 121.016 120.756 0.260 25757 6510 1 8 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.241 -0.086 25757 6511 1 8 . 1 1 118 118 ASP H H 118 8.919 8.919 8.737 0.182 25757 6512 1 8 . 1 1 119 119 GLU N N 119 121.016 121.016 118.338 2.678 25757 6513 1 8 . 1 1 119 119 GLU C C 119 179.204 179.204 178.988 0.216 25757 6514 1 8 . 1 1 119 119 GLU CA C 119 58.070 58.070 58.933 -0.863 25757 6515 1 8 . 1 1 119 119 GLU CB C 119 29.044 29.044 28.989 0.055 25757 6516 1 8 . 1 1 119 119 GLU H H 119 8.919 8.919 8.680 0.239 25757 6517 1 8 . 1 1 120 120 GLU N N 120 120.566 120.566 120.227 0.339 25757 6518 1 8 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.010 -0.009 25757 6519 1 8 . 1 1 120 120 GLU C C 120 180.329 180.329 178.918 1.411 25757 6520 1 8 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.050 0.041 25757 6521 1 8 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.101 1.538 25757 6522 1 8 . 1 1 120 120 GLU H H 120 7.732 7.732 7.611 0.121 25757 6523 1 8 . 1 1 121 121 VAL N N 121 121.875 121.875 119.206 2.669 25757 6524 1 8 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.517 -0.052 25757 6525 1 8 . 1 1 121 121 VAL C C 121 177.477 177.477 178.247 -0.770 25757 6526 1 8 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.826 0.345 25757 6527 1 8 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.185 0.249 25757 6528 1 8 . 1 1 121 121 VAL H H 121 8.104 8.104 7.633 0.471 25757 6529 1 8 . 1 1 122 122 ASP N N 122 120.566 120.566 119.278 1.288 25757 6530 1 8 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.347 -0.012 25757 6531 1 8 . 1 1 122 122 ASP C C 122 179.298 179.298 179.084 0.214 25757 6532 1 8 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.402 0.437 25757 6533 1 8 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.116 0.196 25757 6534 1 8 . 1 1 122 122 ASP H H 122 8.089 8.089 8.229 -0.140 25757 6535 1 8 . 1 1 123 123 GLU N N 123 119.821 119.821 120.196 -0.375 25757 6536 1 8 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.021 0.028 25757 6537 1 8 . 1 1 123 123 GLU C C 123 178.749 178.749 178.908 -0.159 25757 6538 1 8 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.670 -0.353 25757 6539 1 8 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.849 -0.463 25757 6540 1 8 . 1 1 123 123 GLU H H 123 8.105 8.105 7.951 0.154 25757 6541 1 8 . 1 1 124 124 MET N N 124 119.288 119.288 118.162 1.126 25757 6542 1 8 . 1 1 124 124 MET C C 124 180.865 180.865 178.951 1.914 25757 6543 1 8 . 1 1 124 124 MET CA C 124 60.684 60.684 59.213 1.471 25757 6544 1 8 . 1 1 124 124 MET CB C 124 33.141 33.141 32.004 1.137 25757 6545 1 8 . 1 1 124 124 MET H H 124 7.726 7.726 8.130 -0.404 25757 6546 1 8 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.053 -0.324 25757 6547 1 8 . 1 1 125 125 ILE C C 125 177.341 177.341 177.923 -0.582 25757 6548 1 8 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.370 0.431 25757 6549 1 8 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.860 -1.295 25757 6550 1 8 . 1 1 126 126 ARG N N 126 118.555 118.555 120.068 -1.513 25757 6551 1 8 . 1 1 126 126 ARG C C 126 179.164 179.164 178.093 1.071 25757 6552 1 8 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.533 0.391 25757 6553 1 8 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.242 -0.377 25757 6554 1 8 . 1 1 126 126 ARG H H 126 8.380 8.380 7.912 0.468 25757 6555 1 8 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.324 -0.399 25757 6556 1 8 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.944 1.113 25757 6557 1 8 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.144 0.684 25757 6558 1 8 . 1 1 128 128 ALA N N 128 116.764 116.764 119.980 -3.216 25757 6559 1 8 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.129 0.288 25757 6560 1 8 . 1 1 128 128 ALA C C 128 177.885 177.885 177.564 0.321 25757 6561 1 8 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.369 -1.414 25757 6562 1 8 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.471 3.096 25757 6563 1 8 . 1 1 128 128 ALA H H 128 7.152 7.152 7.917 -0.765 25757 6564 1 8 . 1 1 129 129 ASP N N 129 117.762 117.762 119.282 -1.520 25757 6565 1 8 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.083 -0.606 25757 6566 1 8 . 1 1 129 129 ASP C C 129 175.935 175.935 176.988 -1.053 25757 6567 1 8 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.704 1.811 25757 6568 1 8 . 1 1 129 129 ASP CB C 129 40.745 40.745 40.947 -0.202 25757 6569 1 8 . 1 1 129 129 ASP H H 129 8.007 8.007 8.081 -0.074 25757 6570 1 8 . 1 1 130 130 ILE N N 130 128.249 128.249 121.168 7.081 25757 6571 1 8 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.130 -0.266 25757 6572 1 8 . 1 1 130 130 ILE C C 130 177.764 177.764 176.192 1.572 25757 6573 1 8 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.464 1.084 25757 6574 1 8 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.592 1.056 25757 6575 1 8 . 1 1 130 130 ILE H H 130 8.412 8.412 8.202 0.210 25757 6576 1 8 . 1 1 131 131 ASP N N 131 116.430 116.430 122.000 -5.570 25757 6577 1 8 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.653 -0.119 25757 6578 1 8 . 1 1 131 131 ASP C C 131 178.313 178.313 176.887 1.426 25757 6579 1 8 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.768 -0.884 25757 6580 1 8 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.232 -1.270 25757 6581 1 8 . 1 1 131 131 ASP H H 131 8.254 8.254 7.862 0.392 25757 6582 1 8 . 1 1 132 132 GLY N N 132 108.460 108.460 108.784 -0.324 25757 6583 1 8 . 1 1 132 132 GLY C C 132 175.211 175.211 174.315 0.896 25757 6584 1 8 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.544 2.059 25757 6585 1 8 . 1 1 132 132 GLY H H 132 7.547 7.547 8.565 -1.018 25757 6586 1 8 . 1 1 133 133 ASP N N 133 120.909 120.909 119.254 1.655 25757 6587 1 8 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.670 -0.207 25757 6588 1 8 . 1 1 133 133 ASP C C 133 177.691 177.691 176.941 0.750 25757 6589 1 8 . 1 1 133 133 ASP CA C 133 53.814 53.814 51.674 2.140 25757 6590 1 8 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.788 -0.490 25757 6591 1 8 . 1 1 133 133 ASP H H 133 8.339 8.339 8.418 -0.079 25757 6592 1 8 . 1 1 134 134 GLY N N 134 112.704 112.704 107.630 5.074 25757 6593 1 8 . 1 1 134 134 GLY C C 134 172.722 172.722 173.688 -0.966 25757 6594 1 8 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.791 0.246 25757 6595 1 8 . 1 1 134 134 GLY H H 134 10.396 10.396 8.003 2.393 25757 6596 1 8 . 1 1 135 135 GLN N N 135 114.799 114.799 117.127 -2.328 25757 6597 1 8 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.284 -0.420 25757 6598 1 8 . 1 1 135 135 GLN C C 135 174.760 174.760 174.849 -0.089 25757 6599 1 8 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.220 -0.899 25757 6600 1 8 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.078 -1.013 25757 6601 1 8 . 1 1 135 135 GLN H H 135 7.975 7.975 8.733 -0.758 25757 6602 1 8 . 1 1 136 136 VAL N N 136 125.364 125.364 124.176 1.188 25757 6603 1 8 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.721 0.487 25757 6604 1 8 . 1 1 136 136 VAL C C 136 175.831 175.831 175.550 0.281 25757 6605 1 8 . 1 1 136 136 VAL CA C 136 61.817 61.817 60.913 0.904 25757 6606 1 8 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.096 0.578 25757 6607 1 8 . 1 1 136 136 VAL H H 136 9.169 9.169 9.022 0.147 25757 6608 1 8 . 1 1 137 137 ASN N N 137 129.155 129.155 124.761 4.394 25757 6609 1 8 . 1 1 137 137 ASN C C 137 174.737 174.737 175.601 -0.864 25757 6610 1 8 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.398 -0.047 25757 6611 1 8 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.743 -3.421 25757 6612 1 8 . 1 1 137 137 ASN H H 137 9.652 9.652 8.003 1.649 25757 6613 1 8 . 1 1 138 138 TYR N N 138 118.504 118.504 122.171 -3.667 25757 6614 1 8 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.435 -0.156 25757 6615 1 8 . 1 1 138 138 TYR C C 138 176.174 176.174 177.264 -1.090 25757 6616 1 8 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.281 1.293 25757 6617 1 8 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.085 -0.355 25757 6618 1 8 . 1 1 138 138 TYR H H 138 8.460 8.460 8.565 -0.105 25757 6619 1 8 . 1 1 139 139 GLU N N 139 118.644 118.644 118.671 -0.027 25757 6620 1 8 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.713 -0.165 25757 6621 1 8 . 1 1 139 139 GLU C C 139 180.265 180.265 178.559 1.706 25757 6622 1 8 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.839 0.647 25757 6623 1 8 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.007 -0.016 25757 6624 1 8 . 1 1 139 139 GLU H H 139 8.136 8.136 8.031 0.105 25757 6625 1 8 . 1 1 140 140 GLU N N 140 120.030 120.030 117.008 3.022 25757 6626 1 8 . 1 1 140 140 GLU HA H 140 3.888 3.888 3.999 -0.111 25757 6627 1 8 . 1 1 140 140 GLU C C 140 179.627 179.627 178.038 1.589 25757 6628 1 8 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.217 0.460 25757 6629 1 8 . 1 1 140 140 GLU CB C 140 29.727 29.727 28.724 1.002 25757 6630 1 8 . 1 1 140 140 GLU H H 140 8.798 8.798 8.226 0.572 25757 6631 1 8 . 1 1 141 141 PHE N N 141 123.154 123.154 122.333 0.821 25757 6632 1 8 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.833 -0.136 25757 6633 1 8 . 1 1 141 141 PHE C C 141 176.952 176.952 177.990 -1.038 25757 6634 1 8 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.935 1.117 25757 6635 1 8 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.302 0.829 25757 6636 1 8 . 1 1 141 141 PHE H H 141 8.633 8.633 8.051 0.582 25757 6637 1 8 . 1 1 142 142 VAL N N 142 120.046 120.046 116.771 3.275 25757 6638 1 8 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.667 -0.711 25757 6639 1 8 . 1 1 142 142 VAL C C 142 179.627 179.627 177.577 2.050 25757 6640 1 8 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.976 1.267 25757 6641 1 8 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.302 -0.163 25757 6642 1 8 . 1 1 142 142 VAL H H 142 8.894 8.894 7.916 0.978 25757 6643 1 8 . 1 1 143 143 GLN N N 143 118.996 118.996 119.840 -0.844 25757 6644 1 8 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.984 -0.208 25757 6645 1 8 . 1 1 143 143 GLN C C 143 178.443 178.443 177.707 0.736 25757 6646 1 8 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.381 0.748 25757 6647 1 8 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.197 -0.454 25757 6648 1 8 . 1 1 143 143 GLN H H 143 7.627 7.627 7.300 0.327 25757 6649 1 8 . 1 1 144 144 MET N N 144 116.361 116.361 118.410 -2.049 25757 6650 1 8 . 1 1 144 144 MET HA H 144 4.169 4.169 4.062 0.107 25757 6651 1 8 . 1 1 144 144 MET C C 144 178.418 178.418 177.019 1.399 25757 6652 1 8 . 1 1 144 144 MET CA C 144 56.137 56.137 57.869 -1.732 25757 6653 1 8 . 1 1 144 144 MET CB C 144 31.095 31.095 32.348 -1.253 25757 6654 1 8 . 1 1 144 144 MET H H 144 7.179 7.179 7.398 -0.219 25757 6655 1 8 . 1 1 145 145 MET N N 145 115.373 115.373 116.772 -1.399 25757 6656 1 8 . 1 1 145 145 MET HA H 145 4.334 4.334 4.548 -0.214 25757 6657 1 8 . 1 1 145 145 MET C C 145 177.217 177.217 176.045 1.172 25757 6658 1 8 . 1 1 145 145 MET CA C 145 55.296 55.296 55.183 0.113 25757 6659 1 8 . 1 1 145 145 MET CB C 145 34.458 34.458 32.816 1.642 25757 6660 1 8 . 1 1 145 145 MET H H 145 7.776 7.776 7.600 0.176 25757 6661 1 8 . 1 1 146 146 THR N N 146 107.988 107.988 111.178 -3.190 25757 6662 1 8 . 1 1 146 146 THR HA H 146 4.239 4.239 4.444 -0.205 25757 6663 1 8 . 1 1 146 146 THR C C 146 175.378 175.378 174.952 0.426 25757 6664 1 8 . 1 1 146 146 THR CA C 146 61.625 61.625 61.589 0.036 25757 6665 1 8 . 1 1 146 146 THR CB C 146 70.817 70.817 69.007 1.810 25757 6666 1 8 . 1 1 146 146 THR H H 146 7.736 7.736 7.725 0.011 25757 6667 1 8 . 1 1 147 147 GLY N N 147 110.157 110.157 109.728 0.429 25757 6668 1 8 . 1 1 147 147 GLY C C 147 174.046 174.046 173.949 0.097 25757 6669 1 8 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.675 0.869 25757 6670 1 8 . 1 1 147 147 GLY H H 147 7.793 7.793 7.958 -0.166 25757 6671 1 8 . 1 1 150 150 THR HA H 150 4.239 4.239 4.388 -0.149 25757 6672 1 8 . 1 1 150 150 THR C C 150 174.397 174.397 174.129 0.268 25757 6673 1 8 . 1 1 150 150 THR CA C 150 61.260 61.260 62.822 -1.562 25757 6674 1 8 . 1 1 150 150 THR CB C 150 70.358 70.358 69.538 0.820 25757 6675 1 8 . 1 1 151 151 ALA N N 151 126.304 126.304 123.163 3.141 25757 6676 1 8 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.406 -0.118 25757 6677 1 8 . 1 1 151 151 ALA C C 151 177.678 177.678 177.423 0.255 25757 6678 1 8 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.651 0.497 25757 6679 1 8 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.840 -0.421 25757 6680 1 8 . 1 1 151 151 ALA H H 151 8.618 8.618 7.411 1.207 25757 6681 1 8 . 1 1 152 152 ALA N N 152 123.861 123.861 121.386 2.475 25757 6682 1 8 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.302 -0.184 25757 6683 1 8 . 1 1 152 152 ALA C C 152 178.823 178.823 178.316 0.507 25757 6684 1 8 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.575 1.919 25757 6685 1 8 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.163 0.594 25757 6686 1 8 . 1 1 152 152 ALA H H 152 8.354 8.354 8.670 -0.316 25757 6687 1 8 . 1 1 153 153 GLY N N 153 109.984 109.984 107.307 2.677 25757 6688 1 8 . 1 1 153 153 GLY C C 153 174.389 174.389 175.581 -1.192 25757 6689 1 8 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.095 -1.964 25757 6690 1 8 . 1 1 153 153 GLY H H 153 9.028 9.028 8.096 0.932 25757 6691 1 8 . 1 1 154 154 SER N N 154 113.934 113.934 118.696 -4.762 25757 6692 1 8 . 1 1 154 154 SER HA H 154 4.255 4.255 3.969 0.286 25757 6693 1 8 . 1 1 154 154 SER C C 154 177.929 177.929 176.633 1.296 25757 6694 1 8 . 1 1 154 154 SER CA C 154 59.379 59.379 62.592 -3.213 25757 6695 1 8 . 1 1 154 154 SER CB C 154 64.090 64.090 62.558 1.532 25757 6696 1 8 . 1 1 154 154 SER H H 154 7.962 7.962 8.114 -0.152 25757 6697 1 8 . 1 1 155 155 GLY N N 155 115.337 115.337 108.879 6.458 25757 6698 1 8 . 1 1 155 155 GLY C C 155 175.891 175.891 175.480 0.411 25757 6699 1 8 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.611 1.034 25757 6700 1 8 . 1 1 155 155 GLY H H 155 9.451 9.451 7.662 1.789 25757 6701 1 8 . 1 1 156 156 TRP N N 156 119.600 119.600 121.731 -2.131 25757 6702 1 8 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.247 0.024 25757 6703 1 8 . 1 1 156 156 TRP C C 156 178.947 178.947 178.841 0.106 25757 6704 1 8 . 1 1 156 156 TRP CA C 156 60.164 60.164 59.803 0.361 25757 6705 1 8 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.080 0.523 25757 6706 1 8 . 1 1 156 156 TRP H H 156 8.542 8.542 7.265 1.277 25757 6707 1 8 . 1 1 157 157 ARG N N 157 118.583 118.583 120.328 -1.745 25757 6708 1 8 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.099 -0.117 25757 6709 1 8 . 1 1 157 157 ARG C C 157 177.894 177.894 177.796 0.098 25757 6710 1 8 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.242 0.097 25757 6711 1 8 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.911 0.146 25757 6712 1 8 . 1 1 157 157 ARG H H 157 7.747 7.747 8.354 -0.607 25757 6713 1 8 . 1 1 158 158 LYS N N 158 117.033 117.033 119.630 -2.597 25757 6714 1 8 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.870 0.073 25757 6715 1 8 . 1 1 158 158 LYS C C 158 176.973 176.973 179.092 -2.119 25757 6716 1 8 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.617 0.757 25757 6717 1 8 . 1 1 158 158 LYS CB C 158 32.291 32.291 31.732 0.559 25757 6718 1 8 . 1 1 158 158 LYS H H 158 7.529 7.529 8.011 -0.482 25757 6719 1 8 . 1 1 159 159 ILE N N 159 116.553 116.553 120.731 -4.178 25757 6720 1 8 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.743 -0.199 25757 6721 1 8 . 1 1 159 159 ILE C C 159 176.894 176.894 177.217 -0.323 25757 6722 1 8 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.535 0.981 25757 6723 1 8 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.022 -0.218 25757 6724 1 8 . 1 1 159 159 ILE H H 159 7.348 7.348 8.214 -0.866 25757 6725 1 8 . 1 1 160 160 LYS N N 160 119.278 119.278 120.718 -1.440 25757 6726 1 8 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.315 -0.276 25757 6727 1 8 . 1 1 160 160 LYS C C 160 178.566 178.566 179.292 -0.726 25757 6728 1 8 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.927 0.447 25757 6729 1 8 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.518 0.300 25757 6730 1 8 . 1 1 160 160 LYS H H 160 8.225 8.225 7.853 0.372 25757 6731 1 8 . 1 1 161 161 LEU N N 161 117.056 117.056 119.860 -2.804 25757 6732 1 8 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.131 -0.071 25757 6733 1 8 . 1 1 161 161 LEU C C 161 178.977 178.977 179.004 -0.027 25757 6734 1 8 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.058 -0.034 25757 6735 1 8 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.985 -0.003 25757 6736 1 8 . 1 1 161 161 LEU H H 161 8.057 8.057 8.604 -0.547 25757 6737 1 8 . 1 1 162 162 ALA N N 162 121.814 121.814 121.764 0.050 25757 6738 1 8 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.002 0.090 25757 6739 1 8 . 1 1 162 162 ALA C C 162 178.374 178.374 180.012 -1.638 25757 6740 1 8 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.208 0.582 25757 6741 1 8 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.523 -0.198 25757 6742 1 8 . 1 1 162 162 ALA H H 162 8.170 8.170 8.168 0.002 25757 6743 1 8 . 1 1 163 163 VAL N N 163 115.449 115.449 114.319 1.130 25757 6744 1 8 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.998 -0.380 25757 6745 1 8 . 1 1 163 163 VAL C C 163 178.362 178.362 177.612 0.750 25757 6746 1 8 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.424 0.848 25757 6747 1 8 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.465 0.572 25757 6748 1 8 . 1 1 163 163 VAL H H 163 8.499 8.499 8.223 0.276 25757 6749 1 8 . 1 1 164 164 ARG N N 164 115.775 115.775 121.058 -5.283 25757 6750 1 8 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.314 -0.117 25757 6751 1 8 . 1 1 164 164 ARG C C 164 178.938 178.938 177.686 1.252 25757 6752 1 8 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.133 -1.450 25757 6753 1 8 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.817 -0.983 25757 6754 1 8 . 1 1 164 164 ARG H H 164 8.165 8.165 8.359 -0.194 25757 6755 1 8 . 1 1 165 165 GLY N N 165 105.570 105.570 105.792 -0.222 25757 6756 1 8 . 1 1 165 165 GLY C C 165 173.134 173.134 175.100 -1.966 25757 6757 1 8 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.611 1.131 25757 6758 1 8 . 1 1 165 165 GLY H H 165 8.455 8.455 8.216 0.239 25757 6759 1 8 . 1 1 166 166 ALA N N 166 120.648 120.648 122.580 -1.932 25757 6760 1 8 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.190 0.152 25757 6761 1 8 . 1 1 166 166 ALA C C 166 176.155 176.155 177.803 -1.648 25757 6762 1 8 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.756 -1.983 25757 6763 1 8 . 1 1 166 166 ALA CB C 166 19.478 19.478 18.985 0.493 25757 6764 1 8 . 1 1 166 166 ALA H H 166 7.826 7.826 8.003 -0.177 25757 6765 1 8 . 1 1 167 167 GLN N N 167 117.315 117.315 118.395 -1.080 25757 6766 1 8 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.284 -0.007 25757 6767 1 8 . 1 1 167 167 GLN C C 167 175.571 175.571 175.050 0.521 25757 6768 1 8 . 1 1 167 167 GLN CA C 167 55.927 55.927 55.852 0.075 25757 6769 1 8 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.071 0.114 25757 6770 1 8 . 1 1 167 167 GLN H H 167 7.498 7.498 7.726 -0.228 25757 6771 1 8 . 1 1 168 168 ALA N N 168 126.706 126.706 125.152 1.554 25757 6772 1 8 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.435 -0.156 25757 6773 1 8 . 1 1 168 168 ALA C C 168 177.227 177.227 176.451 0.776 25757 6774 1 8 . 1 1 168 168 ALA CA C 168 52.066 52.066 50.757 1.310 25757 6775 1 8 . 1 1 168 168 ALA CB C 168 19.706 19.706 20.171 -0.465 25757 6776 1 8 . 1 1 168 168 ALA H H 168 8.534 8.534 8.194 0.340 25757 6777 1 9 . 1 1 9 9 ILE N N 9 116.733 116.733 122.027 -5.294 25757 6778 1 9 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.896 -0.139 25757 6779 1 9 . 1 1 9 9 ILE C C 9 177.828 177.828 177.382 0.446 25757 6780 1 9 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.681 2.923 25757 6781 1 9 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.135 0.463 25757 6782 1 9 . 1 1 9 9 ILE H H 9 7.366 7.366 8.221 -0.855 25757 6783 1 9 . 1 1 10 10 ALA N N 10 121.080 121.080 122.767 -1.687 25757 6784 1 9 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.976 0.099 25757 6785 1 9 . 1 1 10 10 ALA C C 10 180.921 180.921 179.437 1.484 25757 6786 1 9 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.221 0.382 25757 6787 1 9 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.775 0.209 25757 6788 1 9 . 1 1 10 10 ALA H H 10 8.039 8.039 8.337 -0.298 25757 6789 1 9 . 1 1 11 11 GLU N N 11 119.580 119.580 118.909 0.671 25757 6790 1 9 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.912 0.177 25757 6791 1 9 . 1 1 11 11 GLU C C 11 179.561 179.561 179.073 0.488 25757 6792 1 9 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.401 0.484 25757 6793 1 9 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.166 0.297 25757 6794 1 9 . 1 1 11 11 GLU H H 11 7.741 7.741 7.671 0.070 25757 6795 1 9 . 1 1 12 12 PHE N N 12 118.509 118.509 116.788 1.721 25757 6796 1 9 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.435 0.391 25757 6797 1 9 . 1 1 12 12 PHE C C 12 179.000 179.000 178.430 0.570 25757 6798 1 9 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.343 0.821 25757 6799 1 9 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.043 0.067 25757 6800 1 9 . 1 1 12 12 PHE H H 12 8.470 8.470 6.940 1.530 25757 6801 1 9 . 1 1 13 13 LYS N N 13 123.523 123.523 120.203 3.320 25757 6802 1 9 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.086 -0.060 25757 6803 1 9 . 1 1 13 13 LYS C C 13 179.260 179.260 178.997 0.263 25757 6804 1 9 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.861 0.303 25757 6805 1 9 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.241 -0.408 25757 6806 1 9 . 1 1 13 13 LYS H H 13 9.171 9.171 8.437 0.734 25757 6807 1 9 . 1 1 14 14 GLU N N 14 120.415 120.415 118.965 1.450 25757 6808 1 9 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.234 -0.139 25757 6809 1 9 . 1 1 14 14 GLU C C 14 179.851 179.851 178.814 1.037 25757 6810 1 9 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.127 0.459 25757 6811 1 9 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.426 0.135 25757 6812 1 9 . 1 1 14 14 GLU H H 14 7.822 7.822 8.258 -0.436 25757 6813 1 9 . 1 1 15 15 ALA N N 15 122.143 122.143 122.364 -0.221 25757 6814 1 9 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.233 -0.103 25757 6815 1 9 . 1 1 15 15 ALA C C 15 178.222 178.222 179.610 -1.388 25757 6816 1 9 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.261 -0.071 25757 6817 1 9 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.722 -0.220 25757 6818 1 9 . 1 1 15 15 ALA H H 15 8.244 8.244 8.186 0.058 25757 6819 1 9 . 1 1 16 16 PHE N N 16 119.809 119.809 118.699 1.110 25757 6820 1 9 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.516 -0.504 25757 6821 1 9 . 1 1 16 16 PHE C C 16 177.444 177.444 177.008 0.436 25757 6822 1 9 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.081 1.983 25757 6823 1 9 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.235 -0.803 25757 6824 1 9 . 1 1 16 16 PHE H H 16 8.891 8.891 8.528 0.363 25757 6825 1 9 . 1 1 17 17 SER N N 17 112.631 112.631 116.545 -3.914 25757 6826 1 9 . 1 1 17 17 SER HA H 17 4.034 4.034 4.026 0.008 25757 6827 1 9 . 1 1 17 17 SER C C 17 174.675 174.675 176.100 -1.425 25757 6828 1 9 . 1 1 17 17 SER CA C 17 61.507 61.507 62.023 -0.516 25757 6829 1 9 . 1 1 17 17 SER CB C 17 63.414 63.414 63.577 -0.163 25757 6830 1 9 . 1 1 17 17 SER H H 17 7.910 7.910 8.467 -0.557 25757 6831 1 9 . 1 1 18 18 LEU N N 18 120.614 120.614 117.469 3.145 25757 6832 1 9 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.227 -0.215 25757 6833 1 9 . 1 1 18 18 LEU C C 18 177.366 177.366 177.797 -0.431 25757 6834 1 9 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.163 0.224 25757 6835 1 9 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.758 -0.163 25757 6836 1 9 . 1 1 18 18 LEU H H 18 7.423 7.423 7.934 -0.511 25757 6837 1 9 . 1 1 19 19 PHE N N 19 114.602 114.602 118.335 -3.733 25757 6838 1 9 . 1 1 19 19 PHE C C 19 176.961 176.961 175.823 1.138 25757 6839 1 9 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.566 -1.082 25757 6840 1 9 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.948 0.821 25757 6841 1 9 . 1 1 19 19 PHE H H 19 7.254 7.254 7.240 0.014 25757 6842 1 9 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.689 -0.114 25757 6843 1 9 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.029 -1.381 25757 6844 1 9 . 1 1 22 22 ASP CB C 22 40.010 40.010 41.036 -1.026 25757 6845 1 9 . 1 1 23 23 GLY N N 23 108.244 108.244 109.050 -0.806 25757 6846 1 9 . 1 1 23 23 GLY C C 23 175.188 175.188 174.892 0.296 25757 6847 1 9 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.146 1.257 25757 6848 1 9 . 1 1 23 23 GLY H H 23 7.555 7.555 7.932 -0.377 25757 6849 1 9 . 1 1 24 24 ASP N N 24 120.667 120.667 119.707 0.960 25757 6850 1 9 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.510 -0.041 25757 6851 1 9 . 1 1 24 24 ASP C C 24 177.457 177.457 177.874 -0.417 25757 6852 1 9 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.629 0.163 25757 6853 1 9 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.442 -0.926 25757 6854 1 9 . 1 1 24 24 ASP H H 24 8.397 8.397 7.961 0.436 25757 6855 1 9 . 1 1 25 25 GLY N N 25 112.989 112.989 108.174 4.815 25757 6856 1 9 . 1 1 25 25 GLY C C 25 173.639 173.639 173.231 0.408 25757 6857 1 9 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.112 0.389 25757 6858 1 9 . 1 1 25 25 GLY H H 25 10.592 10.592 8.807 1.785 25757 6859 1 9 . 1 1 26 26 THR N N 26 112.948 112.948 110.767 2.181 25757 6860 1 9 . 1 1 26 26 THR HA H 26 5.282 5.282 5.021 0.261 25757 6861 1 9 . 1 1 26 26 THR C C 26 172.853 172.853 172.773 0.080 25757 6862 1 9 . 1 1 26 26 THR CA C 26 59.817 59.817 60.057 -0.240 25757 6863 1 9 . 1 1 26 26 THR CB C 26 72.465 72.465 72.286 0.179 25757 6864 1 9 . 1 1 26 26 THR H H 26 8.121 8.121 8.186 -0.065 25757 6865 1 9 . 1 1 27 27 ILE N N 27 127.195 127.195 120.365 6.830 25757 6866 1 9 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.431 0.482 25757 6867 1 9 . 1 1 27 27 ILE C C 27 176.091 176.091 175.227 0.864 25757 6868 1 9 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.453 0.312 25757 6869 1 9 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.236 -1.530 25757 6870 1 9 . 1 1 27 27 ILE H H 27 9.867 9.867 8.351 1.516 25757 6871 1 9 . 1 1 28 28 THR N N 28 116.655 116.655 119.746 -3.091 25757 6872 1 9 . 1 1 28 28 THR HA H 28 4.790 4.790 4.761 0.029 25757 6873 1 9 . 1 1 28 28 THR C C 28 176.696 176.696 176.148 0.548 25757 6874 1 9 . 1 1 28 28 THR CA C 28 59.590 59.590 60.051 -0.461 25757 6875 1 9 . 1 1 28 28 THR CB C 28 72.457 72.457 70.704 1.753 25757 6876 1 9 . 1 1 28 28 THR H H 28 8.457 8.457 8.483 -0.026 25757 6877 1 9 . 1 1 29 29 THR N N 29 111.878 111.878 117.051 -5.173 25757 6878 1 9 . 1 1 29 29 THR HA H 29 4.188 4.188 3.981 0.207 25757 6879 1 9 . 1 1 29 29 THR C C 29 177.399 177.399 176.402 0.997 25757 6880 1 9 . 1 1 29 29 THR CA C 29 66.386 66.386 66.907 -0.521 25757 6881 1 9 . 1 1 29 29 THR CB C 29 67.726 67.726 68.539 -0.813 25757 6882 1 9 . 1 1 29 29 THR H H 29 9.211 9.211 9.003 0.208 25757 6883 1 9 . 1 1 30 30 LYS N N 30 121.140 121.140 121.421 -0.281 25757 6884 1 9 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.909 0.168 25757 6885 1 9 . 1 1 30 30 LYS C C 30 179.793 179.793 178.650 1.143 25757 6886 1 9 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.844 -0.552 25757 6887 1 9 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.299 0.148 25757 6888 1 9 . 1 1 30 30 LYS H H 30 7.580 7.580 8.041 -0.461 25757 6889 1 9 . 1 1 31 31 GLU N N 31 121.865 121.865 119.885 1.980 25757 6890 1 9 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.968 0.026 25757 6891 1 9 . 1 1 31 31 GLU C C 31 179.355 179.355 178.857 0.498 25757 6892 1 9 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.785 -0.152 25757 6893 1 9 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.605 0.247 25757 6894 1 9 . 1 1 31 31 GLU H H 31 7.708 7.708 7.468 0.240 25757 6895 1 9 . 1 1 32 32 LEU N N 32 120.597 120.597 118.332 2.265 25757 6896 1 9 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.304 -0.188 25757 6897 1 9 . 1 1 32 32 LEU C C 32 178.885 178.885 179.323 -0.438 25757 6898 1 9 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.645 -0.284 25757 6899 1 9 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.091 1.945 25757 6900 1 9 . 1 1 32 32 LEU H H 32 8.688 8.688 7.811 0.877 25757 6901 1 9 . 1 1 33 33 GLY N N 33 104.837 104.837 107.088 -2.251 25757 6902 1 9 . 1 1 33 33 GLY C C 33 175.123 175.123 175.988 -0.865 25757 6903 1 9 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.726 0.521 25757 6904 1 9 . 1 1 33 33 GLY H H 33 8.694 8.694 8.805 -0.111 25757 6905 1 9 . 1 1 34 34 THR N N 34 117.631 117.631 118.920 -1.289 25757 6906 1 9 . 1 1 34 34 THR HA H 34 3.899 3.899 4.020 -0.121 25757 6907 1 9 . 1 1 34 34 THR C C 34 176.951 176.951 176.746 0.205 25757 6908 1 9 . 1 1 34 34 THR CA C 34 67.234 67.234 66.327 0.907 25757 6909 1 9 . 1 1 34 34 THR CB C 34 68.863 68.863 68.455 0.408 25757 6910 1 9 . 1 1 34 34 THR H H 34 7.960 7.960 7.825 0.135 25757 6911 1 9 . 1 1 35 35 VAL N N 35 121.659 121.659 122.056 -0.397 25757 6912 1 9 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.557 -0.040 25757 6913 1 9 . 1 1 35 35 VAL C C 35 178.265 178.265 176.958 1.307 25757 6914 1 9 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.467 0.208 25757 6915 1 9 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.389 -0.096 25757 6916 1 9 . 1 1 35 35 VAL H H 35 7.358 7.358 8.089 -0.731 25757 6917 1 9 . 1 1 36 36 MET N N 36 117.456 117.456 114.766 2.690 25757 6918 1 9 . 1 1 36 36 MET C C 36 179.088 179.088 178.885 0.203 25757 6919 1 9 . 1 1 36 36 MET CA C 36 60.477 60.477 58.467 2.010 25757 6920 1 9 . 1 1 36 36 MET CB C 36 32.443 32.443 32.381 0.062 25757 6921 1 9 . 1 1 36 36 MET H H 36 8.194 8.194 8.005 0.189 25757 6922 1 9 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.629 0.518 25757 6923 1 9 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.277 0.073 25757 6924 1 9 . 1 1 38 38 SER HA H 38 4.085 4.085 4.335 -0.250 25757 6925 1 9 . 1 1 38 38 SER C C 38 173.788 173.788 174.644 -0.856 25757 6926 1 9 . 1 1 38 38 SER CA C 38 61.617 61.617 58.374 3.243 25757 6927 1 9 . 1 1 38 38 SER CB C 38 62.943 62.943 62.943 -0.000 25757 6928 1 9 . 1 1 39 39 LEU N N 39 119.003 119.003 121.293 -2.290 25757 6929 1 9 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.387 0.107 25757 6930 1 9 . 1 1 39 39 LEU C C 39 176.470 176.470 176.425 0.045 25757 6931 1 9 . 1 1 39 39 LEU CA C 39 53.679 53.679 52.967 0.712 25757 6932 1 9 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.509 0.005 25757 6933 1 9 . 1 1 39 39 LEU H H 39 7.230 7.230 7.165 0.065 25757 6934 1 9 . 1 1 40 40 GLY N N 40 105.026 105.026 105.782 -0.756 25757 6935 1 9 . 1 1 40 40 GLY C C 40 174.322 174.322 173.997 0.325 25757 6936 1 9 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.222 0.993 25757 6937 1 9 . 1 1 40 40 GLY H H 40 7.698 7.698 7.583 0.115 25757 6938 1 9 . 1 1 41 41 GLN N N 41 117.929 117.929 118.451 -0.522 25757 6939 1 9 . 1 1 41 41 GLN C C 41 174.557 174.557 174.262 0.295 25757 6940 1 9 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.298 -0.454 25757 6941 1 9 . 1 1 41 41 GLN H H 41 7.866 7.866 7.508 0.358 25757 6942 1 9 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.479 0.257 25757 6943 1 9 . 1 1 43 43 PRO C C 43 177.805 177.805 175.924 1.881 25757 6944 1 9 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.750 -0.245 25757 6945 1 9 . 1 1 43 43 PRO CB C 43 32.162 32.162 33.754 -1.591 25757 6946 1 9 . 1 1 44 44 THR N N 44 113.167 113.167 114.357 -1.190 25757 6947 1 9 . 1 1 44 44 THR HA H 44 4.684 4.684 4.507 0.177 25757 6948 1 9 . 1 1 44 44 THR C C 44 175.139 175.139 175.961 -0.822 25757 6949 1 9 . 1 1 44 44 THR CA C 44 60.556 60.556 59.286 1.270 25757 6950 1 9 . 1 1 44 44 THR CB C 44 71.064 71.064 70.904 0.160 25757 6951 1 9 . 1 1 44 44 THR H H 44 8.798 8.798 8.338 0.460 25757 6952 1 9 . 1 1 45 45 GLU N N 45 120.673 120.673 121.257 -0.584 25757 6953 1 9 . 1 1 45 45 GLU HA H 45 3.991 3.991 4.126 -0.135 25757 6954 1 9 . 1 1 45 45 GLU C C 45 178.940 178.940 177.792 1.148 25757 6955 1 9 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.024 0.877 25757 6956 1 9 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.721 -0.692 25757 6957 1 9 . 1 1 45 45 GLU H H 45 8.812 8.812 8.977 -0.165 25757 6958 1 9 . 1 1 46 46 ALA N N 46 120.576 120.576 123.086 -2.510 25757 6959 1 9 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.041 -0.074 25757 6960 1 9 . 1 1 46 46 ALA C C 46 180.290 180.290 179.492 0.798 25757 6961 1 9 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.795 -0.876 25757 6962 1 9 . 1 1 46 46 ALA CB C 46 18.161 18.161 17.823 0.338 25757 6963 1 9 . 1 1 46 46 ALA H H 46 8.276 8.276 7.724 0.552 25757 6964 1 9 . 1 1 47 47 GLU N N 47 116.104 116.104 118.113 -2.009 25757 6965 1 9 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.017 -0.017 25757 6966 1 9 . 1 1 47 47 GLU C C 47 180.224 180.224 179.088 1.136 25757 6967 1 9 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.447 -0.516 25757 6968 1 9 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.169 0.820 25757 6969 1 9 . 1 1 47 47 GLU H H 47 7.425 7.425 8.575 -1.150 25757 6970 1 9 . 1 1 48 48 LEU N N 48 120.425 120.425 119.720 0.705 25757 6971 1 9 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.924 0.126 25757 6972 1 9 . 1 1 48 48 LEU C C 48 178.551 178.551 178.982 -0.431 25757 6973 1 9 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.015 -0.176 25757 6974 1 9 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.175 1.394 25757 6975 1 9 . 1 1 48 48 LEU H H 48 8.121 8.121 7.233 0.888 25757 6976 1 9 . 1 1 49 49 GLN N N 49 118.372 118.372 118.838 -0.466 25757 6977 1 9 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.897 -0.135 25757 6978 1 9 . 1 1 49 49 GLN C C 49 178.567 178.567 178.192 0.375 25757 6979 1 9 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.791 0.072 25757 6980 1 9 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.062 0.180 25757 6981 1 9 . 1 1 49 49 GLN H H 49 8.302 8.302 8.291 0.011 25757 6982 1 9 . 1 1 50 50 ASP N N 50 119.992 119.992 119.861 0.131 25757 6983 1 9 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.335 0.025 25757 6984 1 9 . 1 1 50 50 ASP C C 50 178.600 178.600 178.385 0.215 25757 6985 1 9 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.385 0.318 25757 6986 1 9 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.883 -0.416 25757 6987 1 9 . 1 1 50 50 ASP H H 50 8.150 8.150 8.362 -0.212 25757 6988 1 9 . 1 1 51 51 MET N N 51 119.238 119.238 119.257 -0.019 25757 6989 1 9 . 1 1 51 51 MET HA H 51 3.981 3.981 4.074 -0.093 25757 6990 1 9 . 1 1 51 51 MET C C 51 179.006 179.006 178.614 0.392 25757 6991 1 9 . 1 1 51 51 MET CA C 51 59.443 59.443 58.600 0.843 25757 6992 1 9 . 1 1 51 51 MET CB C 51 33.380 33.380 32.516 0.864 25757 6993 1 9 . 1 1 51 51 MET H H 51 7.844 7.844 7.954 -0.110 25757 6994 1 9 . 1 1 52 52 ILE N N 52 118.161 118.161 118.428 -0.267 25757 6995 1 9 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.597 -0.119 25757 6996 1 9 . 1 1 52 52 ILE C C 52 177.847 177.847 178.687 -0.840 25757 6997 1 9 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.707 0.288 25757 6998 1 9 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.446 0.677 25757 6999 1 9 . 1 1 52 52 ILE H H 52 7.686 7.686 8.216 -0.530 25757 7000 1 9 . 1 1 53 53 ASN N N 53 117.884 117.884 117.735 0.149 25757 7001 1 9 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.416 -0.051 25757 7002 1 9 . 1 1 53 53 ASN C C 53 177.515 177.515 177.737 -0.222 25757 7003 1 9 . 1 1 53 53 ASN CA C 53 56.207 56.207 56.005 0.202 25757 7004 1 9 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.542 -0.464 25757 7005 1 9 . 1 1 53 53 ASN H H 53 8.713 8.713 8.447 0.266 25757 7006 1 9 . 1 1 54 54 GLU N N 54 116.178 116.178 118.556 -2.378 25757 7007 1 9 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.250 -0.261 25757 7008 1 9 . 1 1 54 54 GLU C C 54 177.557 177.557 177.021 0.536 25757 7009 1 9 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.797 1.193 25757 7010 1 9 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.273 0.190 25757 7011 1 9 . 1 1 54 54 GLU H H 54 7.530 7.530 8.054 -0.524 25757 7012 1 9 . 1 1 55 55 VAL N N 55 107.164 107.164 111.124 -3.960 25757 7013 1 9 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.332 0.190 25757 7014 1 9 . 1 1 55 55 VAL C C 55 175.602 175.602 174.251 1.351 25757 7015 1 9 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.384 -0.032 25757 7016 1 9 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.854 0.750 25757 7017 1 9 . 1 1 55 55 VAL H H 55 7.175 7.175 7.469 -0.294 25757 7018 1 9 . 1 1 56 56 ASP N N 56 122.126 122.126 120.237 1.889 25757 7019 1 9 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.180 -0.581 25757 7020 1 9 . 1 1 56 56 ASP C C 56 176.182 176.182 175.749 0.433 25757 7021 1 9 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.120 0.686 25757 7022 1 9 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.748 -2.478 25757 7023 1 9 . 1 1 56 56 ASP H H 56 7.569 7.569 7.381 0.188 25757 7024 1 9 . 1 1 57 57 ALA N N 57 103.782 103.782 128.520 -24.738 25757 7025 1 9 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.356 -0.176 25757 7026 1 9 . 1 1 57 57 ALA C C 57 178.584 178.584 178.006 0.578 25757 7027 1 9 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.093 1.251 25757 7028 1 9 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.692 -0.168 25757 7029 1 9 . 1 1 57 57 ALA H H 57 8.515 8.515 8.576 -0.061 25757 7030 1 9 . 1 1 58 58 ASP N N 58 113.602 113.602 119.949 -6.347 25757 7031 1 9 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.557 0.029 25757 7032 1 9 . 1 1 58 58 ASP C C 58 177.756 177.756 177.130 0.626 25757 7033 1 9 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.751 -1.989 25757 7034 1 9 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.257 -1.579 25757 7035 1 9 . 1 1 58 58 ASP H H 58 8.130 8.130 8.036 0.094 25757 7036 1 9 . 1 1 59 59 GLY N N 59 109.195 109.195 108.221 0.974 25757 7037 1 9 . 1 1 59 59 GLY C C 59 175.139 175.139 174.375 0.764 25757 7038 1 9 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.112 2.152 25757 7039 1 9 . 1 1 59 59 GLY H H 59 7.694 7.694 8.699 -1.005 25757 7040 1 9 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.820 -0.215 25757 7041 1 9 . 1 1 61 61 GLY N N 61 113.316 113.316 109.857 3.459 25757 7042 1 9 . 1 1 61 61 GLY C C 61 173.234 173.234 173.289 -0.055 25757 7043 1 9 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.320 -0.622 25757 7044 1 9 . 1 1 61 61 GLY H H 61 10.633 10.633 8.462 2.171 25757 7045 1 9 . 1 1 62 62 THR N N 62 108.892 108.892 110.060 -1.168 25757 7046 1 9 . 1 1 62 62 THR HA H 62 4.736 4.736 4.740 -0.004 25757 7047 1 9 . 1 1 62 62 THR C C 62 173.091 173.091 173.491 -0.400 25757 7048 1 9 . 1 1 62 62 THR CA C 62 59.617 59.617 59.937 -0.320 25757 7049 1 9 . 1 1 62 62 THR CB C 62 72.004 72.004 72.248 -0.244 25757 7050 1 9 . 1 1 62 62 THR H H 62 7.673 7.673 7.712 -0.039 25757 7051 1 9 . 1 1 63 63 ILE N N 63 123.324 123.324 124.510 -1.186 25757 7052 1 9 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.674 0.455 25757 7053 1 9 . 1 1 63 63 ILE C C 63 175.652 175.652 175.508 0.144 25757 7054 1 9 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.598 -0.112 25757 7055 1 9 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.004 -0.047 25757 7056 1 9 . 1 1 63 63 ILE H H 63 8.907 8.907 8.466 0.441 25757 7057 1 9 . 1 1 64 64 ASP N N 64 128.253 128.253 128.108 0.145 25757 7058 1 9 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.650 0.671 25757 7059 1 9 . 1 1 64 64 ASP C C 64 176.431 176.431 177.781 -1.350 25757 7060 1 9 . 1 1 64 64 ASP CA C 64 52.331 52.331 54.007 -1.676 25757 7061 1 9 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.404 -0.350 25757 7062 1 9 . 1 1 64 64 ASP H H 64 8.864 8.864 9.091 -0.227 25757 7063 1 9 . 1 1 65 65 PHE N N 65 118.583 118.583 119.867 -1.284 25757 7064 1 9 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.277 -0.417 25757 7065 1 9 . 1 1 65 65 PHE C C 65 173.458 173.458 175.729 -2.271 25757 7066 1 9 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.007 0.792 25757 7067 1 9 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.089 -1.209 25757 7068 1 9 . 1 1 65 65 PHE H H 65 8.962 8.962 8.608 0.354 25757 7069 1 9 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.314 -0.196 25757 7070 1 9 . 1 1 66 66 PRO C C 66 180.038 180.038 178.622 1.416 25757 7071 1 9 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.211 1.479 25757 7072 1 9 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.209 -0.532 25757 7073 1 9 . 1 1 67 67 GLU N N 67 118.402 118.402 119.841 -1.439 25757 7074 1 9 . 1 1 67 67 GLU C C 67 178.737 178.737 178.731 0.006 25757 7075 1 9 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.672 -0.665 25757 7076 1 9 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.089 0.596 25757 7077 1 9 . 1 1 67 67 GLU H H 67 7.953 7.953 8.048 -0.095 25757 7078 1 9 . 1 1 68 68 PHE N N 68 123.421 123.421 119.498 3.923 25757 7079 1 9 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.137 -0.165 25757 7080 1 9 . 1 1 68 68 PHE C C 68 177.184 177.184 177.465 -0.281 25757 7081 1 9 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.090 0.249 25757 7082 1 9 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.803 1.166 25757 7083 1 9 . 1 1 68 68 PHE H H 68 8.928 8.928 7.526 1.402 25757 7084 1 9 . 1 1 69 69 LEU N N 69 119.284 119.284 120.105 -0.821 25757 7085 1 9 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.706 -0.371 25757 7086 1 9 . 1 1 69 69 LEU C C 69 178.987 178.987 178.287 0.700 25757 7087 1 9 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.820 -0.958 25757 7088 1 9 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.489 -0.657 25757 7089 1 9 . 1 1 69 69 LEU H H 69 8.374 8.374 7.651 0.723 25757 7090 1 9 . 1 1 70 70 THR N N 70 116.017 116.017 115.253 0.764 25757 7091 1 9 . 1 1 70 70 THR HA H 70 4.338 4.338 3.767 0.571 25757 7092 1 9 . 1 1 70 70 THR C C 70 176.169 176.169 176.766 -0.597 25757 7093 1 9 . 1 1 70 70 THR CA C 70 66.700 66.700 66.950 -0.250 25757 7094 1 9 . 1 1 70 70 THR CB C 70 68.379 68.379 68.412 -0.034 25757 7095 1 9 . 1 1 70 70 THR H H 70 7.493 7.493 8.384 -0.891 25757 7096 1 9 . 1 1 71 71 MET N N 71 121.915 121.915 121.453 0.462 25757 7097 1 9 . 1 1 71 71 MET HA H 71 3.718 3.718 3.881 -0.163 25757 7098 1 9 . 1 1 71 71 MET C C 71 178.190 178.190 177.469 0.721 25757 7099 1 9 . 1 1 71 71 MET CA C 71 59.335 59.335 58.977 0.358 25757 7100 1 9 . 1 1 71 71 MET CB C 71 33.894 33.894 32.338 1.556 25757 7101 1 9 . 1 1 71 71 MET H H 71 7.924 7.924 7.941 -0.017 25757 7102 1 9 . 1 1 72 72 MET N N 72 116.973 116.973 117.501 -0.528 25757 7103 1 9 . 1 1 72 72 MET HA H 72 3.968 3.968 3.942 0.026 25757 7104 1 9 . 1 1 72 72 MET C C 72 178.211 178.211 178.592 -0.381 25757 7105 1 9 . 1 1 72 72 MET CA C 72 56.059 56.059 58.875 -2.816 25757 7106 1 9 . 1 1 72 72 MET CB C 72 31.639 31.639 32.793 -1.154 25757 7107 1 9 . 1 1 72 72 MET H H 72 8.276 8.276 7.812 0.464 25757 7108 1 9 . 1 1 73 73 ALA N N 73 122.499 122.499 121.401 1.098 25757 7109 1 9 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.921 0.029 25757 7110 1 9 . 1 1 73 73 ALA C C 73 180.231 180.231 179.610 0.621 25757 7111 1 9 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.950 0.003 25757 7112 1 9 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.850 0.182 25757 7113 1 9 . 1 1 73 73 ALA H H 73 8.240 8.240 8.369 -0.129 25757 7114 1 9 . 1 1 74 74 ARG N N 74 116.098 116.098 119.767 -3.669 25757 7115 1 9 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.035 -0.043 25757 7116 1 9 . 1 1 74 74 ARG C C 74 178.567 178.567 178.412 0.155 25757 7117 1 9 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.244 0.581 25757 7118 1 9 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.628 0.447 25757 7119 1 9 . 1 1 74 74 ARG H H 74 7.420 7.420 8.237 -0.817 25757 7120 1 9 . 1 1 75 75 LYS N N 75 119.046 119.046 119.877 -0.831 25757 7121 1 9 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.111 -0.068 25757 7122 1 9 . 1 1 75 75 LYS C C 75 179.045 179.045 178.124 0.921 25757 7123 1 9 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.225 -0.336 25757 7124 1 9 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.921 -0.155 25757 7125 1 9 . 1 1 75 75 LYS H H 75 7.862 7.862 8.301 -0.439 25757 7126 1 9 . 1 1 76 76 MET N N 76 116.772 116.772 119.057 -2.285 25757 7127 1 9 . 1 1 76 76 MET H H 76 8.099 8.099 8.080 0.019 25757 7128 1 9 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.509 0.125 25757 7129 1 9 . 1 1 78 78 ASP C C 78 176.395 176.395 177.127 -0.732 25757 7130 1 9 . 1 1 78 78 ASP CA C 78 54.644 54.644 55.184 -0.540 25757 7131 1 9 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.983 -0.509 25757 7132 1 9 . 1 1 79 79 THR N N 79 113.904 113.904 115.127 -1.223 25757 7133 1 9 . 1 1 79 79 THR HA H 79 4.215 4.215 4.208 0.007 25757 7134 1 9 . 1 1 79 79 THR C C 79 174.204 174.204 174.533 -0.329 25757 7135 1 9 . 1 1 79 79 THR CA C 79 62.264 62.264 63.666 -1.402 25757 7136 1 9 . 1 1 79 79 THR CB C 79 69.884 69.884 69.363 0.521 25757 7137 1 9 . 1 1 79 79 THR H H 79 8.039 8.039 8.367 -0.328 25757 7138 1 9 . 1 1 80 80 ASP N N 80 123.572 123.572 117.814 5.758 25757 7139 1 9 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.954 -0.234 25757 7140 1 9 . 1 1 80 80 ASP C C 80 176.221 176.221 175.258 0.963 25757 7141 1 9 . 1 1 80 80 ASP CA C 80 54.315 54.315 53.560 0.755 25757 7142 1 9 . 1 1 80 80 ASP CB C 80 41.427 41.427 43.954 -2.527 25757 7143 1 9 . 1 1 80 80 ASP H H 80 8.441 8.441 8.188 0.253 25757 7144 1 9 . 1 1 81 81 SER N N 81 117.879 117.879 114.311 3.568 25757 7145 1 9 . 1 1 81 81 SER HA H 81 3.925 3.925 4.504 -0.579 25757 7146 1 9 . 1 1 81 81 SER C C 81 175.264 175.264 175.519 -0.255 25757 7147 1 9 . 1 1 81 81 SER CA C 81 58.860 58.860 59.132 -0.272 25757 7148 1 9 . 1 1 81 81 SER CB C 81 63.790 63.790 63.516 0.274 25757 7149 1 9 . 1 1 81 81 SER H H 81 8.503 8.503 8.609 -0.106 25757 7150 1 9 . 1 1 82 82 GLU N N 82 123.206 123.206 122.833 0.373 25757 7151 1 9 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.036 0.022 25757 7152 1 9 . 1 1 82 82 GLU C C 82 178.378 178.378 178.351 0.027 25757 7153 1 9 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.515 0.071 25757 7154 1 9 . 1 1 82 82 GLU CB C 82 29.603 29.603 28.849 0.754 25757 7155 1 9 . 1 1 82 82 GLU H H 82 8.563 8.563 8.672 -0.109 25757 7156 1 9 . 1 1 83 83 GLU N N 83 119.262 119.262 118.187 1.075 25757 7157 1 9 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.985 -0.028 25757 7158 1 9 . 1 1 83 83 GLU C C 83 178.606 178.606 178.932 -0.326 25757 7159 1 9 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.383 0.286 25757 7160 1 9 . 1 1 83 83 GLU CB C 83 29.355 29.355 28.519 0.836 25757 7161 1 9 . 1 1 83 83 GLU H H 83 7.728 7.728 8.405 -0.677 25757 7162 1 9 . 1 1 84 84 GLU N N 84 118.432 118.432 120.509 -2.077 25757 7163 1 9 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.312 -0.205 25757 7164 1 9 . 1 1 84 84 GLU C C 84 179.436 179.436 179.027 0.409 25757 7165 1 9 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.596 0.907 25757 7166 1 9 . 1 1 84 84 GLU CB C 84 29.107 29.107 28.983 0.124 25757 7167 1 9 . 1 1 84 84 GLU H H 84 8.346 8.346 8.297 0.049 25757 7168 1 9 . 1 1 85 85 ILE N N 85 120.925 120.925 120.521 0.404 25757 7169 1 9 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.752 -0.004 25757 7170 1 9 . 1 1 85 85 ILE C C 85 177.661 177.661 178.289 -0.628 25757 7171 1 9 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.790 -0.300 25757 7172 1 9 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.760 -0.329 25757 7173 1 9 . 1 1 85 85 ILE H H 85 7.821 7.821 8.251 -0.430 25757 7174 1 9 . 1 1 86 86 ARG N N 86 121.916 121.916 118.653 3.263 25757 7175 1 9 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.629 0.507 25757 7176 1 9 . 1 1 86 86 ARG C C 86 179.208 179.208 178.828 0.380 25757 7177 1 9 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.582 0.789 25757 7178 1 9 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.708 0.390 25757 7179 1 9 . 1 1 86 86 ARG H H 86 8.432 8.432 8.116 0.316 25757 7180 1 9 . 1 1 87 87 GLU N N 87 118.261 118.261 118.957 -0.696 25757 7181 1 9 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.881 0.231 25757 7182 1 9 . 1 1 87 87 GLU C C 87 178.516 178.516 178.650 -0.134 25757 7183 1 9 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.190 -0.165 25757 7184 1 9 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.385 -0.215 25757 7185 1 9 . 1 1 87 87 GLU H H 87 8.225 8.225 8.094 0.131 25757 7186 1 9 . 1 1 88 88 ALA N N 88 121.009 121.009 122.731 -1.722 25757 7187 1 9 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.479 0.348 25757 7188 1 9 . 1 1 88 88 ALA C C 88 177.947 177.947 177.961 -0.014 25757 7189 1 9 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.839 0.022 25757 7190 1 9 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.351 -0.396 25757 7191 1 9 . 1 1 88 88 ALA H H 88 7.789 7.789 7.951 -0.162 25757 7192 1 9 . 1 1 89 89 PHE N N 89 117.164 117.164 118.468 -1.304 25757 7193 1 9 . 1 1 89 89 PHE C C 89 176.134 176.134 177.294 -1.160 25757 7194 1 9 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.461 2.189 25757 7195 1 9 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.757 0.136 25757 7196 1 9 . 1 1 89 89 PHE H H 89 8.337 8.337 7.454 0.883 25757 7197 1 9 . 1 1 90 90 ARG N N 90 114.900 114.900 117.671 -2.771 25757 7198 1 9 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.794 0.120 25757 7199 1 9 . 1 1 90 90 ARG C C 90 178.296 178.296 177.307 0.989 25757 7200 1 9 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.908 0.171 25757 7201 1 9 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.648 -0.554 25757 7202 1 9 . 1 1 90 90 ARG H H 90 7.681 7.681 7.609 0.072 25757 7203 1 9 . 1 1 91 91 VAL N N 91 116.927 116.927 115.007 1.920 25757 7204 1 9 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.809 -0.202 25757 7205 1 9 . 1 1 91 91 VAL C C 91 177.964 177.964 176.994 0.970 25757 7206 1 9 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.671 0.289 25757 7207 1 9 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.799 -0.180 25757 7208 1 9 . 1 1 91 91 VAL H H 91 7.405 7.405 7.424 -0.019 25757 7209 1 9 . 1 1 92 92 PHE N N 92 119.026 119.026 117.652 1.374 25757 7210 1 9 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.291 0.071 25757 7211 1 9 . 1 1 92 92 PHE C C 92 177.639 177.639 176.475 1.164 25757 7212 1 9 . 1 1 92 92 PHE CA C 92 57.721 57.721 57.990 -0.269 25757 7213 1 9 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.449 -0.022 25757 7214 1 9 . 1 1 92 92 PHE H H 92 7.886 7.886 7.414 0.472 25757 7215 1 9 . 1 1 93 93 ASP N N 93 118.238 118.238 118.578 -0.340 25757 7216 1 9 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.793 -0.331 25757 7217 1 9 . 1 1 93 93 ASP C C 93 176.979 176.979 176.644 0.335 25757 7218 1 9 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.667 -1.519 25757 7219 1 9 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.911 -1.762 25757 7220 1 9 . 1 1 93 93 ASP H H 93 8.009 8.009 7.357 0.652 25757 7221 1 9 . 1 1 94 94 LYS N N 94 125.792 125.792 125.701 0.091 25757 7222 1 9 . 1 1 94 94 LYS C C 94 178.213 178.213 177.815 0.398 25757 7223 1 9 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.920 0.398 25757 7224 1 9 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.762 -1.734 25757 7225 1 9 . 1 1 94 94 LYS H H 94 7.428 7.428 8.143 -0.715 25757 7226 1 9 . 1 1 95 95 ASP N N 95 113.833 113.833 115.527 -1.694 25757 7227 1 9 . 1 1 95 95 ASP C C 95 177.718 177.718 177.067 0.651 25757 7228 1 9 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.211 -1.266 25757 7229 1 9 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.655 -0.912 25757 7230 1 9 . 1 1 95 95 ASP H H 95 8.159 8.159 7.878 0.281 25757 7231 1 9 . 1 1 96 96 GLY N N 96 109.414 109.414 107.220 2.194 25757 7232 1 9 . 1 1 96 96 GLY C C 96 175.093 175.093 175.406 -0.313 25757 7233 1 9 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.934 1.320 25757 7234 1 9 . 1 1 96 96 GLY H H 96 7.848 7.848 8.070 -0.222 25757 7235 1 9 . 1 1 97 97 ASN N N 97 119.590 119.590 117.963 1.627 25757 7236 1 9 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.493 0.119 25757 7237 1 9 . 1 1 97 97 ASN C C 97 175.937 175.937 176.509 -0.572 25757 7238 1 9 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.699 -0.811 25757 7239 1 9 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.528 -1.208 25757 7240 1 9 . 1 1 97 97 ASN H H 97 8.338 8.338 8.921 -0.583 25757 7241 1 9 . 1 1 98 98 GLY N N 98 112.940 112.940 107.888 5.052 25757 7242 1 9 . 1 1 98 98 GLY C C 98 172.429 172.429 172.706 -0.277 25757 7243 1 9 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.039 0.053 25757 7244 1 9 . 1 1 98 98 GLY H H 98 10.695 10.695 8.447 2.248 25757 7245 1 9 . 1 1 99 99 TYR N N 99 115.544 115.544 118.069 -2.525 25757 7246 1 9 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.275 -0.188 25757 7247 1 9 . 1 1 99 99 TYR C C 99 174.859 174.859 174.626 0.233 25757 7248 1 9 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.269 -1.251 25757 7249 1 9 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.312 1.041 25757 7250 1 9 . 1 1 99 99 TYR H H 99 7.597 7.597 8.115 -0.518 25757 7251 1 9 . 1 1 100 100 ILE N N 100 127.078 127.078 124.192 2.886 25757 7252 1 9 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.787 0.002 25757 7253 1 9 . 1 1 100 100 ILE C C 100 175.387 175.387 176.037 -0.650 25757 7254 1 9 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.569 0.437 25757 7255 1 9 . 1 1 100 100 ILE CB C 100 38.790 38.790 40.385 -1.595 25757 7256 1 9 . 1 1 100 100 ILE H H 100 10.267 10.267 9.327 0.940 25757 7257 1 9 . 1 1 101 101 SER N N 101 124.102 124.102 122.500 1.602 25757 7258 1 9 . 1 1 101 101 SER HA H 101 4.417 4.417 5.278 -0.861 25757 7259 1 9 . 1 1 101 101 SER C C 101 175.360 175.360 175.382 -0.022 25757 7260 1 9 . 1 1 101 101 SER CA C 101 56.036 56.036 57.286 -1.250 25757 7261 1 9 . 1 1 101 101 SER CB C 101 66.896 66.896 65.809 1.087 25757 7262 1 9 . 1 1 101 101 SER H H 101 8.985 8.985 8.359 0.626 25757 7263 1 9 . 1 1 102 102 ALA N N 102 122.780 122.780 125.171 -2.391 25757 7264 1 9 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.923 -0.179 25757 7265 1 9 . 1 1 102 102 ALA C C 102 179.175 179.175 178.445 0.730 25757 7266 1 9 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.712 0.578 25757 7267 1 9 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.368 -0.341 25757 7268 1 9 . 1 1 102 102 ALA H H 102 9.269 9.269 9.151 0.118 25757 7269 1 9 . 1 1 103 103 ALA N N 103 118.513 118.513 120.868 -2.355 25757 7270 1 9 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.959 0.052 25757 7271 1 9 . 1 1 103 103 ALA C C 103 181.521 181.521 179.918 1.603 25757 7272 1 9 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.228 0.126 25757 7273 1 9 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.252 0.039 25757 7274 1 9 . 1 1 103 103 ALA H H 103 8.321 8.321 8.306 0.015 25757 7275 1 9 . 1 1 104 104 GLU N N 104 119.550 119.550 119.546 0.004 25757 7276 1 9 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.078 -0.072 25757 7277 1 9 . 1 1 104 104 GLU C C 104 179.750 179.750 179.178 0.572 25757 7278 1 9 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.649 -0.480 25757 7279 1 9 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.370 -0.155 25757 7280 1 9 . 1 1 104 104 GLU H H 104 7.867 7.867 7.929 -0.062 25757 7281 1 9 . 1 1 105 105 LEU N N 105 122.688 122.688 120.533 2.155 25757 7282 1 9 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.857 0.061 25757 7283 1 9 . 1 1 105 105 LEU C C 105 178.233 178.233 178.250 -0.017 25757 7284 1 9 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.276 -0.541 25757 7285 1 9 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.911 0.109 25757 7286 1 9 . 1 1 105 105 LEU H H 105 8.746 8.746 8.216 0.530 25757 7287 1 9 . 1 1 106 106 ARG N N 106 118.835 118.835 117.911 0.924 25757 7288 1 9 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.856 -0.206 25757 7289 1 9 . 1 1 106 106 ARG C C 106 178.742 178.742 178.470 0.272 25757 7290 1 9 . 1 1 106 106 ARG CA C 106 59.963 59.963 58.947 1.016 25757 7291 1 9 . 1 1 106 106 ARG CB C 106 30.046 30.046 28.996 1.050 25757 7292 1 9 . 1 1 106 106 ARG H H 106 8.684 8.684 8.447 0.237 25757 7293 1 9 . 1 1 107 107 HIS N N 107 119.258 119.258 119.149 0.109 25757 7294 1 9 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.423 -0.156 25757 7295 1 9 . 1 1 107 107 HIS C C 107 177.244 177.244 177.491 -0.247 25757 7296 1 9 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.745 1.407 25757 7297 1 9 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.650 0.925 25757 7298 1 9 . 1 1 107 107 HIS H H 107 7.691 7.691 8.202 -0.511 25757 7299 1 9 . 1 1 108 108 VAL N N 108 118.996 118.996 120.861 -1.865 25757 7300 1 9 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.483 -0.045 25757 7301 1 9 . 1 1 108 108 VAL C C 108 177.998 177.998 178.016 -0.018 25757 7302 1 9 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.820 -0.389 25757 7303 1 9 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.744 -0.320 25757 7304 1 9 . 1 1 108 108 VAL H H 108 7.599 7.599 7.999 -0.400 25757 7305 1 9 . 1 1 109 109 MET N N 109 114.880 114.880 118.164 -3.284 25757 7306 1 9 . 1 1 109 109 MET C C 109 179.119 179.119 177.710 1.409 25757 7307 1 9 . 1 1 109 109 MET CA C 109 56.979 56.979 58.719 -1.740 25757 7308 1 9 . 1 1 109 109 MET CB C 109 29.253 29.253 32.887 -3.634 25757 7309 1 9 . 1 1 109 109 MET H H 109 7.911 7.911 8.178 -0.267 25757 7310 1 9 . 1 1 110 110 THR N N 110 116.943 116.943 116.295 0.648 25757 7311 1 9 . 1 1 110 110 THR HA H 110 4.229 4.229 4.138 0.091 25757 7312 1 9 . 1 1 110 110 THR C C 110 178.506 178.506 176.007 2.499 25757 7313 1 9 . 1 1 110 110 THR CA C 110 66.573 66.573 66.135 0.438 25757 7314 1 9 . 1 1 110 110 THR CB C 110 68.575 68.575 68.739 -0.164 25757 7315 1 9 . 1 1 110 110 THR H H 110 8.353 8.353 7.915 0.438 25757 7316 1 9 . 1 1 111 111 ASN N N 111 123.829 123.829 120.038 3.791 25757 7317 1 9 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.359 0.003 25757 7318 1 9 . 1 1 111 111 ASN C C 111 177.197 177.197 176.952 0.245 25757 7319 1 9 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.844 0.115 25757 7320 1 9 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.480 -1.257 25757 7321 1 9 . 1 1 111 111 ASN H H 111 8.053 8.053 8.012 0.041 25757 7322 1 9 . 1 1 112 112 LEU N N 112 119.036 119.036 116.237 2.799 25757 7323 1 9 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.056 0.114 25757 7324 1 9 . 1 1 112 112 LEU C C 112 176.377 176.377 176.954 -0.577 25757 7325 1 9 . 1 1 112 112 LEU CA C 112 55.505 55.505 55.899 -0.394 25757 7326 1 9 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.456 -0.096 25757 7327 1 9 . 1 1 112 112 LEU H H 112 7.794 7.794 7.555 0.239 25757 7328 1 9 . 1 1 113 113 GLY N N 113 106.045 106.045 104.294 1.751 25757 7329 1 9 . 1 1 113 113 GLY C C 113 174.248 174.248 173.705 0.543 25757 7330 1 9 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.464 0.843 25757 7331 1 9 . 1 1 113 113 GLY H H 113 7.741 7.741 7.479 0.262 25757 7332 1 9 . 1 1 114 114 GLU N N 114 120.556 120.556 120.947 -0.391 25757 7333 1 9 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.409 -0.099 25757 7334 1 9 . 1 1 114 114 GLU C C 114 174.993 174.993 175.795 -0.802 25757 7335 1 9 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.467 0.170 25757 7336 1 9 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.611 0.606 25757 7337 1 9 . 1 1 114 114 GLU H H 114 7.980 7.980 7.738 0.242 25757 7338 1 9 . 1 1 115 115 LYS N N 115 124.986 124.986 128.358 -3.372 25757 7339 1 9 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.267 0.067 25757 7340 1 9 . 1 1 115 115 LYS C C 115 175.285 175.285 175.878 -0.593 25757 7341 1 9 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.650 -1.069 25757 7342 1 9 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.115 -0.142 25757 7343 1 9 . 1 1 115 115 LYS H H 115 8.613 8.613 8.600 0.013 25757 7344 1 9 . 1 1 116 116 LEU N N 116 125.243 125.243 122.755 2.488 25757 7345 1 9 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.799 -0.111 25757 7346 1 9 . 1 1 116 116 LEU C C 116 178.365 178.365 175.990 2.375 25757 7347 1 9 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.223 1.125 25757 7348 1 9 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.828 0.462 25757 7349 1 9 . 1 1 116 116 LEU H H 116 8.066 8.066 8.159 -0.093 25757 7350 1 9 . 1 1 117 117 THR N N 117 114.324 114.324 114.100 0.224 25757 7351 1 9 . 1 1 117 117 THR HA H 117 4.713 4.713 4.559 0.154 25757 7352 1 9 . 1 1 117 117 THR C C 117 175.539 175.539 174.939 0.600 25757 7353 1 9 . 1 1 117 117 THR CA C 117 60.756 60.756 60.286 0.470 25757 7354 1 9 . 1 1 117 117 THR CB C 117 71.144 71.144 70.017 1.127 25757 7355 1 9 . 1 1 117 117 THR H H 117 9.228 9.228 7.663 1.565 25757 7356 1 9 . 1 1 118 118 ASP N N 118 121.016 121.016 122.484 -1.468 25757 7357 1 9 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.277 -0.122 25757 7358 1 9 . 1 1 118 118 ASP H H 118 8.919 8.919 8.749 0.170 25757 7359 1 9 . 1 1 119 119 GLU N N 119 121.016 121.016 118.278 2.738 25757 7360 1 9 . 1 1 119 119 GLU C C 119 179.204 179.204 178.680 0.524 25757 7361 1 9 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.402 -1.332 25757 7362 1 9 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.326 -0.282 25757 7363 1 9 . 1 1 119 119 GLU H H 119 8.919 8.919 8.712 0.207 25757 7364 1 9 . 1 1 120 120 GLU N N 120 120.566 120.566 120.400 0.166 25757 7365 1 9 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.022 -0.021 25757 7366 1 9 . 1 1 120 120 GLU C C 120 180.329 180.329 178.715 1.614 25757 7367 1 9 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.206 -0.115 25757 7368 1 9 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.076 1.562 25757 7369 1 9 . 1 1 120 120 GLU H H 120 7.732 7.732 7.546 0.186 25757 7370 1 9 . 1 1 121 121 VAL N N 121 121.875 121.875 119.678 2.197 25757 7371 1 9 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.493 -0.028 25757 7372 1 9 . 1 1 121 121 VAL C C 121 177.477 177.477 178.048 -0.571 25757 7373 1 9 . 1 1 121 121 VAL CA C 121 67.171 67.171 67.021 0.150 25757 7374 1 9 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.575 -0.141 25757 7375 1 9 . 1 1 121 121 VAL H H 121 8.104 8.104 7.457 0.647 25757 7376 1 9 . 1 1 122 122 ASP N N 122 120.566 120.566 120.096 0.470 25757 7377 1 9 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.295 0.040 25757 7378 1 9 . 1 1 122 122 ASP C C 122 179.298 179.298 179.034 0.264 25757 7379 1 9 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.564 0.275 25757 7380 1 9 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.157 0.155 25757 7381 1 9 . 1 1 122 122 ASP H H 122 8.089 8.089 8.246 -0.157 25757 7382 1 9 . 1 1 123 123 GLU N N 123 119.821 119.821 119.439 0.382 25757 7383 1 9 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.059 -0.010 25757 7384 1 9 . 1 1 123 123 GLU C C 123 178.749 178.749 179.216 -0.467 25757 7385 1 9 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.987 0.331 25757 7386 1 9 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.471 -0.085 25757 7387 1 9 . 1 1 123 123 GLU H H 123 8.105 8.105 8.313 -0.208 25757 7388 1 9 . 1 1 124 124 MET N N 124 119.288 119.288 119.688 -0.400 25757 7389 1 9 . 1 1 124 124 MET C C 124 180.865 180.865 179.020 1.845 25757 7390 1 9 . 1 1 124 124 MET CA C 124 60.684 60.684 59.884 0.800 25757 7391 1 9 . 1 1 124 124 MET CB C 124 33.141 33.141 32.602 0.539 25757 7392 1 9 . 1 1 124 124 MET H H 124 7.726 7.726 8.152 -0.426 25757 7393 1 9 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.958 -0.229 25757 7394 1 9 . 1 1 125 125 ILE C C 125 177.341 177.341 178.350 -1.009 25757 7395 1 9 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.969 -0.168 25757 7396 1 9 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.871 -1.306 25757 7397 1 9 . 1 1 126 126 ARG N N 126 118.555 118.555 118.449 0.106 25757 7398 1 9 . 1 1 126 126 ARG C C 126 179.164 179.164 178.063 1.101 25757 7399 1 9 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.509 0.415 25757 7400 1 9 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.153 -0.288 25757 7401 1 9 . 1 1 126 126 ARG H H 126 8.380 8.380 8.177 0.203 25757 7402 1 9 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.333 -0.408 25757 7403 1 9 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.669 1.388 25757 7404 1 9 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.483 0.345 25757 7405 1 9 . 1 1 128 128 ALA N N 128 116.764 116.764 120.395 -3.631 25757 7406 1 9 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.117 0.300 25757 7407 1 9 . 1 1 128 128 ALA C C 128 177.885 177.885 176.659 1.226 25757 7408 1 9 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.597 -0.642 25757 7409 1 9 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.539 3.028 25757 7410 1 9 . 1 1 128 128 ALA H H 128 7.152 7.152 8.004 -0.852 25757 7411 1 9 . 1 1 129 129 ASP N N 129 117.762 117.762 117.564 0.198 25757 7412 1 9 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.153 -0.676 25757 7413 1 9 . 1 1 129 129 ASP C C 129 175.935 175.935 176.268 -0.333 25757 7414 1 9 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.262 2.253 25757 7415 1 9 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.730 -0.985 25757 7416 1 9 . 1 1 129 129 ASP H H 129 8.007 8.007 7.700 0.307 25757 7417 1 9 . 1 1 130 130 ILE N N 130 128.249 128.249 124.645 3.604 25757 7418 1 9 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.800 0.064 25757 7419 1 9 . 1 1 130 130 ILE C C 130 177.764 177.764 177.360 0.404 25757 7420 1 9 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.928 -0.380 25757 7421 1 9 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.221 0.427 25757 7422 1 9 . 1 1 130 130 ILE H H 130 8.412 8.412 8.778 -0.366 25757 7423 1 9 . 1 1 131 131 ASP N N 131 116.430 116.430 116.505 -0.075 25757 7424 1 9 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.603 -0.069 25757 7425 1 9 . 1 1 131 131 ASP C C 131 178.313 178.313 177.039 1.274 25757 7426 1 9 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.814 -0.930 25757 7427 1 9 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.878 -0.916 25757 7428 1 9 . 1 1 131 131 ASP H H 131 8.254 8.254 8.131 0.123 25757 7429 1 9 . 1 1 132 132 GLY N N 132 108.460 108.460 109.177 -0.717 25757 7430 1 9 . 1 1 132 132 GLY C C 132 175.211 175.211 174.311 0.900 25757 7431 1 9 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.777 1.826 25757 7432 1 9 . 1 1 132 132 GLY H H 132 7.547 7.547 7.803 -0.256 25757 7433 1 9 . 1 1 133 133 ASP N N 133 120.909 120.909 118.585 2.324 25757 7434 1 9 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.572 -0.109 25757 7435 1 9 . 1 1 133 133 ASP C C 133 177.691 177.691 177.391 0.300 25757 7436 1 9 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.810 0.004 25757 7437 1 9 . 1 1 133 133 ASP CB C 133 40.298 40.298 42.061 -1.763 25757 7438 1 9 . 1 1 133 133 ASP H H 133 8.339 8.339 8.500 -0.161 25757 7439 1 9 . 1 1 134 134 GLY N N 134 112.704 112.704 108.270 4.434 25757 7440 1 9 . 1 1 134 134 GLY C C 134 172.722 172.722 173.353 -0.631 25757 7441 1 9 . 1 1 134 134 GLY CA C 134 46.037 46.037 44.949 1.088 25757 7442 1 9 . 1 1 134 134 GLY H H 134 10.396 10.396 8.727 1.669 25757 7443 1 9 . 1 1 135 135 GLN N N 135 114.799 114.799 119.296 -4.497 25757 7444 1 9 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.262 -0.398 25757 7445 1 9 . 1 1 135 135 GLN C C 135 174.760 174.760 175.051 -0.291 25757 7446 1 9 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.441 -1.120 25757 7447 1 9 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.652 -0.587 25757 7448 1 9 . 1 1 135 135 GLN H H 135 7.975 7.975 8.668 -0.693 25757 7449 1 9 . 1 1 136 136 VAL N N 136 125.364 125.364 126.146 -0.782 25757 7450 1 9 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.431 0.777 25757 7451 1 9 . 1 1 136 136 VAL C C 136 175.831 175.831 175.404 0.427 25757 7452 1 9 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.404 0.413 25757 7453 1 9 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.028 1.646 25757 7454 1 9 . 1 1 136 136 VAL H H 136 9.169 9.169 9.176 -0.007 25757 7455 1 9 . 1 1 137 137 ASN N N 137 129.155 129.155 127.265 1.890 25757 7456 1 9 . 1 1 137 137 ASN C C 137 174.737 174.737 175.902 -1.165 25757 7457 1 9 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.178 0.173 25757 7458 1 9 . 1 1 137 137 ASN CB C 137 38.323 38.323 40.631 -2.308 25757 7459 1 9 . 1 1 137 137 ASN H H 137 9.652 9.652 8.258 1.394 25757 7460 1 9 . 1 1 138 138 TYR N N 138 118.504 118.504 123.004 -4.500 25757 7461 1 9 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.502 -0.223 25757 7462 1 9 . 1 1 138 138 TYR C C 138 176.174 176.174 176.620 -0.446 25757 7463 1 9 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.332 1.242 25757 7464 1 9 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.060 -0.330 25757 7465 1 9 . 1 1 138 138 TYR H H 138 8.460 8.460 8.637 -0.177 25757 7466 1 9 . 1 1 139 139 GLU N N 139 118.644 118.644 119.946 -1.302 25757 7467 1 9 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.398 0.150 25757 7468 1 9 . 1 1 139 139 GLU C C 139 180.265 180.265 178.058 2.207 25757 7469 1 9 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.834 0.652 25757 7470 1 9 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.861 0.130 25757 7471 1 9 . 1 1 139 139 GLU H H 139 8.136 8.136 8.780 -0.644 25757 7472 1 9 . 1 1 140 140 GLU N N 140 120.030 120.030 117.692 2.338 25757 7473 1 9 . 1 1 140 140 GLU HA H 140 3.888 3.888 3.992 -0.104 25757 7474 1 9 . 1 1 140 140 GLU C C 140 179.627 179.627 177.626 2.001 25757 7475 1 9 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.519 0.158 25757 7476 1 9 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.427 0.300 25757 7477 1 9 . 1 1 140 140 GLU H H 140 8.798 8.798 8.106 0.692 25757 7478 1 9 . 1 1 141 141 PHE N N 141 123.154 123.154 121.830 1.324 25757 7479 1 9 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.925 -0.228 25757 7480 1 9 . 1 1 141 141 PHE C C 141 176.952 176.952 177.595 -0.643 25757 7481 1 9 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.175 0.877 25757 7482 1 9 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.257 0.874 25757 7483 1 9 . 1 1 141 141 PHE H H 141 8.633 8.633 7.904 0.729 25757 7484 1 9 . 1 1 142 142 VAL N N 142 120.046 120.046 118.848 1.198 25757 7485 1 9 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.731 -0.775 25757 7486 1 9 . 1 1 142 142 VAL C C 142 179.627 179.627 177.077 2.550 25757 7487 1 9 . 1 1 142 142 VAL CA C 142 67.243 67.243 64.331 2.913 25757 7488 1 9 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.454 -0.314 25757 7489 1 9 . 1 1 142 142 VAL H H 142 8.894 8.894 8.299 0.595 25757 7490 1 9 . 1 1 143 143 GLN N N 143 118.996 118.996 118.689 0.307 25757 7491 1 9 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.094 -0.318 25757 7492 1 9 . 1 1 143 143 GLN C C 143 178.443 178.443 177.520 0.923 25757 7493 1 9 . 1 1 143 143 GLN CA C 143 59.129 59.129 57.537 1.592 25757 7494 1 9 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.392 -0.649 25757 7495 1 9 . 1 1 143 143 GLN H H 143 7.627 7.627 7.542 0.085 25757 7496 1 9 . 1 1 144 144 MET N N 144 116.361 116.361 118.274 -1.913 25757 7497 1 9 . 1 1 144 144 MET HA H 144 4.169 4.169 4.205 -0.036 25757 7498 1 9 . 1 1 144 144 MET C C 144 178.418 178.418 176.368 2.050 25757 7499 1 9 . 1 1 144 144 MET CA C 144 56.137 56.137 57.623 -1.486 25757 7500 1 9 . 1 1 144 144 MET CB C 144 31.095 31.095 32.150 -1.055 25757 7501 1 9 . 1 1 144 144 MET H H 144 7.179 7.179 7.249 -0.070 25757 7502 1 9 . 1 1 145 145 MET N N 145 115.373 115.373 115.510 -0.137 25757 7503 1 9 . 1 1 145 145 MET HA H 145 4.334 4.334 4.352 -0.018 25757 7504 1 9 . 1 1 145 145 MET C C 145 177.217 177.217 176.772 0.445 25757 7505 1 9 . 1 1 145 145 MET CA C 145 55.296 55.296 56.386 -1.089 25757 7506 1 9 . 1 1 145 145 MET CB C 145 34.458 34.458 32.467 1.991 25757 7507 1 9 . 1 1 145 145 MET H H 145 7.776 7.776 7.475 0.301 25757 7508 1 9 . 1 1 146 146 THR N N 146 107.988 107.988 111.999 -4.011 25757 7509 1 9 . 1 1 146 146 THR HA H 146 4.239 4.239 4.322 -0.083 25757 7510 1 9 . 1 1 146 146 THR C C 146 175.378 175.378 174.650 0.728 25757 7511 1 9 . 1 1 146 146 THR CA C 146 61.625 61.625 61.551 0.074 25757 7512 1 9 . 1 1 146 146 THR CB C 146 70.817 70.817 67.389 3.428 25757 7513 1 9 . 1 1 146 146 THR H H 146 7.736 7.736 7.250 0.486 25757 7514 1 9 . 1 1 147 147 GLY N N 147 110.157 110.157 110.867 -0.710 25757 7515 1 9 . 1 1 147 147 GLY C C 147 174.046 174.046 173.713 0.333 25757 7516 1 9 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.786 0.758 25757 7517 1 9 . 1 1 147 147 GLY H H 147 7.793 7.793 7.646 0.147 25757 7518 1 9 . 1 1 150 150 THR HA H 150 4.239 4.239 4.396 -0.157 25757 7519 1 9 . 1 1 150 150 THR C C 150 174.397 174.397 174.884 -0.487 25757 7520 1 9 . 1 1 150 150 THR CA C 150 61.260 61.260 61.345 -0.085 25757 7521 1 9 . 1 1 150 150 THR CB C 150 70.358 70.358 69.752 0.606 25757 7522 1 9 . 1 1 151 151 ALA N N 151 126.304 126.304 124.361 1.943 25757 7523 1 9 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.570 -0.282 25757 7524 1 9 . 1 1 151 151 ALA C C 151 177.678 177.678 177.952 -0.274 25757 7525 1 9 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.844 0.304 25757 7526 1 9 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.742 -0.323 25757 7527 1 9 . 1 1 151 151 ALA H H 151 8.618 8.618 7.572 1.046 25757 7528 1 9 . 1 1 152 152 ALA N N 152 123.861 123.861 120.909 2.952 25757 7529 1 9 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.364 -0.246 25757 7530 1 9 . 1 1 152 152 ALA C C 152 178.823 178.823 178.621 0.202 25757 7531 1 9 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.652 1.842 25757 7532 1 9 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.092 0.665 25757 7533 1 9 . 1 1 152 152 ALA H H 152 8.354 8.354 8.774 -0.420 25757 7534 1 9 . 1 1 153 153 GLY N N 153 109.984 109.984 107.419 2.565 25757 7535 1 9 . 1 1 153 153 GLY C C 153 174.389 174.389 176.149 -1.760 25757 7536 1 9 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.243 -2.112 25757 7537 1 9 . 1 1 153 153 GLY H H 153 9.028 9.028 7.725 1.303 25757 7538 1 9 . 1 1 154 154 SER N N 154 113.934 113.934 117.162 -3.228 25757 7539 1 9 . 1 1 154 154 SER HA H 154 4.255 4.255 4.118 0.137 25757 7540 1 9 . 1 1 154 154 SER C C 154 177.929 177.929 176.769 1.160 25757 7541 1 9 . 1 1 154 154 SER CA C 154 59.379 59.379 61.703 -2.324 25757 7542 1 9 . 1 1 154 154 SER CB C 154 64.090 64.090 62.556 1.534 25757 7543 1 9 . 1 1 154 154 SER H H 154 7.962 7.962 8.024 -0.062 25757 7544 1 9 . 1 1 155 155 GLY N N 155 115.337 115.337 109.180 6.157 25757 7545 1 9 . 1 1 155 155 GLY C C 155 175.891 175.891 176.015 -0.124 25757 7546 1 9 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.912 0.734 25757 7547 1 9 . 1 1 155 155 GLY H H 155 9.451 9.451 7.894 1.557 25757 7548 1 9 . 1 1 156 156 TRP N N 156 119.600 119.600 121.865 -2.265 25757 7549 1 9 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.374 -0.103 25757 7550 1 9 . 1 1 156 156 TRP C C 156 178.947 178.947 178.679 0.268 25757 7551 1 9 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.273 -0.109 25757 7552 1 9 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.303 0.300 25757 7553 1 9 . 1 1 156 156 TRP H H 156 8.542 8.542 7.484 1.058 25757 7554 1 9 . 1 1 157 157 ARG N N 157 118.583 118.583 120.924 -2.341 25757 7555 1 9 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.005 -0.023 25757 7556 1 9 . 1 1 157 157 ARG C C 157 177.894 177.894 178.213 -0.319 25757 7557 1 9 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.074 -0.736 25757 7558 1 9 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.354 -0.297 25757 7559 1 9 . 1 1 157 157 ARG H H 157 7.747 7.747 8.550 -0.803 25757 7560 1 9 . 1 1 158 158 LYS N N 158 117.033 117.033 119.247 -2.214 25757 7561 1 9 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.069 -0.126 25757 7562 1 9 . 1 1 158 158 LYS C C 158 176.973 176.973 178.973 -2.000 25757 7563 1 9 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.589 0.785 25757 7564 1 9 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.073 0.218 25757 7565 1 9 . 1 1 158 158 LYS H H 158 7.529 7.529 8.101 -0.572 25757 7566 1 9 . 1 1 159 159 ILE N N 159 116.553 116.553 121.628 -5.075 25757 7567 1 9 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.800 -0.256 25757 7568 1 9 . 1 1 159 159 ILE C C 159 176.894 176.894 176.985 -0.091 25757 7569 1 9 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.842 0.674 25757 7570 1 9 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.119 -0.315 25757 7571 1 9 . 1 1 159 159 ILE H H 159 7.348 7.348 8.193 -0.845 25757 7572 1 9 . 1 1 160 160 LYS N N 160 119.278 119.278 120.246 -0.968 25757 7573 1 9 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.465 -0.426 25757 7574 1 9 . 1 1 160 160 LYS C C 160 178.566 178.566 179.255 -0.689 25757 7575 1 9 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.667 0.707 25757 7576 1 9 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.257 0.561 25757 7577 1 9 . 1 1 160 160 LYS H H 160 8.225 8.225 8.099 0.126 25757 7578 1 9 . 1 1 161 161 LEU N N 161 117.056 117.056 120.701 -3.645 25757 7579 1 9 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.226 -0.166 25757 7580 1 9 . 1 1 161 161 LEU C C 161 178.977 178.977 179.306 -0.329 25757 7581 1 9 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.522 0.502 25757 7582 1 9 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.818 0.164 25757 7583 1 9 . 1 1 161 161 LEU H H 161 8.057 8.057 8.310 -0.253 25757 7584 1 9 . 1 1 162 162 ALA N N 162 121.814 121.814 122.677 -0.863 25757 7585 1 9 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.269 -0.177 25757 7586 1 9 . 1 1 162 162 ALA C C 162 178.374 178.374 179.498 -1.124 25757 7587 1 9 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.154 0.637 25757 7588 1 9 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.488 -0.163 25757 7589 1 9 . 1 1 162 162 ALA H H 162 8.170 8.170 8.189 -0.019 25757 7590 1 9 . 1 1 163 163 VAL N N 163 115.449 115.449 119.460 -4.011 25757 7591 1 9 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.669 -0.051 25757 7592 1 9 . 1 1 163 163 VAL C C 163 178.362 178.362 177.351 1.011 25757 7593 1 9 . 1 1 163 163 VAL CA C 163 66.272 66.272 66.082 0.190 25757 7594 1 9 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.938 0.099 25757 7595 1 9 . 1 1 163 163 VAL H H 163 8.499 8.499 8.203 0.296 25757 7596 1 9 . 1 1 164 164 ARG N N 164 115.775 115.775 118.684 -2.909 25757 7597 1 9 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.500 -0.303 25757 7598 1 9 . 1 1 164 164 ARG C C 164 178.938 178.938 178.449 0.489 25757 7599 1 9 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.844 -1.161 25757 7600 1 9 . 1 1 164 164 ARG CB C 164 29.834 29.834 29.719 0.115 25757 7601 1 9 . 1 1 164 164 ARG H H 164 8.165 8.165 8.273 -0.108 25757 7602 1 9 . 1 1 165 165 GLY N N 165 105.570 105.570 107.690 -2.120 25757 7603 1 9 . 1 1 165 165 GLY C C 165 173.134 173.134 175.236 -2.102 25757 7604 1 9 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.265 0.477 25757 7605 1 9 . 1 1 165 165 GLY H H 165 8.455 8.455 8.021 0.434 25757 7606 1 9 . 1 1 166 166 ALA N N 166 120.648 120.648 123.508 -2.860 25757 7607 1 9 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.597 -0.255 25757 7608 1 9 . 1 1 166 166 ALA C C 166 176.155 176.155 177.830 -1.675 25757 7609 1 9 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.090 -2.317 25757 7610 1 9 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.646 -0.168 25757 7611 1 9 . 1 1 166 166 ALA H H 166 7.826 7.826 8.197 -0.371 25757 7612 1 9 . 1 1 167 167 GLN N N 167 117.315 117.315 118.101 -0.786 25757 7613 1 9 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.556 -0.279 25757 7614 1 9 . 1 1 167 167 GLN C C 167 175.571 175.571 173.930 1.641 25757 7615 1 9 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.880 1.047 25757 7616 1 9 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.050 0.135 25757 7617 1 9 . 1 1 167 167 GLN H H 167 7.498 7.498 7.687 -0.189 25757 7618 1 9 . 1 1 168 168 ALA N N 168 126.706 126.706 126.405 0.301 25757 7619 1 9 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.600 -0.321 25757 7620 1 9 . 1 1 168 168 ALA C C 168 177.227 177.227 176.302 0.925 25757 7621 1 9 . 1 1 168 168 ALA CA C 168 52.066 52.066 50.068 1.998 25757 7622 1 9 . 1 1 168 168 ALA CB C 168 19.706 19.706 21.354 -1.648 25757 7623 1 9 . 1 1 168 168 ALA H H 168 8.534 8.534 8.281 0.253 25757 7624 1 10 . 1 1 9 9 ILE N N 9 116.733 116.733 121.299 -4.566 25757 7625 1 10 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.037 -0.280 25757 7626 1 10 . 1 1 9 9 ILE C C 9 177.828 177.828 177.221 0.607 25757 7627 1 10 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.502 3.102 25757 7628 1 10 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.434 0.164 25757 7629 1 10 . 1 1 9 9 ILE H H 9 7.366 7.366 8.193 -0.827 25757 7630 1 10 . 1 1 10 10 ALA N N 10 121.080 121.080 123.105 -2.025 25757 7631 1 10 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.993 0.082 25757 7632 1 10 . 1 1 10 10 ALA C C 10 180.921 180.921 179.291 1.630 25757 7633 1 10 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.352 0.251 25757 7634 1 10 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.837 0.147 25757 7635 1 10 . 1 1 10 10 ALA H H 10 8.039 8.039 8.313 -0.274 25757 7636 1 10 . 1 1 11 11 GLU N N 11 119.580 119.580 118.856 0.724 25757 7637 1 10 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.905 0.184 25757 7638 1 10 . 1 1 11 11 GLU C C 11 179.561 179.561 179.234 0.327 25757 7639 1 10 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.001 0.884 25757 7640 1 10 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.138 0.325 25757 7641 1 10 . 1 1 11 11 GLU H H 11 7.741 7.741 7.963 -0.222 25757 7642 1 10 . 1 1 12 12 PHE N N 12 118.509 118.509 117.990 0.519 25757 7643 1 10 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.362 0.464 25757 7644 1 10 . 1 1 12 12 PHE C C 12 179.000 179.000 178.279 0.721 25757 7645 1 10 . 1 1 12 12 PHE CA C 12 60.164 60.164 60.336 -0.172 25757 7646 1 10 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.859 0.251 25757 7647 1 10 . 1 1 12 12 PHE H H 12 8.470 8.470 7.224 1.246 25757 7648 1 10 . 1 1 13 13 LYS N N 13 123.523 123.523 119.010 4.513 25757 7649 1 10 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.095 -0.069 25757 7650 1 10 . 1 1 13 13 LYS C C 13 179.260 179.260 179.392 -0.132 25757 7651 1 10 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.241 0.923 25757 7652 1 10 . 1 1 13 13 LYS CB C 13 31.833 31.833 31.683 0.150 25757 7653 1 10 . 1 1 13 13 LYS H H 13 9.171 9.171 8.315 0.856 25757 7654 1 10 . 1 1 14 14 GLU N N 14 120.415 120.415 119.252 1.163 25757 7655 1 10 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.114 -0.019 25757 7656 1 10 . 1 1 14 14 GLU C C 14 179.851 179.851 178.877 0.974 25757 7657 1 10 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.187 0.399 25757 7658 1 10 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.229 0.332 25757 7659 1 10 . 1 1 14 14 GLU H H 14 7.822 7.822 8.230 -0.408 25757 7660 1 10 . 1 1 15 15 ALA N N 15 122.143 122.143 122.475 -0.332 25757 7661 1 10 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.133 -0.003 25757 7662 1 10 . 1 1 15 15 ALA C C 15 178.222 178.222 179.850 -1.628 25757 7663 1 10 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.307 -0.117 25757 7664 1 10 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.717 -0.215 25757 7665 1 10 . 1 1 15 15 ALA H H 15 8.244 8.244 8.182 0.062 25757 7666 1 10 . 1 1 16 16 PHE N N 16 119.809 119.809 118.653 1.156 25757 7667 1 10 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.114 -0.102 25757 7668 1 10 . 1 1 16 16 PHE C C 16 177.444 177.444 177.318 0.126 25757 7669 1 10 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.043 2.021 25757 7670 1 10 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.135 0.297 25757 7671 1 10 . 1 1 16 16 PHE H H 16 8.891 8.891 8.460 0.431 25757 7672 1 10 . 1 1 17 17 SER N N 17 112.631 112.631 115.629 -2.998 25757 7673 1 10 . 1 1 17 17 SER HA H 17 4.034 4.034 4.058 -0.024 25757 7674 1 10 . 1 1 17 17 SER C C 17 174.675 174.675 176.271 -1.596 25757 7675 1 10 . 1 1 17 17 SER CA C 17 61.507 61.507 61.994 -0.487 25757 7676 1 10 . 1 1 17 17 SER CB C 17 63.414 63.414 63.477 -0.063 25757 7677 1 10 . 1 1 17 17 SER H H 17 7.910 7.910 8.440 -0.530 25757 7678 1 10 . 1 1 18 18 LEU N N 18 120.614 120.614 117.989 2.625 25757 7679 1 10 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.229 -0.217 25757 7680 1 10 . 1 1 18 18 LEU C C 18 177.366 177.366 177.528 -0.162 25757 7681 1 10 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.310 0.076 25757 7682 1 10 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.933 -0.338 25757 7683 1 10 . 1 1 18 18 LEU H H 18 7.423 7.423 7.811 -0.388 25757 7684 1 10 . 1 1 19 19 PHE N N 19 114.602 114.602 117.334 -2.732 25757 7685 1 10 . 1 1 19 19 PHE C C 19 176.961 176.961 175.864 1.097 25757 7686 1 10 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.056 -0.572 25757 7687 1 10 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.394 1.375 25757 7688 1 10 . 1 1 19 19 PHE H H 19 7.254 7.254 7.073 0.181 25757 7689 1 10 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.565 0.010 25757 7690 1 10 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.478 -1.830 25757 7691 1 10 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.616 -0.606 25757 7692 1 10 . 1 1 23 23 GLY N N 23 108.244 108.244 107.890 0.354 25757 7693 1 10 . 1 1 23 23 GLY C C 23 175.188 175.188 174.947 0.241 25757 7694 1 10 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.113 1.290 25757 7695 1 10 . 1 1 23 23 GLY H H 23 7.555 7.555 8.368 -0.813 25757 7696 1 10 . 1 1 24 24 ASP N N 24 120.667 120.667 119.997 0.670 25757 7697 1 10 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.594 -0.125 25757 7698 1 10 . 1 1 24 24 ASP C C 24 177.457 177.457 177.852 -0.395 25757 7699 1 10 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.509 0.283 25757 7700 1 10 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.581 -1.065 25757 7701 1 10 . 1 1 24 24 ASP H H 24 8.397 8.397 8.554 -0.157 25757 7702 1 10 . 1 1 25 25 GLY N N 25 112.989 112.989 108.510 4.479 25757 7703 1 10 . 1 1 25 25 GLY C C 25 173.639 173.639 173.345 0.294 25757 7704 1 10 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.227 0.274 25757 7705 1 10 . 1 1 25 25 GLY H H 25 10.592 10.592 8.168 2.424 25757 7706 1 10 . 1 1 26 26 THR N N 26 112.948 112.948 113.005 -0.057 25757 7707 1 10 . 1 1 26 26 THR HA H 26 5.282 5.282 4.995 0.287 25757 7708 1 10 . 1 1 26 26 THR C C 26 172.853 172.853 172.605 0.248 25757 7709 1 10 . 1 1 26 26 THR CA C 26 59.817 59.817 61.303 -1.486 25757 7710 1 10 . 1 1 26 26 THR CB C 26 72.465 72.465 71.316 1.149 25757 7711 1 10 . 1 1 26 26 THR H H 26 8.121 8.121 8.053 0.068 25757 7712 1 10 . 1 1 27 27 ILE N N 27 127.195 127.195 125.044 2.151 25757 7713 1 10 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.631 0.282 25757 7714 1 10 . 1 1 27 27 ILE C C 27 176.091 176.091 175.349 0.742 25757 7715 1 10 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.001 0.764 25757 7716 1 10 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.299 -1.594 25757 7717 1 10 . 1 1 27 27 ILE H H 27 9.867 9.867 8.477 1.390 25757 7718 1 10 . 1 1 28 28 THR N N 28 116.655 116.655 122.226 -5.571 25757 7719 1 10 . 1 1 28 28 THR HA H 28 4.790 4.790 4.742 0.048 25757 7720 1 10 . 1 1 28 28 THR C C 28 176.696 176.696 176.389 0.307 25757 7721 1 10 . 1 1 28 28 THR CA C 28 59.590 59.590 61.760 -2.170 25757 7722 1 10 . 1 1 28 28 THR CB C 28 72.457 72.457 70.411 2.046 25757 7723 1 10 . 1 1 28 28 THR H H 28 8.457 8.457 8.197 0.260 25757 7724 1 10 . 1 1 29 29 THR N N 29 111.878 111.878 117.779 -5.901 25757 7725 1 10 . 1 1 29 29 THR HA H 29 4.188 4.188 3.851 0.337 25757 7726 1 10 . 1 1 29 29 THR C C 29 177.399 177.399 176.081 1.318 25757 7727 1 10 . 1 1 29 29 THR CA C 29 66.386 66.386 67.525 -1.139 25757 7728 1 10 . 1 1 29 29 THR CB C 29 67.726 67.726 68.442 -0.716 25757 7729 1 10 . 1 1 29 29 THR H H 29 9.211 9.211 9.016 0.195 25757 7730 1 10 . 1 1 30 30 LYS N N 30 121.140 121.140 121.907 -0.767 25757 7731 1 10 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.902 0.175 25757 7732 1 10 . 1 1 30 30 LYS C C 30 179.793 179.793 179.120 0.673 25757 7733 1 10 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.971 -0.679 25757 7734 1 10 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.679 0.768 25757 7735 1 10 . 1 1 30 30 LYS H H 30 7.580 7.580 8.448 -0.868 25757 7736 1 10 . 1 1 31 31 GLU N N 31 121.865 121.865 119.876 1.989 25757 7737 1 10 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.947 0.047 25757 7738 1 10 . 1 1 31 31 GLU C C 31 179.355 179.355 178.847 0.508 25757 7739 1 10 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.889 -0.256 25757 7740 1 10 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.341 0.511 25757 7741 1 10 . 1 1 31 31 GLU H H 31 7.708 7.708 7.677 0.031 25757 7742 1 10 . 1 1 32 32 LEU N N 32 120.597 120.597 120.460 0.137 25757 7743 1 10 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.127 -0.011 25757 7744 1 10 . 1 1 32 32 LEU C C 32 178.885 178.885 178.782 0.103 25757 7745 1 10 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.354 0.007 25757 7746 1 10 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.819 1.217 25757 7747 1 10 . 1 1 32 32 LEU H H 32 8.688 8.688 8.013 0.675 25757 7748 1 10 . 1 1 33 33 GLY N N 33 104.837 104.837 106.287 -1.450 25757 7749 1 10 . 1 1 33 33 GLY C C 33 175.123 175.123 175.894 -0.771 25757 7750 1 10 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.636 0.611 25757 7751 1 10 . 1 1 33 33 GLY H H 33 8.694 8.694 8.657 0.037 25757 7752 1 10 . 1 1 34 34 THR N N 34 117.631 117.631 119.371 -1.740 25757 7753 1 10 . 1 1 34 34 THR HA H 34 3.899 3.899 3.865 0.034 25757 7754 1 10 . 1 1 34 34 THR C C 34 176.951 176.951 176.735 0.216 25757 7755 1 10 . 1 1 34 34 THR CA C 34 67.234 67.234 67.073 0.161 25757 7756 1 10 . 1 1 34 34 THR CB C 34 68.863 68.863 68.745 0.118 25757 7757 1 10 . 1 1 34 34 THR H H 34 7.960 7.960 7.963 -0.003 25757 7758 1 10 . 1 1 35 35 VAL N N 35 121.659 121.659 122.596 -0.937 25757 7759 1 10 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.533 -0.016 25757 7760 1 10 . 1 1 35 35 VAL C C 35 178.265 178.265 178.379 -0.114 25757 7761 1 10 . 1 1 35 35 VAL CA C 35 66.675 66.675 67.109 -0.434 25757 7762 1 10 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.770 -0.477 25757 7763 1 10 . 1 1 35 35 VAL H H 35 7.358 7.358 8.285 -0.927 25757 7764 1 10 . 1 1 36 36 MET N N 36 117.456 117.456 116.884 0.572 25757 7765 1 10 . 1 1 36 36 MET C C 36 179.088 179.088 177.413 1.675 25757 7766 1 10 . 1 1 36 36 MET CA C 36 60.477 60.477 58.603 1.874 25757 7767 1 10 . 1 1 36 36 MET CB C 36 32.443 32.443 32.540 -0.097 25757 7768 1 10 . 1 1 36 36 MET H H 36 8.194 8.194 8.456 -0.262 25757 7769 1 10 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.493 0.653 25757 7770 1 10 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.352 -0.002 25757 7771 1 10 . 1 1 38 38 SER HA H 38 4.085 4.085 4.329 -0.244 25757 7772 1 10 . 1 1 38 38 SER C C 38 173.788 173.788 175.007 -1.219 25757 7773 1 10 . 1 1 38 38 SER CA C 38 61.617 61.617 61.106 0.511 25757 7774 1 10 . 1 1 38 38 SER CB C 38 62.943 62.943 63.017 -0.074 25757 7775 1 10 . 1 1 39 39 LEU N N 39 119.003 119.003 120.242 -1.239 25757 7776 1 10 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.619 -0.125 25757 7777 1 10 . 1 1 39 39 LEU C C 39 176.470 176.470 177.371 -0.901 25757 7778 1 10 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.129 0.550 25757 7779 1 10 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.141 1.373 25757 7780 1 10 . 1 1 39 39 LEU H H 39 7.230 7.230 7.377 -0.147 25757 7781 1 10 . 1 1 40 40 GLY N N 40 105.026 105.026 107.842 -2.816 25757 7782 1 10 . 1 1 40 40 GLY C C 40 174.322 174.322 174.423 -0.101 25757 7783 1 10 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.169 1.046 25757 7784 1 10 . 1 1 40 40 GLY H H 40 7.698 7.698 7.948 -0.250 25757 7785 1 10 . 1 1 41 41 GLN N N 41 117.929 117.929 119.720 -1.791 25757 7786 1 10 . 1 1 41 41 GLN C C 41 174.557 174.557 175.151 -0.594 25757 7787 1 10 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.619 1.225 25757 7788 1 10 . 1 1 41 41 GLN H H 41 7.866 7.866 7.788 0.078 25757 7789 1 10 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.575 0.161 25757 7790 1 10 . 1 1 43 43 PRO C C 43 177.805 177.805 176.500 1.305 25757 7791 1 10 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.010 -0.505 25757 7792 1 10 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.465 -0.303 25757 7793 1 10 . 1 1 44 44 THR N N 44 113.167 113.167 112.160 1.007 25757 7794 1 10 . 1 1 44 44 THR HA H 44 4.684 4.684 4.539 0.145 25757 7795 1 10 . 1 1 44 44 THR C C 44 175.139 175.139 175.638 -0.499 25757 7796 1 10 . 1 1 44 44 THR CA C 44 60.556 60.556 59.178 1.378 25757 7797 1 10 . 1 1 44 44 THR CB C 44 71.064 71.064 71.545 -0.481 25757 7798 1 10 . 1 1 44 44 THR H H 44 8.798 8.798 7.892 0.906 25757 7799 1 10 . 1 1 45 45 GLU N N 45 120.673 120.673 120.794 -0.121 25757 7800 1 10 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.832 0.159 25757 7801 1 10 . 1 1 45 45 GLU C C 45 178.940 178.940 178.591 0.349 25757 7802 1 10 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.024 -0.123 25757 7803 1 10 . 1 1 45 45 GLU CB C 45 29.029 29.029 28.613 0.416 25757 7804 1 10 . 1 1 45 45 GLU H H 45 8.812 8.812 8.837 -0.025 25757 7805 1 10 . 1 1 46 46 ALA N N 46 120.576 120.576 121.112 -0.536 25757 7806 1 10 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.080 -0.113 25757 7807 1 10 . 1 1 46 46 ALA C C 46 180.290 180.290 180.132 0.158 25757 7808 1 10 . 1 1 46 46 ALA CA C 46 54.919 54.919 54.895 0.024 25757 7809 1 10 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.114 0.047 25757 7810 1 10 . 1 1 46 46 ALA H H 46 8.276 8.276 8.364 -0.088 25757 7811 1 10 . 1 1 47 47 GLU N N 47 116.104 116.104 119.184 -3.080 25757 7812 1 10 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.004 -0.004 25757 7813 1 10 . 1 1 47 47 GLU C C 47 180.224 180.224 178.890 1.334 25757 7814 1 10 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.649 -0.718 25757 7815 1 10 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.297 0.692 25757 7816 1 10 . 1 1 47 47 GLU H H 47 7.425 7.425 7.594 -0.169 25757 7817 1 10 . 1 1 48 48 LEU N N 48 120.425 120.425 119.730 0.695 25757 7818 1 10 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.888 0.162 25757 7819 1 10 . 1 1 48 48 LEU C C 48 178.551 178.551 179.375 -0.824 25757 7820 1 10 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.175 -0.335 25757 7821 1 10 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.404 1.165 25757 7822 1 10 . 1 1 48 48 LEU H H 48 8.121 8.121 8.057 0.064 25757 7823 1 10 . 1 1 49 49 GLN N N 49 118.372 118.372 118.090 0.282 25757 7824 1 10 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.929 -0.167 25757 7825 1 10 . 1 1 49 49 GLN C C 49 178.567 178.567 178.400 0.167 25757 7826 1 10 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.812 0.051 25757 7827 1 10 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.084 0.158 25757 7828 1 10 . 1 1 49 49 GLN H H 49 8.302 8.302 8.223 0.079 25757 7829 1 10 . 1 1 50 50 ASP N N 50 119.992 119.992 120.518 -0.526 25757 7830 1 10 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.341 0.019 25757 7831 1 10 . 1 1 50 50 ASP C C 50 178.600 178.600 178.419 0.181 25757 7832 1 10 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.161 0.542 25757 7833 1 10 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.936 -0.469 25757 7834 1 10 . 1 1 50 50 ASP H H 50 8.150 8.150 8.112 0.038 25757 7835 1 10 . 1 1 51 51 MET N N 51 119.238 119.238 119.322 -0.084 25757 7836 1 10 . 1 1 51 51 MET HA H 51 3.981 3.981 3.994 -0.013 25757 7837 1 10 . 1 1 51 51 MET C C 51 179.006 179.006 178.635 0.371 25757 7838 1 10 . 1 1 51 51 MET CA C 51 59.443 59.443 59.362 0.081 25757 7839 1 10 . 1 1 51 51 MET CB C 51 33.380 33.380 32.796 0.584 25757 7840 1 10 . 1 1 51 51 MET H H 51 7.844 7.844 7.996 -0.152 25757 7841 1 10 . 1 1 52 52 ILE N N 52 118.161 118.161 117.916 0.245 25757 7842 1 10 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.584 -0.106 25757 7843 1 10 . 1 1 52 52 ILE C C 52 177.847 177.847 178.603 -0.756 25757 7844 1 10 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.735 0.260 25757 7845 1 10 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.429 0.694 25757 7846 1 10 . 1 1 52 52 ILE H H 52 7.686 7.686 8.236 -0.550 25757 7847 1 10 . 1 1 53 53 ASN N N 53 117.884 117.884 117.715 0.169 25757 7848 1 10 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.433 -0.068 25757 7849 1 10 . 1 1 53 53 ASN C C 53 177.515 177.515 177.624 -0.109 25757 7850 1 10 . 1 1 53 53 ASN CA C 53 56.207 56.207 56.016 0.191 25757 7851 1 10 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.401 -0.323 25757 7852 1 10 . 1 1 53 53 ASN H H 53 8.713 8.713 8.260 0.453 25757 7853 1 10 . 1 1 54 54 GLU N N 54 116.178 116.178 118.006 -1.828 25757 7854 1 10 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.238 -0.249 25757 7855 1 10 . 1 1 54 54 GLU C C 54 177.557 177.557 177.225 0.332 25757 7856 1 10 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.906 1.085 25757 7857 1 10 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.567 -0.104 25757 7858 1 10 . 1 1 54 54 GLU H H 54 7.530 7.530 7.984 -0.454 25757 7859 1 10 . 1 1 55 55 VAL N N 55 107.164 107.164 110.792 -3.628 25757 7860 1 10 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.368 0.154 25757 7861 1 10 . 1 1 55 55 VAL C C 55 175.602 175.602 174.161 1.441 25757 7862 1 10 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.625 -0.273 25757 7863 1 10 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.302 0.301 25757 7864 1 10 . 1 1 55 55 VAL H H 55 7.175 7.175 7.486 -0.311 25757 7865 1 10 . 1 1 56 56 ASP N N 56 122.126 122.126 120.228 1.898 25757 7866 1 10 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.325 -0.726 25757 7867 1 10 . 1 1 56 56 ASP C C 56 176.182 176.182 175.672 0.510 25757 7868 1 10 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.127 0.679 25757 7869 1 10 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.726 -2.456 25757 7870 1 10 . 1 1 56 56 ASP H H 56 7.569 7.569 7.413 0.156 25757 7871 1 10 . 1 1 57 57 ALA N N 57 103.782 103.782 128.943 -25.161 25757 7872 1 10 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.342 -0.162 25757 7873 1 10 . 1 1 57 57 ALA C C 57 178.584 178.584 178.047 0.537 25757 7874 1 10 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.134 1.210 25757 7875 1 10 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.661 -0.137 25757 7876 1 10 . 1 1 57 57 ALA H H 57 8.515 8.515 8.404 0.111 25757 7877 1 10 . 1 1 58 58 ASP N N 58 113.602 113.602 120.011 -6.409 25757 7878 1 10 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.543 0.043 25757 7879 1 10 . 1 1 58 58 ASP C C 58 177.756 177.756 177.495 0.261 25757 7880 1 10 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.784 -2.022 25757 7881 1 10 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.152 -1.474 25757 7882 1 10 . 1 1 58 58 ASP H H 58 8.130 8.130 8.118 0.012 25757 7883 1 10 . 1 1 59 59 GLY N N 59 109.195 109.195 107.138 2.057 25757 7884 1 10 . 1 1 59 59 GLY C C 59 175.139 175.139 174.882 0.257 25757 7885 1 10 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.152 2.112 25757 7886 1 10 . 1 1 59 59 GLY H H 59 7.694 7.694 8.806 -1.112 25757 7887 1 10 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.728 -0.123 25757 7888 1 10 . 1 1 61 61 GLY N N 61 113.316 113.316 108.612 4.704 25757 7889 1 10 . 1 1 61 61 GLY C C 61 173.234 173.234 173.258 -0.024 25757 7890 1 10 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.136 -0.438 25757 7891 1 10 . 1 1 61 61 GLY H H 61 10.633 10.633 8.654 1.979 25757 7892 1 10 . 1 1 62 62 THR N N 62 108.892 108.892 108.895 -0.003 25757 7893 1 10 . 1 1 62 62 THR HA H 62 4.736 4.736 4.838 -0.102 25757 7894 1 10 . 1 1 62 62 THR C C 62 173.091 173.091 173.385 -0.294 25757 7895 1 10 . 1 1 62 62 THR CA C 62 59.617 59.617 59.030 0.587 25757 7896 1 10 . 1 1 62 62 THR CB C 62 72.004 72.004 72.553 -0.549 25757 7897 1 10 . 1 1 62 62 THR H H 62 7.673 7.673 7.849 -0.176 25757 7898 1 10 . 1 1 63 63 ILE N N 63 123.324 123.324 122.931 0.393 25757 7899 1 10 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.759 0.370 25757 7900 1 10 . 1 1 63 63 ILE C C 63 175.652 175.652 175.188 0.464 25757 7901 1 10 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.505 -0.019 25757 7902 1 10 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.221 -0.264 25757 7903 1 10 . 1 1 63 63 ILE H H 63 8.907 8.907 8.471 0.436 25757 7904 1 10 . 1 1 64 64 ASP N N 64 128.253 128.253 127.848 0.405 25757 7905 1 10 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.920 0.401 25757 7906 1 10 . 1 1 64 64 ASP C C 64 176.431 176.431 177.477 -1.046 25757 7907 1 10 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.818 -1.487 25757 7908 1 10 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.597 -0.544 25757 7909 1 10 . 1 1 64 64 ASP H H 64 8.864 8.864 9.098 -0.234 25757 7910 1 10 . 1 1 65 65 PHE N N 65 118.583 118.583 119.475 -0.892 25757 7911 1 10 . 1 1 65 65 PHE HA H 65 3.860 3.860 3.856 0.004 25757 7912 1 10 . 1 1 65 65 PHE C C 65 173.458 173.458 175.198 -1.740 25757 7913 1 10 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.484 0.314 25757 7914 1 10 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.022 -1.142 25757 7915 1 10 . 1 1 65 65 PHE H H 65 8.962 8.962 9.017 -0.055 25757 7916 1 10 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.310 -0.192 25757 7917 1 10 . 1 1 66 66 PRO C C 66 180.038 180.038 178.499 1.539 25757 7918 1 10 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.536 1.154 25757 7919 1 10 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.085 -0.408 25757 7920 1 10 . 1 1 67 67 GLU N N 67 118.402 118.402 119.128 -0.726 25757 7921 1 10 . 1 1 67 67 GLU C C 67 178.737 178.737 178.707 0.030 25757 7922 1 10 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.899 -0.891 25757 7923 1 10 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.186 0.499 25757 7924 1 10 . 1 1 67 67 GLU H H 67 7.953 7.953 8.597 -0.644 25757 7925 1 10 . 1 1 68 68 PHE N N 68 123.421 123.421 120.149 3.272 25757 7926 1 10 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.120 -0.148 25757 7927 1 10 . 1 1 68 68 PHE C C 68 177.184 177.184 176.994 0.190 25757 7928 1 10 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.115 0.223 25757 7929 1 10 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.038 0.930 25757 7930 1 10 . 1 1 68 68 PHE H H 68 8.928 8.928 7.481 1.447 25757 7931 1 10 . 1 1 69 69 LEU N N 69 119.284 119.284 119.539 -0.255 25757 7932 1 10 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.568 -0.233 25757 7933 1 10 . 1 1 69 69 LEU C C 69 178.987 178.987 178.315 0.672 25757 7934 1 10 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.780 -0.918 25757 7935 1 10 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.617 -0.785 25757 7936 1 10 . 1 1 69 69 LEU H H 69 8.374 8.374 7.578 0.796 25757 7937 1 10 . 1 1 70 70 THR N N 70 116.017 116.017 114.859 1.158 25757 7938 1 10 . 1 1 70 70 THR HA H 70 4.338 4.338 3.756 0.582 25757 7939 1 10 . 1 1 70 70 THR C C 70 176.169 176.169 176.631 -0.462 25757 7940 1 10 . 1 1 70 70 THR CA C 70 66.700 66.700 66.809 -0.109 25757 7941 1 10 . 1 1 70 70 THR CB C 70 68.379 68.379 68.462 -0.083 25757 7942 1 10 . 1 1 70 70 THR H H 70 7.493 7.493 8.282 -0.789 25757 7943 1 10 . 1 1 71 71 MET N N 71 121.915 121.915 122.337 -0.422 25757 7944 1 10 . 1 1 71 71 MET HA H 71 3.718 3.718 3.830 -0.112 25757 7945 1 10 . 1 1 71 71 MET C C 71 178.190 178.190 177.513 0.677 25757 7946 1 10 . 1 1 71 71 MET CA C 71 59.335 59.335 59.345 -0.010 25757 7947 1 10 . 1 1 71 71 MET CB C 71 33.894 33.894 32.394 1.500 25757 7948 1 10 . 1 1 71 71 MET H H 71 7.924 7.924 7.857 0.067 25757 7949 1 10 . 1 1 72 72 MET N N 72 116.973 116.973 118.365 -1.392 25757 7950 1 10 . 1 1 72 72 MET HA H 72 3.968 3.968 3.894 0.074 25757 7951 1 10 . 1 1 72 72 MET C C 72 178.211 178.211 178.167 0.044 25757 7952 1 10 . 1 1 72 72 MET CA C 72 56.059 56.059 58.863 -2.804 25757 7953 1 10 . 1 1 72 72 MET CB C 72 31.639 31.639 32.477 -0.838 25757 7954 1 10 . 1 1 72 72 MET H H 72 8.276 8.276 7.701 0.575 25757 7955 1 10 . 1 1 73 73 ALA N N 73 122.499 122.499 120.914 1.585 25757 7956 1 10 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.860 0.090 25757 7957 1 10 . 1 1 73 73 ALA C C 73 180.231 180.231 179.403 0.828 25757 7958 1 10 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.984 -0.031 25757 7959 1 10 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.755 0.278 25757 7960 1 10 . 1 1 73 73 ALA H H 73 8.240 8.240 8.250 -0.010 25757 7961 1 10 . 1 1 74 74 ARG N N 74 116.098 116.098 118.763 -2.665 25757 7962 1 10 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.031 -0.039 25757 7963 1 10 . 1 1 74 74 ARG C C 74 178.567 178.567 178.297 0.270 25757 7964 1 10 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.775 0.050 25757 7965 1 10 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.100 -0.025 25757 7966 1 10 . 1 1 74 74 ARG H H 74 7.420 7.420 7.877 -0.457 25757 7967 1 10 . 1 1 75 75 LYS N N 75 119.046 119.046 117.846 1.200 25757 7968 1 10 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.356 -0.313 25757 7969 1 10 . 1 1 75 75 LYS C C 75 179.045 179.045 178.859 0.186 25757 7970 1 10 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.717 0.172 25757 7971 1 10 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.556 -0.790 25757 7972 1 10 . 1 1 75 75 LYS H H 75 7.862 7.862 7.713 0.149 25757 7973 1 10 . 1 1 76 76 MET N N 76 116.772 116.772 120.030 -3.258 25757 7974 1 10 . 1 1 76 76 MET H H 76 8.099 8.099 8.333 -0.234 25757 7975 1 10 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.530 0.104 25757 7976 1 10 . 1 1 78 78 ASP C C 78 176.395 176.395 176.577 -0.182 25757 7977 1 10 . 1 1 78 78 ASP CA C 78 54.644 54.644 55.209 -0.564 25757 7978 1 10 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.540 -0.066 25757 7979 1 10 . 1 1 79 79 THR N N 79 113.904 113.904 119.046 -5.142 25757 7980 1 10 . 1 1 79 79 THR HA H 79 4.215 4.215 4.145 0.070 25757 7981 1 10 . 1 1 79 79 THR C C 79 174.204 174.204 174.724 -0.520 25757 7982 1 10 . 1 1 79 79 THR CA C 79 62.264 62.264 64.543 -2.279 25757 7983 1 10 . 1 1 79 79 THR CB C 79 69.884 69.884 69.246 0.638 25757 7984 1 10 . 1 1 79 79 THR H H 79 8.039 8.039 8.137 -0.098 25757 7985 1 10 . 1 1 80 80 ASP N N 80 123.572 123.572 122.132 1.440 25757 7986 1 10 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.726 -0.006 25757 7987 1 10 . 1 1 80 80 ASP C C 80 176.221 176.221 176.115 0.106 25757 7988 1 10 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.967 -0.652 25757 7989 1 10 . 1 1 80 80 ASP CB C 80 41.427 41.427 41.379 0.048 25757 7990 1 10 . 1 1 80 80 ASP H H 80 8.441 8.441 8.156 0.285 25757 7991 1 10 . 1 1 81 81 SER N N 81 117.879 117.879 119.351 -1.472 25757 7992 1 10 . 1 1 81 81 SER HA H 81 3.925 3.925 4.514 -0.589 25757 7993 1 10 . 1 1 81 81 SER C C 81 175.264 175.264 175.381 -0.117 25757 7994 1 10 . 1 1 81 81 SER CA C 81 58.860 58.860 58.689 0.171 25757 7995 1 10 . 1 1 81 81 SER CB C 81 63.790 63.790 63.789 0.001 25757 7996 1 10 . 1 1 81 81 SER H H 81 8.503 8.503 8.769 -0.266 25757 7997 1 10 . 1 1 82 82 GLU N N 82 123.206 123.206 122.480 0.726 25757 7998 1 10 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.047 0.011 25757 7999 1 10 . 1 1 82 82 GLU C C 82 178.378 178.378 178.516 -0.138 25757 8000 1 10 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.080 -0.494 25757 8001 1 10 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.579 0.024 25757 8002 1 10 . 1 1 82 82 GLU H H 82 8.563 8.563 8.739 -0.176 25757 8003 1 10 . 1 1 83 83 GLU N N 83 119.262 119.262 119.036 0.226 25757 8004 1 10 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.977 -0.020 25757 8005 1 10 . 1 1 83 83 GLU C C 83 178.606 178.606 179.087 -0.481 25757 8006 1 10 . 1 1 83 83 GLU CA C 83 59.669 59.669 60.144 -0.475 25757 8007 1 10 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.287 0.068 25757 8008 1 10 . 1 1 83 83 GLU H H 83 7.728 7.728 8.496 -0.768 25757 8009 1 10 . 1 1 84 84 GLU N N 84 118.432 118.432 119.489 -1.057 25757 8010 1 10 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.304 -0.197 25757 8011 1 10 . 1 1 84 84 GLU C C 84 179.436 179.436 179.447 -0.011 25757 8012 1 10 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.761 -0.258 25757 8013 1 10 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.277 -0.171 25757 8014 1 10 . 1 1 84 84 GLU H H 84 8.346 8.346 7.882 0.464 25757 8015 1 10 . 1 1 85 85 ILE N N 85 120.925 120.925 119.901 1.024 25757 8016 1 10 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.845 -0.097 25757 8017 1 10 . 1 1 85 85 ILE C C 85 177.661 177.661 178.341 -0.680 25757 8018 1 10 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.517 0.973 25757 8019 1 10 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.796 0.635 25757 8020 1 10 . 1 1 85 85 ILE H H 85 7.821 7.821 8.370 -0.549 25757 8021 1 10 . 1 1 86 86 ARG N N 86 121.916 121.916 119.164 2.752 25757 8022 1 10 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.036 0.100 25757 8023 1 10 . 1 1 86 86 ARG C C 86 179.208 179.208 178.947 0.261 25757 8024 1 10 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.314 1.057 25757 8025 1 10 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.593 0.505 25757 8026 1 10 . 1 1 86 86 ARG H H 86 8.432 8.432 8.284 0.148 25757 8027 1 10 . 1 1 87 87 GLU N N 87 118.261 118.261 119.094 -0.833 25757 8028 1 10 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.942 0.170 25757 8029 1 10 . 1 1 87 87 GLU C C 87 178.516 178.516 178.836 -0.320 25757 8030 1 10 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.266 -0.241 25757 8031 1 10 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.266 -0.096 25757 8032 1 10 . 1 1 87 87 GLU H H 87 8.225 8.225 8.210 0.015 25757 8033 1 10 . 1 1 88 88 ALA N N 88 121.009 121.009 122.486 -1.477 25757 8034 1 10 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.505 0.322 25757 8035 1 10 . 1 1 88 88 ALA C C 88 177.947 177.947 178.363 -0.416 25757 8036 1 10 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.936 -0.075 25757 8037 1 10 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.418 -0.463 25757 8038 1 10 . 1 1 88 88 ALA H H 88 7.789 7.789 7.996 -0.207 25757 8039 1 10 . 1 1 89 89 PHE N N 89 117.164 117.164 118.885 -1.721 25757 8040 1 10 . 1 1 89 89 PHE C C 89 176.134 176.134 177.007 -0.873 25757 8041 1 10 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.049 2.601 25757 8042 1 10 . 1 1 89 89 PHE CB C 89 38.893 38.893 39.139 -0.246 25757 8043 1 10 . 1 1 89 89 PHE H H 89 8.337 8.337 7.717 0.620 25757 8044 1 10 . 1 1 90 90 ARG N N 90 114.900 114.900 119.577 -4.677 25757 8045 1 10 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.852 0.062 25757 8046 1 10 . 1 1 90 90 ARG C C 90 178.296 178.296 176.802 1.494 25757 8047 1 10 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.772 0.307 25757 8048 1 10 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.425 -0.333 25757 8049 1 10 . 1 1 90 90 ARG H H 90 7.681 7.681 7.832 -0.151 25757 8050 1 10 . 1 1 91 91 VAL N N 91 116.927 116.927 115.287 1.640 25757 8051 1 10 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.902 -0.295 25757 8052 1 10 . 1 1 91 91 VAL C C 91 177.964 177.964 177.281 0.683 25757 8053 1 10 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.761 0.199 25757 8054 1 10 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.901 -0.281 25757 8055 1 10 . 1 1 91 91 VAL H H 91 7.405 7.405 7.486 -0.081 25757 8056 1 10 . 1 1 92 92 PHE N N 92 119.026 119.026 116.817 2.209 25757 8057 1 10 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.370 -0.008 25757 8058 1 10 . 1 1 92 92 PHE C C 92 177.639 177.639 176.248 1.391 25757 8059 1 10 . 1 1 92 92 PHE CA C 92 57.721 57.721 57.953 -0.232 25757 8060 1 10 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.790 -0.363 25757 8061 1 10 . 1 1 92 92 PHE H H 92 7.886 7.886 7.564 0.322 25757 8062 1 10 . 1 1 93 93 ASP N N 93 118.238 118.238 119.030 -0.792 25757 8063 1 10 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.772 -0.310 25757 8064 1 10 . 1 1 93 93 ASP C C 93 176.979 176.979 176.542 0.437 25757 8065 1 10 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.489 -1.341 25757 8066 1 10 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.486 -1.337 25757 8067 1 10 . 1 1 93 93 ASP H H 93 8.009 8.009 7.443 0.566 25757 8068 1 10 . 1 1 94 94 LYS N N 94 125.792 125.792 125.092 0.700 25757 8069 1 10 . 1 1 94 94 LYS C C 94 178.213 178.213 178.029 0.184 25757 8070 1 10 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.979 0.339 25757 8071 1 10 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.629 -1.601 25757 8072 1 10 . 1 1 94 94 LYS H H 94 7.428 7.428 8.390 -0.962 25757 8073 1 10 . 1 1 95 95 ASP N N 95 113.833 113.833 115.895 -2.062 25757 8074 1 10 . 1 1 95 95 ASP C C 95 177.718 177.718 177.517 0.201 25757 8075 1 10 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.068 -1.123 25757 8076 1 10 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.478 -0.735 25757 8077 1 10 . 1 1 95 95 ASP H H 95 8.159 8.159 7.929 0.230 25757 8078 1 10 . 1 1 96 96 GLY N N 96 109.414 109.414 108.233 1.181 25757 8079 1 10 . 1 1 96 96 GLY C C 96 175.093 175.093 175.114 -0.021 25757 8080 1 10 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.733 1.521 25757 8081 1 10 . 1 1 96 96 GLY H H 96 7.848 7.848 8.113 -0.265 25757 8082 1 10 . 1 1 97 97 ASN N N 97 119.590 119.590 118.536 1.054 25757 8083 1 10 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.538 0.074 25757 8084 1 10 . 1 1 97 97 ASN C C 97 175.937 175.937 176.533 -0.596 25757 8085 1 10 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.834 -0.946 25757 8086 1 10 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.680 -1.360 25757 8087 1 10 . 1 1 97 97 ASN H H 97 8.338 8.338 8.538 -0.200 25757 8088 1 10 . 1 1 98 98 GLY N N 98 112.940 112.940 107.728 5.212 25757 8089 1 10 . 1 1 98 98 GLY C C 98 172.429 172.429 172.613 -0.184 25757 8090 1 10 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.996 0.096 25757 8091 1 10 . 1 1 98 98 GLY H H 98 10.695 10.695 8.791 1.904 25757 8092 1 10 . 1 1 99 99 TYR N N 99 115.544 115.544 117.966 -2.422 25757 8093 1 10 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.159 -0.072 25757 8094 1 10 . 1 1 99 99 TYR C C 99 174.859 174.859 174.662 0.197 25757 8095 1 10 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.284 -1.266 25757 8096 1 10 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.206 1.147 25757 8097 1 10 . 1 1 99 99 TYR H H 99 7.597 7.597 8.245 -0.648 25757 8098 1 10 . 1 1 100 100 ILE N N 100 127.078 127.078 124.994 2.084 25757 8099 1 10 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.765 0.024 25757 8100 1 10 . 1 1 100 100 ILE C C 100 175.387 175.387 176.082 -0.695 25757 8101 1 10 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.970 0.036 25757 8102 1 10 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.797 -1.008 25757 8103 1 10 . 1 1 100 100 ILE H H 100 10.267 10.267 9.175 1.092 25757 8104 1 10 . 1 1 101 101 SER N N 101 124.102 124.102 122.923 1.179 25757 8105 1 10 . 1 1 101 101 SER HA H 101 4.417 4.417 5.334 -0.917 25757 8106 1 10 . 1 1 101 101 SER C C 101 175.360 175.360 175.498 -0.138 25757 8107 1 10 . 1 1 101 101 SER CA C 101 56.036 56.036 56.718 -0.682 25757 8108 1 10 . 1 1 101 101 SER CB C 101 66.896 66.896 65.266 1.630 25757 8109 1 10 . 1 1 101 101 SER H H 101 8.985 8.985 8.549 0.436 25757 8110 1 10 . 1 1 102 102 ALA N N 102 122.780 122.780 123.781 -1.001 25757 8111 1 10 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.970 -0.226 25757 8112 1 10 . 1 1 102 102 ALA C C 102 179.175 179.175 178.469 0.706 25757 8113 1 10 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.096 1.194 25757 8114 1 10 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.154 -0.127 25757 8115 1 10 . 1 1 102 102 ALA H H 102 9.269 9.269 9.052 0.217 25757 8116 1 10 . 1 1 103 103 ALA N N 103 118.513 118.513 121.395 -2.882 25757 8117 1 10 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.823 0.188 25757 8118 1 10 . 1 1 103 103 ALA C C 103 181.521 181.521 179.464 2.057 25757 8119 1 10 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.186 0.168 25757 8120 1 10 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.369 -0.078 25757 8121 1 10 . 1 1 103 103 ALA H H 103 8.321 8.321 8.305 0.016 25757 8122 1 10 . 1 1 104 104 GLU N N 104 119.550 119.550 118.913 0.637 25757 8123 1 10 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.133 -0.127 25757 8124 1 10 . 1 1 104 104 GLU C C 104 179.750 179.750 179.142 0.608 25757 8125 1 10 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.859 -0.690 25757 8126 1 10 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.356 -0.141 25757 8127 1 10 . 1 1 104 104 GLU H H 104 7.867 7.867 8.449 -0.582 25757 8128 1 10 . 1 1 105 105 LEU N N 105 122.688 122.688 120.169 2.519 25757 8129 1 10 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.837 0.081 25757 8130 1 10 . 1 1 105 105 LEU C C 105 178.233 178.233 178.297 -0.064 25757 8131 1 10 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.130 -0.396 25757 8132 1 10 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.721 0.299 25757 8133 1 10 . 1 1 105 105 LEU H H 105 8.746 8.746 7.882 0.864 25757 8134 1 10 . 1 1 106 106 ARG N N 106 118.835 118.835 118.081 0.754 25757 8135 1 10 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.731 -0.081 25757 8136 1 10 . 1 1 106 106 ARG C C 106 178.742 178.742 178.291 0.451 25757 8137 1 10 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.392 0.571 25757 8138 1 10 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.271 0.775 25757 8139 1 10 . 1 1 106 106 ARG H H 106 8.684 8.684 8.268 0.416 25757 8140 1 10 . 1 1 107 107 HIS N N 107 119.258 119.258 119.802 -0.544 25757 8141 1 10 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.459 -0.192 25757 8142 1 10 . 1 1 107 107 HIS C C 107 177.244 177.244 177.985 -0.741 25757 8143 1 10 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.386 1.766 25757 8144 1 10 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.587 0.988 25757 8145 1 10 . 1 1 107 107 HIS H H 107 7.691 7.691 8.140 -0.449 25757 8146 1 10 . 1 1 108 108 VAL N N 108 118.996 118.996 120.855 -1.859 25757 8147 1 10 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.806 -0.368 25757 8148 1 10 . 1 1 108 108 VAL C C 108 177.998 177.998 178.637 -0.639 25757 8149 1 10 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.338 0.093 25757 8150 1 10 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.164 0.260 25757 8151 1 10 . 1 1 108 108 VAL H H 108 7.599 7.599 8.172 -0.574 25757 8152 1 10 . 1 1 109 109 MET N N 109 114.880 114.880 118.528 -3.648 25757 8153 1 10 . 1 1 109 109 MET C C 109 179.119 179.119 178.654 0.465 25757 8154 1 10 . 1 1 109 109 MET CA C 109 56.979 56.979 58.723 -1.744 25757 8155 1 10 . 1 1 109 109 MET CB C 109 29.253 29.253 31.661 -2.408 25757 8156 1 10 . 1 1 109 109 MET H H 109 7.911 7.911 8.283 -0.372 25757 8157 1 10 . 1 1 110 110 THR N N 110 116.943 116.943 113.809 3.134 25757 8158 1 10 . 1 1 110 110 THR HA H 110 4.229 4.229 3.869 0.360 25757 8159 1 10 . 1 1 110 110 THR C C 110 178.506 178.506 177.293 1.213 25757 8160 1 10 . 1 1 110 110 THR CA C 110 66.573 66.573 65.990 0.583 25757 8161 1 10 . 1 1 110 110 THR CB C 110 68.575 68.575 68.541 0.034 25757 8162 1 10 . 1 1 110 110 THR H H 110 8.353 8.353 8.210 0.143 25757 8163 1 10 . 1 1 111 111 ASN N N 111 123.829 123.829 120.194 3.635 25757 8164 1 10 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.434 -0.072 25757 8165 1 10 . 1 1 111 111 ASN C C 111 177.197 177.197 176.991 0.206 25757 8166 1 10 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.830 0.130 25757 8167 1 10 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.400 -1.177 25757 8168 1 10 . 1 1 111 111 ASN H H 111 8.053 8.053 8.165 -0.112 25757 8169 1 10 . 1 1 112 112 LEU N N 112 119.036 119.036 117.124 1.912 25757 8170 1 10 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.100 0.070 25757 8171 1 10 . 1 1 112 112 LEU C C 112 176.377 176.377 177.436 -1.059 25757 8172 1 10 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.267 -0.762 25757 8173 1 10 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.686 -0.326 25757 8174 1 10 . 1 1 112 112 LEU H H 112 7.794 7.794 7.494 0.300 25757 8175 1 10 . 1 1 113 113 GLY N N 113 106.045 106.045 105.089 0.956 25757 8176 1 10 . 1 1 113 113 GLY C C 113 174.248 174.248 173.686 0.562 25757 8177 1 10 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.357 0.950 25757 8178 1 10 . 1 1 113 113 GLY H H 113 7.741 7.741 7.599 0.142 25757 8179 1 10 . 1 1 114 114 GLU N N 114 120.556 120.556 120.983 -0.427 25757 8180 1 10 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.486 -0.176 25757 8181 1 10 . 1 1 114 114 GLU C C 114 174.993 174.993 175.907 -0.914 25757 8182 1 10 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.433 0.204 25757 8183 1 10 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.425 0.792 25757 8184 1 10 . 1 1 114 114 GLU H H 114 7.980 7.980 7.648 0.332 25757 8185 1 10 . 1 1 115 115 LYS N N 115 124.986 124.986 126.035 -1.049 25757 8186 1 10 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.156 0.178 25757 8187 1 10 . 1 1 115 115 LYS C C 115 175.285 175.285 175.774 -0.489 25757 8188 1 10 . 1 1 115 115 LYS CA C 115 55.581 55.581 57.245 -1.664 25757 8189 1 10 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.489 -0.516 25757 8190 1 10 . 1 1 115 115 LYS H H 115 8.613 8.613 8.492 0.121 25757 8191 1 10 . 1 1 116 116 LEU N N 116 125.243 125.243 122.596 2.647 25757 8192 1 10 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.783 -0.095 25757 8193 1 10 . 1 1 116 116 LEU C C 116 178.365 178.365 175.986 2.379 25757 8194 1 10 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.119 1.229 25757 8195 1 10 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.246 0.043 25757 8196 1 10 . 1 1 116 116 LEU H H 116 8.066 8.066 8.143 -0.077 25757 8197 1 10 . 1 1 117 117 THR N N 117 114.324 114.324 112.981 1.343 25757 8198 1 10 . 1 1 117 117 THR HA H 117 4.713 4.713 4.544 0.169 25757 8199 1 10 . 1 1 117 117 THR C C 117 175.539 175.539 174.811 0.728 25757 8200 1 10 . 1 1 117 117 THR CA C 117 60.756 60.756 60.731 0.025 25757 8201 1 10 . 1 1 117 117 THR CB C 117 71.144 71.144 71.612 -0.468 25757 8202 1 10 . 1 1 117 117 THR H H 117 9.228 9.228 8.060 1.168 25757 8203 1 10 . 1 1 118 118 ASP N N 118 121.016 121.016 122.818 -1.802 25757 8204 1 10 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.307 -0.152 25757 8205 1 10 . 1 1 118 118 ASP H H 118 8.919 8.919 8.694 0.225 25757 8206 1 10 . 1 1 119 119 GLU N N 119 121.016 121.016 117.387 3.629 25757 8207 1 10 . 1 1 119 119 GLU C C 119 179.204 179.204 178.690 0.514 25757 8208 1 10 . 1 1 119 119 GLU CA C 119 58.070 58.070 58.963 -0.893 25757 8209 1 10 . 1 1 119 119 GLU CB C 119 29.044 29.044 28.850 0.194 25757 8210 1 10 . 1 1 119 119 GLU H H 119 8.919 8.919 8.778 0.141 25757 8211 1 10 . 1 1 120 120 GLU N N 120 120.566 120.566 120.610 -0.044 25757 8212 1 10 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.002 -0.001 25757 8213 1 10 . 1 1 120 120 GLU C C 120 180.329 180.329 178.557 1.772 25757 8214 1 10 . 1 1 120 120 GLU CA C 120 59.091 59.091 58.987 0.104 25757 8215 1 10 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.155 1.483 25757 8216 1 10 . 1 1 120 120 GLU H H 120 7.732 7.732 7.640 0.092 25757 8217 1 10 . 1 1 121 121 VAL N N 121 121.875 121.875 119.620 2.255 25757 8218 1 10 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.542 -0.077 25757 8219 1 10 . 1 1 121 121 VAL C C 121 177.477 177.477 178.239 -0.762 25757 8220 1 10 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.640 0.531 25757 8221 1 10 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.198 0.236 25757 8222 1 10 . 1 1 121 121 VAL H H 121 8.104 8.104 7.443 0.661 25757 8223 1 10 . 1 1 122 122 ASP N N 122 120.566 120.566 118.657 1.909 25757 8224 1 10 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.284 0.051 25757 8225 1 10 . 1 1 122 122 ASP C C 122 179.298 179.298 178.584 0.714 25757 8226 1 10 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.402 0.437 25757 8227 1 10 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.725 -0.413 25757 8228 1 10 . 1 1 122 122 ASP H H 122 8.089 8.089 8.118 -0.029 25757 8229 1 10 . 1 1 123 123 GLU N N 123 119.821 119.821 120.732 -0.911 25757 8230 1 10 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.093 -0.044 25757 8231 1 10 . 1 1 123 123 GLU C C 123 178.749 178.749 178.774 -0.025 25757 8232 1 10 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.070 0.248 25757 8233 1 10 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.412 -0.026 25757 8234 1 10 . 1 1 123 123 GLU H H 123 8.105 8.105 7.842 0.263 25757 8235 1 10 . 1 1 124 124 MET N N 124 119.288 119.288 117.991 1.297 25757 8236 1 10 . 1 1 124 124 MET C C 124 180.865 180.865 179.131 1.734 25757 8237 1 10 . 1 1 124 124 MET CA C 124 60.684 60.684 58.938 1.746 25757 8238 1 10 . 1 1 124 124 MET CB C 124 33.141 33.141 31.937 1.204 25757 8239 1 10 . 1 1 124 124 MET H H 124 7.726 7.726 8.034 -0.308 25757 8240 1 10 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.052 -0.323 25757 8241 1 10 . 1 1 125 125 ILE C C 125 177.341 177.341 177.847 -0.506 25757 8242 1 10 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.908 -0.107 25757 8243 1 10 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.151 -1.586 25757 8244 1 10 . 1 1 126 126 ARG N N 126 118.555 118.555 119.043 -0.488 25757 8245 1 10 . 1 1 126 126 ARG C C 126 179.164 179.164 178.074 1.090 25757 8246 1 10 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.047 0.877 25757 8247 1 10 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.843 0.022 25757 8248 1 10 . 1 1 126 126 ARG H H 126 8.380 8.380 8.142 0.238 25757 8249 1 10 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.382 -0.457 25757 8250 1 10 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.489 1.568 25757 8251 1 10 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.030 0.798 25757 8252 1 10 . 1 1 128 128 ALA N N 128 116.764 116.764 120.708 -3.944 25757 8253 1 10 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.115 0.302 25757 8254 1 10 . 1 1 128 128 ALA C C 128 177.885 177.885 177.176 0.709 25757 8255 1 10 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.024 -1.069 25757 8256 1 10 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.765 2.802 25757 8257 1 10 . 1 1 128 128 ALA H H 128 7.152 7.152 7.714 -0.562 25757 8258 1 10 . 1 1 129 129 ASP N N 129 117.762 117.762 117.674 0.088 25757 8259 1 10 . 1 1 129 129 ASP HA H 129 4.477 4.477 4.914 -0.437 25757 8260 1 10 . 1 1 129 129 ASP C C 129 175.935 175.935 176.590 -0.655 25757 8261 1 10 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.490 2.025 25757 8262 1 10 . 1 1 129 129 ASP CB C 129 40.745 40.745 42.289 -1.544 25757 8263 1 10 . 1 1 129 129 ASP H H 129 8.007 8.007 7.938 0.069 25757 8264 1 10 . 1 1 130 130 ILE N N 130 128.249 128.249 120.664 7.585 25757 8265 1 10 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.069 -0.205 25757 8266 1 10 . 1 1 130 130 ILE C C 130 177.764 177.764 176.174 1.590 25757 8267 1 10 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.710 0.838 25757 8268 1 10 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.688 0.960 25757 8269 1 10 . 1 1 130 130 ILE H H 130 8.412 8.412 8.406 0.006 25757 8270 1 10 . 1 1 131 131 ASP N N 131 116.430 116.430 119.861 -3.431 25757 8271 1 10 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.690 -0.156 25757 8272 1 10 . 1 1 131 131 ASP C C 131 178.313 178.313 176.903 1.410 25757 8273 1 10 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.500 -0.616 25757 8274 1 10 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.509 -1.547 25757 8275 1 10 . 1 1 131 131 ASP H H 131 8.254 8.254 8.660 -0.406 25757 8276 1 10 . 1 1 132 132 GLY N N 132 108.460 108.460 109.560 -1.100 25757 8277 1 10 . 1 1 132 132 GLY C C 132 175.211 175.211 174.943 0.268 25757 8278 1 10 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.191 1.412 25757 8279 1 10 . 1 1 132 132 GLY H H 132 7.547 7.547 7.759 -0.212 25757 8280 1 10 . 1 1 133 133 ASP N N 133 120.909 120.909 119.339 1.570 25757 8281 1 10 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.577 -0.114 25757 8282 1 10 . 1 1 133 133 ASP C C 133 177.691 177.691 177.773 -0.082 25757 8283 1 10 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.537 0.277 25757 8284 1 10 . 1 1 133 133 ASP CB C 133 40.298 40.298 41.262 -0.964 25757 8285 1 10 . 1 1 133 133 ASP H H 133 8.339 8.339 8.299 0.040 25757 8286 1 10 . 1 1 134 134 GLY N N 134 112.704 112.704 107.529 5.175 25757 8287 1 10 . 1 1 134 134 GLY C C 134 172.722 172.722 173.458 -0.736 25757 8288 1 10 . 1 1 134 134 GLY CA C 134 46.037 46.037 44.844 1.193 25757 8289 1 10 . 1 1 134 134 GLY H H 134 10.396 10.396 8.143 2.253 25757 8290 1 10 . 1 1 135 135 GLN N N 135 114.799 114.799 119.332 -4.533 25757 8291 1 10 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.105 -0.241 25757 8292 1 10 . 1 1 135 135 GLN C C 135 174.760 174.760 174.944 -0.184 25757 8293 1 10 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.535 -1.214 25757 8294 1 10 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.732 -0.667 25757 8295 1 10 . 1 1 135 135 GLN H H 135 7.975 7.975 8.486 -0.511 25757 8296 1 10 . 1 1 136 136 VAL N N 136 125.364 125.364 126.286 -0.922 25757 8297 1 10 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.648 0.560 25757 8298 1 10 . 1 1 136 136 VAL C C 136 175.831 175.831 175.570 0.261 25757 8299 1 10 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.242 0.575 25757 8300 1 10 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.008 1.665 25757 8301 1 10 . 1 1 136 136 VAL H H 136 9.169 9.169 9.082 0.087 25757 8302 1 10 . 1 1 137 137 ASN N N 137 129.155 129.155 126.723 2.432 25757 8303 1 10 . 1 1 137 137 ASN C C 137 174.737 174.737 175.764 -1.027 25757 8304 1 10 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.572 -0.221 25757 8305 1 10 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.270 -2.947 25757 8306 1 10 . 1 1 137 137 ASN H H 137 9.652 9.652 8.625 1.027 25757 8307 1 10 . 1 1 138 138 TYR N N 138 118.504 118.504 122.614 -4.110 25757 8308 1 10 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.614 -0.335 25757 8309 1 10 . 1 1 138 138 TYR C C 138 176.174 176.174 177.570 -1.396 25757 8310 1 10 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.163 0.411 25757 8311 1 10 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.141 -0.411 25757 8312 1 10 . 1 1 138 138 TYR H H 138 8.460 8.460 8.524 -0.064 25757 8313 1 10 . 1 1 139 139 GLU N N 139 118.644 118.644 117.671 0.973 25757 8314 1 10 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.860 -0.312 25757 8315 1 10 . 1 1 139 139 GLU C C 139 180.265 180.265 178.900 1.365 25757 8316 1 10 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.881 0.605 25757 8317 1 10 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.839 0.152 25757 8318 1 10 . 1 1 139 139 GLU H H 139 8.136 8.136 8.212 -0.076 25757 8319 1 10 . 1 1 140 140 GLU N N 140 120.030 120.030 117.600 2.430 25757 8320 1 10 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.013 -0.125 25757 8321 1 10 . 1 1 140 140 GLU C C 140 179.627 179.627 178.119 1.508 25757 8322 1 10 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.912 0.765 25757 8323 1 10 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.248 0.479 25757 8324 1 10 . 1 1 140 140 GLU H H 140 8.798 8.798 8.162 0.636 25757 8325 1 10 . 1 1 141 141 PHE N N 141 123.154 123.154 122.430 0.724 25757 8326 1 10 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.828 -0.131 25757 8327 1 10 . 1 1 141 141 PHE C C 141 176.952 176.952 177.908 -0.956 25757 8328 1 10 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.839 1.213 25757 8329 1 10 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.231 0.900 25757 8330 1 10 . 1 1 141 141 PHE H H 141 8.633 8.633 8.031 0.602 25757 8331 1 10 . 1 1 142 142 VAL N N 142 120.046 120.046 115.842 4.204 25757 8332 1 10 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.552 -0.596 25757 8333 1 10 . 1 1 142 142 VAL C C 142 179.627 179.627 177.537 2.090 25757 8334 1 10 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.232 2.011 25757 8335 1 10 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.397 -0.257 25757 8336 1 10 . 1 1 142 142 VAL H H 142 8.894 8.894 8.022 0.872 25757 8337 1 10 . 1 1 143 143 GLN N N 143 118.996 118.996 119.903 -0.907 25757 8338 1 10 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.987 -0.211 25757 8339 1 10 . 1 1 143 143 GLN C C 143 178.443 178.443 177.891 0.552 25757 8340 1 10 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.070 1.059 25757 8341 1 10 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.302 -0.558 25757 8342 1 10 . 1 1 143 143 GLN H H 143 7.627 7.627 7.544 0.083 25757 8343 1 10 . 1 1 144 144 MET N N 144 116.361 116.361 117.840 -1.479 25757 8344 1 10 . 1 1 144 144 MET HA H 144 4.169 4.169 4.016 0.153 25757 8345 1 10 . 1 1 144 144 MET C C 144 178.418 178.418 176.958 1.460 25757 8346 1 10 . 1 1 144 144 MET CA C 144 56.137 56.137 57.835 -1.698 25757 8347 1 10 . 1 1 144 144 MET CB C 144 31.095 31.095 32.340 -1.245 25757 8348 1 10 . 1 1 144 144 MET H H 144 7.179 7.179 7.393 -0.214 25757 8349 1 10 . 1 1 145 145 MET N N 145 115.373 115.373 113.919 1.454 25757 8350 1 10 . 1 1 145 145 MET HA H 145 4.334 4.334 4.663 -0.329 25757 8351 1 10 . 1 1 145 145 MET C C 145 177.217 177.217 176.154 1.063 25757 8352 1 10 . 1 1 145 145 MET CA C 145 55.296 55.296 55.626 -0.330 25757 8353 1 10 . 1 1 145 145 MET CB C 145 34.458 34.458 32.825 1.633 25757 8354 1 10 . 1 1 145 145 MET H H 145 7.776 7.776 7.557 0.219 25757 8355 1 10 . 1 1 146 146 THR N N 146 107.988 107.988 111.730 -3.742 25757 8356 1 10 . 1 1 146 146 THR HA H 146 4.239 4.239 4.478 -0.239 25757 8357 1 10 . 1 1 146 146 THR C C 146 175.378 175.378 174.953 0.425 25757 8358 1 10 . 1 1 146 146 THR CA C 146 61.625 61.625 61.668 -0.043 25757 8359 1 10 . 1 1 146 146 THR CB C 146 70.817 70.817 68.694 2.123 25757 8360 1 10 . 1 1 146 146 THR H H 146 7.736 7.736 7.803 -0.067 25757 8361 1 10 . 1 1 147 147 GLY N N 147 110.157 110.157 109.787 0.370 25757 8362 1 10 . 1 1 147 147 GLY C C 147 174.046 174.046 173.990 0.056 25757 8363 1 10 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.674 0.870 25757 8364 1 10 . 1 1 147 147 GLY H H 147 7.793 7.793 8.029 -0.236 25757 8365 1 10 . 1 1 150 150 THR HA H 150 4.239 4.239 4.325 -0.086 25757 8366 1 10 . 1 1 150 150 THR C C 150 174.397 174.397 174.759 -0.362 25757 8367 1 10 . 1 1 150 150 THR CA C 150 61.260 61.260 62.335 -1.075 25757 8368 1 10 . 1 1 150 150 THR CB C 150 70.358 70.358 69.455 0.903 25757 8369 1 10 . 1 1 151 151 ALA N N 151 126.304 126.304 124.494 1.810 25757 8370 1 10 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.715 -0.427 25757 8371 1 10 . 1 1 151 151 ALA C C 151 177.678 177.678 177.809 -0.131 25757 8372 1 10 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.252 0.896 25757 8373 1 10 . 1 1 151 151 ALA CB C 151 19.419 19.419 20.240 -0.821 25757 8374 1 10 . 1 1 151 151 ALA H H 151 8.618 8.618 7.043 1.575 25757 8375 1 10 . 1 1 152 152 ALA N N 152 123.861 123.861 121.695 2.166 25757 8376 1 10 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.307 -0.189 25757 8377 1 10 . 1 1 152 152 ALA C C 152 178.823 178.823 178.314 0.509 25757 8378 1 10 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.538 1.956 25757 8379 1 10 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.123 0.634 25757 8380 1 10 . 1 1 152 152 ALA H H 152 8.354 8.354 8.687 -0.333 25757 8381 1 10 . 1 1 153 153 GLY N N 153 109.984 109.984 107.423 2.561 25757 8382 1 10 . 1 1 153 153 GLY C C 153 174.389 174.389 175.737 -1.348 25757 8383 1 10 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.135 -2.004 25757 8384 1 10 . 1 1 153 153 GLY H H 153 9.028 9.028 8.151 0.877 25757 8385 1 10 . 1 1 154 154 SER N N 154 113.934 113.934 117.193 -3.259 25757 8386 1 10 . 1 1 154 154 SER HA H 154 4.255 4.255 4.045 0.210 25757 8387 1 10 . 1 1 154 154 SER C C 154 177.929 177.929 176.736 1.193 25757 8388 1 10 . 1 1 154 154 SER CA C 154 59.379 59.379 62.109 -2.730 25757 8389 1 10 . 1 1 154 154 SER CB C 154 64.090 64.090 62.745 1.345 25757 8390 1 10 . 1 1 154 154 SER H H 154 7.962 7.962 8.111 -0.149 25757 8391 1 10 . 1 1 155 155 GLY N N 155 115.337 115.337 108.962 6.375 25757 8392 1 10 . 1 1 155 155 GLY C C 155 175.891 175.891 175.661 0.230 25757 8393 1 10 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.880 0.766 25757 8394 1 10 . 1 1 155 155 GLY H H 155 9.451 9.451 7.708 1.743 25757 8395 1 10 . 1 1 156 156 TRP N N 156 119.600 119.600 122.049 -2.449 25757 8396 1 10 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.280 -0.009 25757 8397 1 10 . 1 1 156 156 TRP C C 156 178.947 178.947 178.865 0.082 25757 8398 1 10 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.196 -0.032 25757 8399 1 10 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.107 0.496 25757 8400 1 10 . 1 1 156 156 TRP H H 156 8.542 8.542 7.323 1.219 25757 8401 1 10 . 1 1 157 157 ARG N N 157 118.583 118.583 119.770 -1.187 25757 8402 1 10 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.034 -0.052 25757 8403 1 10 . 1 1 157 157 ARG C C 157 177.894 177.894 178.452 -0.558 25757 8404 1 10 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.250 0.088 25757 8405 1 10 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.903 0.154 25757 8406 1 10 . 1 1 157 157 ARG H H 157 7.747 7.747 8.585 -0.838 25757 8407 1 10 . 1 1 158 158 LYS N N 158 117.033 117.033 120.322 -3.289 25757 8408 1 10 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.078 -0.135 25757 8409 1 10 . 1 1 158 158 LYS C C 158 176.973 176.973 178.566 -1.593 25757 8410 1 10 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.203 1.171 25757 8411 1 10 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.291 -0.000 25757 8412 1 10 . 1 1 158 158 LYS H H 158 7.529 7.529 7.890 -0.361 25757 8413 1 10 . 1 1 159 159 ILE N N 159 116.553 116.553 119.619 -3.066 25757 8414 1 10 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.772 -0.228 25757 8415 1 10 . 1 1 159 159 ILE C C 159 176.894 176.894 177.029 -0.135 25757 8416 1 10 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.346 0.171 25757 8417 1 10 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.956 -0.152 25757 8418 1 10 . 1 1 159 159 ILE H H 159 7.348 7.348 8.446 -1.098 25757 8419 1 10 . 1 1 160 160 LYS N N 160 119.278 119.278 119.800 -0.522 25757 8420 1 10 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.368 -0.329 25757 8421 1 10 . 1 1 160 160 LYS C C 160 178.566 178.566 179.095 -0.529 25757 8422 1 10 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.725 0.649 25757 8423 1 10 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.190 0.628 25757 8424 1 10 . 1 1 160 160 LYS H H 160 8.225 8.225 8.279 -0.054 25757 8425 1 10 . 1 1 161 161 LEU N N 161 117.056 117.056 121.140 -4.084 25757 8426 1 10 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.192 -0.132 25757 8427 1 10 . 1 1 161 161 LEU C C 161 178.977 178.977 179.210 -0.233 25757 8428 1 10 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.696 0.328 25757 8429 1 10 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.951 0.031 25757 8430 1 10 . 1 1 161 161 LEU H H 161 8.057 8.057 8.047 0.010 25757 8431 1 10 . 1 1 162 162 ALA N N 162 121.814 121.814 121.868 -0.054 25757 8432 1 10 . 1 1 162 162 ALA HA H 162 4.092 4.092 3.840 0.252 25757 8433 1 10 . 1 1 162 162 ALA C C 162 178.374 178.374 179.443 -1.069 25757 8434 1 10 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.065 0.725 25757 8435 1 10 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.506 -0.181 25757 8436 1 10 . 1 1 162 162 ALA H H 162 8.170 8.170 8.169 0.001 25757 8437 1 10 . 1 1 163 163 VAL N N 163 115.449 115.449 116.482 -1.033 25757 8438 1 10 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.880 -0.262 25757 8439 1 10 . 1 1 163 163 VAL C C 163 178.362 178.362 177.413 0.949 25757 8440 1 10 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.183 1.089 25757 8441 1 10 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.009 1.028 25757 8442 1 10 . 1 1 163 163 VAL H H 163 8.499 8.499 8.049 0.450 25757 8443 1 10 . 1 1 164 164 ARG N N 164 115.775 115.775 118.085 -2.310 25757 8444 1 10 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.289 -0.092 25757 8445 1 10 . 1 1 164 164 ARG C C 164 178.938 178.938 177.624 1.314 25757 8446 1 10 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.623 -0.940 25757 8447 1 10 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.145 -0.311 25757 8448 1 10 . 1 1 164 164 ARG H H 164 8.165 8.165 8.166 -0.001 25757 8449 1 10 . 1 1 165 165 GLY N N 165 105.570 105.570 106.858 -1.288 25757 8450 1 10 . 1 1 165 165 GLY C C 165 173.134 173.134 175.521 -2.387 25757 8451 1 10 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.646 1.096 25757 8452 1 10 . 1 1 165 165 GLY H H 165 8.455 8.455 7.908 0.547 25757 8453 1 10 . 1 1 166 166 ALA N N 166 120.648 120.648 123.434 -2.786 25757 8454 1 10 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.439 -0.097 25757 8455 1 10 . 1 1 166 166 ALA C C 166 176.155 176.155 177.317 -1.162 25757 8456 1 10 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.242 -2.469 25757 8457 1 10 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.201 0.277 25757 8458 1 10 . 1 1 166 166 ALA H H 166 7.826 7.826 8.155 -0.329 25757 8459 1 10 . 1 1 167 167 GLN N N 167 117.315 117.315 114.380 2.935 25757 8460 1 10 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.629 -0.352 25757 8461 1 10 . 1 1 167 167 GLN C C 167 175.571 175.571 174.758 0.813 25757 8462 1 10 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.156 1.772 25757 8463 1 10 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.975 -0.790 25757 8464 1 10 . 1 1 167 167 GLN H H 167 7.498 7.498 7.353 0.145 25757 8465 1 10 . 1 1 168 168 ALA N N 168 126.706 126.706 122.468 4.238 25757 8466 1 10 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.320 -0.041 25757 8467 1 10 . 1 1 168 168 ALA C C 168 177.227 177.227 177.651 -0.424 25757 8468 1 10 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.149 -1.083 25757 8469 1 10 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.116 0.590 25757 8470 1 10 . 1 1 168 168 ALA H H 168 8.534 8.534 8.465 0.069 25757 8471 1 11 . 1 1 9 9 ILE N N 9 116.733 116.733 121.778 -5.045 25757 8472 1 11 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.179 -0.422 25757 8473 1 11 . 1 1 9 9 ILE C C 9 177.828 177.828 177.609 0.219 25757 8474 1 11 . 1 1 9 9 ILE CA C 9 65.604 65.604 63.058 2.546 25757 8475 1 11 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.245 0.353 25757 8476 1 11 . 1 1 9 9 ILE H H 9 7.366 7.366 8.229 -0.863 25757 8477 1 11 . 1 1 10 10 ALA N N 10 121.080 121.080 122.610 -1.530 25757 8478 1 11 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.040 0.035 25757 8479 1 11 . 1 1 10 10 ALA C C 10 180.921 180.921 179.556 1.365 25757 8480 1 11 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.375 0.228 25757 8481 1 11 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.882 0.102 25757 8482 1 11 . 1 1 10 10 ALA H H 10 8.039 8.039 8.529 -0.490 25757 8483 1 11 . 1 1 11 11 GLU N N 11 119.580 119.580 119.265 0.315 25757 8484 1 11 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.874 0.215 25757 8485 1 11 . 1 1 11 11 GLU C C 11 179.561 179.561 179.124 0.437 25757 8486 1 11 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.048 0.837 25757 8487 1 11 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.127 0.336 25757 8488 1 11 . 1 1 11 11 GLU H H 11 7.741 7.741 7.726 0.015 25757 8489 1 11 . 1 1 12 12 PHE N N 12 118.509 118.509 117.839 0.670 25757 8490 1 11 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.385 0.441 25757 8491 1 11 . 1 1 12 12 PHE C C 12 179.000 179.000 178.427 0.573 25757 8492 1 11 . 1 1 12 12 PHE CA C 12 60.164 60.164 61.089 -0.924 25757 8493 1 11 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.350 -0.240 25757 8494 1 11 . 1 1 12 12 PHE H H 12 8.470 8.470 7.482 0.988 25757 8495 1 11 . 1 1 13 13 LYS N N 13 123.523 123.523 120.000 3.523 25757 8496 1 11 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.091 -0.065 25757 8497 1 11 . 1 1 13 13 LYS C C 13 179.260 179.260 179.013 0.247 25757 8498 1 11 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.896 0.268 25757 8499 1 11 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.055 -0.222 25757 8500 1 11 . 1 1 13 13 LYS H H 13 9.171 9.171 8.805 0.366 25757 8501 1 11 . 1 1 14 14 GLU N N 14 120.415 120.415 118.738 1.677 25757 8502 1 11 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.169 -0.074 25757 8503 1 11 . 1 1 14 14 GLU C C 14 179.851 179.851 178.889 0.962 25757 8504 1 11 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.193 0.393 25757 8505 1 11 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.738 -0.177 25757 8506 1 11 . 1 1 14 14 GLU H H 14 7.822 7.822 8.123 -0.301 25757 8507 1 11 . 1 1 15 15 ALA N N 15 122.143 122.143 122.956 -0.813 25757 8508 1 11 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.124 0.006 25757 8509 1 11 . 1 1 15 15 ALA C C 15 178.222 178.222 179.675 -1.453 25757 8510 1 11 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.407 -0.217 25757 8511 1 11 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.608 -0.105 25757 8512 1 11 . 1 1 15 15 ALA H H 15 8.244 8.244 8.247 -0.003 25757 8513 1 11 . 1 1 16 16 PHE N N 16 119.809 119.809 118.517 1.292 25757 8514 1 11 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.265 -0.253 25757 8515 1 11 . 1 1 16 16 PHE C C 16 177.444 177.444 177.237 0.207 25757 8516 1 11 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.595 1.469 25757 8517 1 11 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.999 -0.567 25757 8518 1 11 . 1 1 16 16 PHE H H 16 8.891 8.891 8.513 0.378 25757 8519 1 11 . 1 1 17 17 SER N N 17 112.631 112.631 116.540 -3.909 25757 8520 1 11 . 1 1 17 17 SER HA H 17 4.034 4.034 3.991 0.043 25757 8521 1 11 . 1 1 17 17 SER C C 17 174.675 174.675 177.054 -2.379 25757 8522 1 11 . 1 1 17 17 SER CA C 17 61.507 61.507 62.023 -0.516 25757 8523 1 11 . 1 1 17 17 SER CB C 17 63.414 63.414 63.287 0.127 25757 8524 1 11 . 1 1 17 17 SER H H 17 7.910 7.910 8.501 -0.591 25757 8525 1 11 . 1 1 18 18 LEU N N 18 120.614 120.614 118.051 2.563 25757 8526 1 11 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.191 -0.179 25757 8527 1 11 . 1 1 18 18 LEU C C 18 177.366 177.366 177.400 -0.034 25757 8528 1 11 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.237 0.149 25757 8529 1 11 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.584 0.011 25757 8530 1 11 . 1 1 18 18 LEU H H 18 7.423 7.423 8.007 -0.584 25757 8531 1 11 . 1 1 19 19 PHE N N 19 114.602 114.602 117.624 -3.022 25757 8532 1 11 . 1 1 19 19 PHE C C 19 176.961 176.961 175.168 1.793 25757 8533 1 11 . 1 1 19 19 PHE CA C 19 59.484 59.484 58.648 0.837 25757 8534 1 11 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.305 1.464 25757 8535 1 11 . 1 1 19 19 PHE H H 19 7.254 7.254 7.331 -0.077 25757 8536 1 11 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.589 -0.014 25757 8537 1 11 . 1 1 22 22 ASP CA C 22 52.648 52.648 53.372 -0.724 25757 8538 1 11 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.421 -0.411 25757 8539 1 11 . 1 1 23 23 GLY N N 23 108.244 108.244 109.020 -0.776 25757 8540 1 11 . 1 1 23 23 GLY C C 23 175.188 175.188 175.352 -0.164 25757 8541 1 11 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.063 1.340 25757 8542 1 11 . 1 1 23 23 GLY H H 23 7.555 7.555 7.861 -0.306 25757 8543 1 11 . 1 1 24 24 ASP N N 24 120.667 120.667 119.875 0.792 25757 8544 1 11 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.458 0.011 25757 8545 1 11 . 1 1 24 24 ASP C C 24 177.457 177.457 177.842 -0.385 25757 8546 1 11 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.863 -0.071 25757 8547 1 11 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.079 -0.563 25757 8548 1 11 . 1 1 24 24 ASP H H 24 8.397 8.397 8.173 0.224 25757 8549 1 11 . 1 1 25 25 GLY N N 25 112.989 112.989 109.016 3.973 25757 8550 1 11 . 1 1 25 25 GLY C C 25 173.639 173.639 173.364 0.275 25757 8551 1 11 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.123 0.378 25757 8552 1 11 . 1 1 25 25 GLY H H 25 10.592 10.592 8.199 2.393 25757 8553 1 11 . 1 1 26 26 THR N N 26 112.948 112.948 113.187 -0.239 25757 8554 1 11 . 1 1 26 26 THR HA H 26 5.282 5.282 4.921 0.361 25757 8555 1 11 . 1 1 26 26 THR C C 26 172.853 172.853 172.754 0.099 25757 8556 1 11 . 1 1 26 26 THR CA C 26 59.817 59.817 61.604 -1.787 25757 8557 1 11 . 1 1 26 26 THR CB C 26 72.465 72.465 71.277 1.188 25757 8558 1 11 . 1 1 26 26 THR H H 26 8.121 8.121 7.675 0.446 25757 8559 1 11 . 1 1 27 27 ILE N N 27 127.195 127.195 124.036 3.159 25757 8560 1 11 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.772 0.141 25757 8561 1 11 . 1 1 27 27 ILE C C 27 176.091 176.091 175.132 0.959 25757 8562 1 11 . 1 1 27 27 ILE CA C 27 60.765 60.765 59.928 0.837 25757 8563 1 11 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.420 -1.715 25757 8564 1 11 . 1 1 27 27 ILE H H 27 9.867 9.867 8.969 0.898 25757 8565 1 11 . 1 1 28 28 THR N N 28 116.655 116.655 121.693 -5.038 25757 8566 1 11 . 1 1 28 28 THR HA H 28 4.790 4.790 4.858 -0.068 25757 8567 1 11 . 1 1 28 28 THR C C 28 176.696 176.696 176.474 0.222 25757 8568 1 11 . 1 1 28 28 THR CA C 28 59.590 59.590 61.181 -1.591 25757 8569 1 11 . 1 1 28 28 THR CB C 28 72.457 72.457 70.540 1.917 25757 8570 1 11 . 1 1 28 28 THR H H 28 8.457 8.457 8.964 -0.507 25757 8571 1 11 . 1 1 29 29 THR N N 29 111.878 111.878 117.340 -5.462 25757 8572 1 11 . 1 1 29 29 THR HA H 29 4.188 4.188 3.858 0.330 25757 8573 1 11 . 1 1 29 29 THR C C 29 177.399 177.399 176.208 1.191 25757 8574 1 11 . 1 1 29 29 THR CA C 29 66.386 66.386 67.302 -0.916 25757 8575 1 11 . 1 1 29 29 THR CB C 29 67.726 67.726 68.526 -0.800 25757 8576 1 11 . 1 1 29 29 THR H H 29 9.211 9.211 8.745 0.466 25757 8577 1 11 . 1 1 30 30 LYS N N 30 121.140 121.140 121.473 -0.333 25757 8578 1 11 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.867 0.210 25757 8579 1 11 . 1 1 30 30 LYS C C 30 179.793 179.793 178.734 1.059 25757 8580 1 11 . 1 1 30 30 LYS CA C 30 59.292 59.292 60.154 -0.862 25757 8581 1 11 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.669 0.778 25757 8582 1 11 . 1 1 30 30 LYS H H 30 7.580 7.580 8.712 -1.132 25757 8583 1 11 . 1 1 31 31 GLU N N 31 121.865 121.865 119.536 2.329 25757 8584 1 11 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.906 0.088 25757 8585 1 11 . 1 1 31 31 GLU C C 31 179.355 179.355 178.994 0.361 25757 8586 1 11 . 1 1 31 31 GLU CA C 31 59.633 59.633 58.964 0.669 25757 8587 1 11 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.125 0.727 25757 8588 1 11 . 1 1 31 31 GLU H H 31 7.708 7.708 8.086 -0.378 25757 8589 1 11 . 1 1 32 32 LEU N N 32 120.597 120.597 120.856 -0.259 25757 8590 1 11 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.986 0.130 25757 8591 1 11 . 1 1 32 32 LEU C C 32 178.885 178.885 178.739 0.146 25757 8592 1 11 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.224 0.137 25757 8593 1 11 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.944 1.092 25757 8594 1 11 . 1 1 32 32 LEU H H 32 8.688 8.688 8.419 0.269 25757 8595 1 11 . 1 1 33 33 GLY N N 33 104.837 104.837 106.390 -1.553 25757 8596 1 11 . 1 1 33 33 GLY C C 33 175.123 175.123 176.204 -1.081 25757 8597 1 11 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.628 0.619 25757 8598 1 11 . 1 1 33 33 GLY H H 33 8.694 8.694 8.697 -0.003 25757 8599 1 11 . 1 1 34 34 THR N N 34 117.631 117.631 118.555 -0.924 25757 8600 1 11 . 1 1 34 34 THR HA H 34 3.899 3.899 3.989 -0.090 25757 8601 1 11 . 1 1 34 34 THR C C 34 176.951 176.951 176.637 0.314 25757 8602 1 11 . 1 1 34 34 THR CA C 34 67.234 67.234 66.857 0.377 25757 8603 1 11 . 1 1 34 34 THR CB C 34 68.863 68.863 68.626 0.236 25757 8604 1 11 . 1 1 34 34 THR H H 34 7.960 7.960 8.029 -0.069 25757 8605 1 11 . 1 1 35 35 VAL N N 35 121.659 121.659 121.071 0.588 25757 8606 1 11 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.935 -0.418 25757 8607 1 11 . 1 1 35 35 VAL C C 35 178.265 178.265 177.453 0.812 25757 8608 1 11 . 1 1 35 35 VAL CA C 35 66.675 66.675 65.647 1.028 25757 8609 1 11 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.557 -0.264 25757 8610 1 11 . 1 1 35 35 VAL H H 35 7.358 7.358 8.090 -0.732 25757 8611 1 11 . 1 1 36 36 MET N N 36 117.456 117.456 113.164 4.292 25757 8612 1 11 . 1 1 36 36 MET C C 36 179.088 179.088 177.177 1.911 25757 8613 1 11 . 1 1 36 36 MET CA C 36 60.477 60.477 57.459 3.018 25757 8614 1 11 . 1 1 36 36 MET CB C 36 32.443 32.443 33.240 -0.797 25757 8615 1 11 . 1 1 36 36 MET H H 36 8.194 8.194 8.036 0.158 25757 8616 1 11 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.122 1.025 25757 8617 1 11 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.672 -0.322 25757 8618 1 11 . 1 1 38 38 SER HA H 38 4.085 4.085 4.292 -0.207 25757 8619 1 11 . 1 1 38 38 SER C C 38 173.788 173.788 174.654 -0.866 25757 8620 1 11 . 1 1 38 38 SER CA C 38 61.617 61.617 60.382 1.235 25757 8621 1 11 . 1 1 38 38 SER CB C 38 62.943 62.943 63.148 -0.205 25757 8622 1 11 . 1 1 39 39 LEU N N 39 119.003 119.003 119.920 -0.917 25757 8623 1 11 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.508 -0.014 25757 8624 1 11 . 1 1 39 39 LEU C C 39 176.470 176.470 177.527 -1.057 25757 8625 1 11 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.888 -0.209 25757 8626 1 11 . 1 1 39 39 LEU CB C 39 41.514 41.514 39.879 1.635 25757 8627 1 11 . 1 1 39 39 LEU H H 39 7.230 7.230 7.504 -0.274 25757 8628 1 11 . 1 1 40 40 GLY N N 40 105.026 105.026 107.980 -2.954 25757 8629 1 11 . 1 1 40 40 GLY C C 40 174.322 174.322 174.033 0.289 25757 8630 1 11 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.382 0.833 25757 8631 1 11 . 1 1 40 40 GLY H H 40 7.698 7.698 7.965 -0.267 25757 8632 1 11 . 1 1 41 41 GLN N N 41 117.929 117.929 119.609 -1.680 25757 8633 1 11 . 1 1 41 41 GLN C C 41 174.557 174.557 174.735 -0.178 25757 8634 1 11 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.647 0.197 25757 8635 1 11 . 1 1 41 41 GLN H H 41 7.866 7.866 7.571 0.295 25757 8636 1 11 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.553 0.183 25757 8637 1 11 . 1 1 43 43 PRO C C 43 177.805 177.805 176.138 1.667 25757 8638 1 11 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.073 -0.568 25757 8639 1 11 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.352 -0.190 25757 8640 1 11 . 1 1 44 44 THR N N 44 113.167 113.167 113.491 -0.324 25757 8641 1 11 . 1 1 44 44 THR HA H 44 4.684 4.684 4.642 0.042 25757 8642 1 11 . 1 1 44 44 THR C C 44 175.139 175.139 175.520 -0.381 25757 8643 1 11 . 1 1 44 44 THR CA C 44 60.556 60.556 59.389 1.167 25757 8644 1 11 . 1 1 44 44 THR CB C 44 71.064 71.064 71.749 -0.685 25757 8645 1 11 . 1 1 44 44 THR H H 44 8.798 8.798 7.567 1.231 25757 8646 1 11 . 1 1 45 45 GLU N N 45 120.673 120.673 121.171 -0.498 25757 8647 1 11 . 1 1 45 45 GLU HA H 45 3.991 3.991 4.023 -0.032 25757 8648 1 11 . 1 1 45 45 GLU C C 45 178.940 178.940 178.925 0.015 25757 8649 1 11 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.305 -0.404 25757 8650 1 11 . 1 1 45 45 GLU CB C 45 29.029 29.029 28.713 0.316 25757 8651 1 11 . 1 1 45 45 GLU H H 45 8.812 8.812 8.962 -0.150 25757 8652 1 11 . 1 1 46 46 ALA N N 46 120.576 120.576 120.661 -0.085 25757 8653 1 11 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.061 -0.094 25757 8654 1 11 . 1 1 46 46 ALA C C 46 180.290 180.290 179.772 0.518 25757 8655 1 11 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.112 -0.193 25757 8656 1 11 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.268 -0.107 25757 8657 1 11 . 1 1 46 46 ALA H H 46 8.276 8.276 8.405 -0.129 25757 8658 1 11 . 1 1 47 47 GLU N N 47 116.104 116.104 118.856 -2.752 25757 8659 1 11 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.001 -0.001 25757 8660 1 11 . 1 1 47 47 GLU C C 47 180.224 180.224 179.059 1.165 25757 8661 1 11 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.082 -0.151 25757 8662 1 11 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.213 0.776 25757 8663 1 11 . 1 1 47 47 GLU H H 47 7.425 7.425 7.621 -0.196 25757 8664 1 11 . 1 1 48 48 LEU N N 48 120.425 120.425 120.094 0.331 25757 8665 1 11 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.929 0.121 25757 8666 1 11 . 1 1 48 48 LEU C C 48 178.551 178.551 179.431 -0.880 25757 8667 1 11 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.203 -0.364 25757 8668 1 11 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.365 1.204 25757 8669 1 11 . 1 1 48 48 LEU H H 48 8.121 8.121 8.041 0.080 25757 8670 1 11 . 1 1 49 49 GLN N N 49 118.372 118.372 118.444 -0.072 25757 8671 1 11 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.875 -0.113 25757 8672 1 11 . 1 1 49 49 GLN C C 49 178.567 178.567 178.458 0.109 25757 8673 1 11 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.239 -0.376 25757 8674 1 11 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.495 -0.253 25757 8675 1 11 . 1 1 49 49 GLN H H 49 8.302 8.302 8.218 0.084 25757 8676 1 11 . 1 1 50 50 ASP N N 50 119.992 119.992 120.478 -0.486 25757 8677 1 11 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.321 0.039 25757 8678 1 11 . 1 1 50 50 ASP C C 50 178.600 178.600 178.422 0.178 25757 8679 1 11 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.451 0.252 25757 8680 1 11 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.944 -0.477 25757 8681 1 11 . 1 1 50 50 ASP H H 50 8.150 8.150 8.227 -0.077 25757 8682 1 11 . 1 1 51 51 MET N N 51 119.238 119.238 118.884 0.354 25757 8683 1 11 . 1 1 51 51 MET HA H 51 3.981 3.981 3.901 0.080 25757 8684 1 11 . 1 1 51 51 MET C C 51 179.006 179.006 178.652 0.354 25757 8685 1 11 . 1 1 51 51 MET CA C 51 59.443 59.443 60.086 -0.643 25757 8686 1 11 . 1 1 51 51 MET CB C 51 33.380 33.380 32.913 0.467 25757 8687 1 11 . 1 1 51 51 MET H H 51 7.844 7.844 7.948 -0.104 25757 8688 1 11 . 1 1 52 52 ILE N N 52 118.161 118.161 118.069 0.092 25757 8689 1 11 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.686 -0.208 25757 8690 1 11 . 1 1 52 52 ILE C C 52 177.847 177.847 178.719 -0.872 25757 8691 1 11 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.536 0.459 25757 8692 1 11 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.661 0.462 25757 8693 1 11 . 1 1 52 52 ILE H H 52 7.686 7.686 8.272 -0.586 25757 8694 1 11 . 1 1 53 53 ASN N N 53 117.884 117.884 118.142 -0.258 25757 8695 1 11 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.453 -0.088 25757 8696 1 11 . 1 1 53 53 ASN C C 53 177.515 177.515 177.966 -0.451 25757 8697 1 11 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.892 0.315 25757 8698 1 11 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.562 -0.484 25757 8699 1 11 . 1 1 53 53 ASN H H 53 8.713 8.713 8.496 0.217 25757 8700 1 11 . 1 1 54 54 GLU N N 54 116.178 116.178 118.276 -2.098 25757 8701 1 11 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.293 -0.304 25757 8702 1 11 . 1 1 54 54 GLU C C 54 177.557 177.557 177.326 0.231 25757 8703 1 11 . 1 1 54 54 GLU CA C 54 58.990 58.990 58.010 0.980 25757 8704 1 11 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.137 0.326 25757 8705 1 11 . 1 1 54 54 GLU H H 54 7.530 7.530 8.085 -0.555 25757 8706 1 11 . 1 1 55 55 VAL N N 55 107.164 107.164 111.757 -4.593 25757 8707 1 11 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.330 0.192 25757 8708 1 11 . 1 1 55 55 VAL C C 55 175.602 175.602 174.582 1.020 25757 8709 1 11 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.613 -0.261 25757 8710 1 11 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.484 1.119 25757 8711 1 11 . 1 1 55 55 VAL H H 55 7.175 7.175 7.571 -0.396 25757 8712 1 11 . 1 1 56 56 ASP N N 56 122.126 122.126 120.856 1.270 25757 8713 1 11 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.873 -0.274 25757 8714 1 11 . 1 1 56 56 ASP C C 56 176.182 176.182 175.564 0.618 25757 8715 1 11 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.348 0.458 25757 8716 1 11 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.464 -2.194 25757 8717 1 11 . 1 1 56 56 ASP H H 56 7.569 7.569 7.349 0.220 25757 8718 1 11 . 1 1 57 57 ALA N N 57 103.782 103.782 128.679 -24.897 25757 8719 1 11 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.316 -0.136 25757 8720 1 11 . 1 1 57 57 ALA C C 57 178.584 178.584 178.166 0.418 25757 8721 1 11 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.230 1.113 25757 8722 1 11 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.759 -0.235 25757 8723 1 11 . 1 1 57 57 ALA H H 57 8.515 8.515 8.675 -0.160 25757 8724 1 11 . 1 1 58 58 ASP N N 58 113.602 113.602 118.331 -4.729 25757 8725 1 11 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.615 -0.029 25757 8726 1 11 . 1 1 58 58 ASP C C 58 177.756 177.756 176.937 0.819 25757 8727 1 11 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.628 -1.866 25757 8728 1 11 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.560 -1.882 25757 8729 1 11 . 1 1 58 58 ASP H H 58 8.130 8.130 8.161 -0.031 25757 8730 1 11 . 1 1 59 59 GLY N N 59 109.195 109.195 109.551 -0.356 25757 8731 1 11 . 1 1 59 59 GLY C C 59 175.139 175.139 174.347 0.792 25757 8732 1 11 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.098 2.166 25757 8733 1 11 . 1 1 59 59 GLY H H 59 7.694 7.694 8.181 -0.487 25757 8734 1 11 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.856 -0.251 25757 8735 1 11 . 1 1 61 61 GLY N N 61 113.316 113.316 108.696 4.620 25757 8736 1 11 . 1 1 61 61 GLY C C 61 173.234 173.234 173.186 0.048 25757 8737 1 11 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.109 -0.411 25757 8738 1 11 . 1 1 61 61 GLY H H 61 10.633 10.633 8.536 2.097 25757 8739 1 11 . 1 1 62 62 THR N N 62 108.892 108.892 109.448 -0.556 25757 8740 1 11 . 1 1 62 62 THR HA H 62 4.736 4.736 5.058 -0.322 25757 8741 1 11 . 1 1 62 62 THR C C 62 173.091 173.091 173.139 -0.048 25757 8742 1 11 . 1 1 62 62 THR CA C 62 59.617 59.617 59.519 0.098 25757 8743 1 11 . 1 1 62 62 THR CB C 62 72.004 72.004 72.403 -0.399 25757 8744 1 11 . 1 1 62 62 THR H H 62 7.673 7.673 7.979 -0.306 25757 8745 1 11 . 1 1 63 63 ILE N N 63 123.324 123.324 123.425 -0.101 25757 8746 1 11 . 1 1 63 63 ILE HA H 63 5.129 5.129 5.096 0.033 25757 8747 1 11 . 1 1 63 63 ILE C C 63 175.652 175.652 174.044 1.608 25757 8748 1 11 . 1 1 63 63 ILE CA C 63 60.486 60.486 58.701 1.785 25757 8749 1 11 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.242 -1.285 25757 8750 1 11 . 1 1 63 63 ILE H H 63 8.907 8.907 8.836 0.071 25757 8751 1 11 . 1 1 64 64 ASP N N 64 128.253 128.253 129.485 -1.232 25757 8752 1 11 . 1 1 64 64 ASP HA H 64 5.321 5.321 5.139 0.182 25757 8753 1 11 . 1 1 64 64 ASP C C 64 176.431 176.431 177.393 -0.962 25757 8754 1 11 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.159 -0.828 25757 8755 1 11 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.489 -0.435 25757 8756 1 11 . 1 1 64 64 ASP H H 64 8.864 8.864 9.235 -0.371 25757 8757 1 11 . 1 1 65 65 PHE N N 65 118.583 118.583 121.704 -3.121 25757 8758 1 11 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.104 -0.244 25757 8759 1 11 . 1 1 65 65 PHE C C 65 173.458 173.458 173.992 -0.534 25757 8760 1 11 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.824 1.975 25757 8761 1 11 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.396 -0.516 25757 8762 1 11 . 1 1 65 65 PHE H H 65 8.962 8.962 8.805 0.157 25757 8763 1 11 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.649 0.469 25757 8764 1 11 . 1 1 66 66 PRO C C 66 180.038 180.038 178.202 1.836 25757 8765 1 11 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.534 2.156 25757 8766 1 11 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.624 0.053 25757 8767 1 11 . 1 1 67 67 GLU N N 67 118.402 118.402 120.023 -1.621 25757 8768 1 11 . 1 1 67 67 GLU C C 67 178.737 178.737 178.170 0.567 25757 8769 1 11 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.281 -0.273 25757 8770 1 11 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.654 0.031 25757 8771 1 11 . 1 1 67 67 GLU H H 67 7.953 7.953 7.480 0.473 25757 8772 1 11 . 1 1 68 68 PHE N N 68 123.421 123.421 121.554 1.867 25757 8773 1 11 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.108 -0.136 25757 8774 1 11 . 1 1 68 68 PHE C C 68 177.184 177.184 177.032 0.152 25757 8775 1 11 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.530 -0.192 25757 8776 1 11 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.149 0.820 25757 8777 1 11 . 1 1 68 68 PHE H H 68 8.928 8.928 7.877 1.051 25757 8778 1 11 . 1 1 69 69 LEU N N 69 119.284 119.284 118.602 0.682 25757 8779 1 11 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.590 -0.255 25757 8780 1 11 . 1 1 69 69 LEU C C 69 178.987 178.987 178.416 0.571 25757 8781 1 11 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.876 -1.014 25757 8782 1 11 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.634 -0.802 25757 8783 1 11 . 1 1 69 69 LEU H H 69 8.374 8.374 7.741 0.633 25757 8784 1 11 . 1 1 70 70 THR N N 70 116.017 116.017 114.216 1.801 25757 8785 1 11 . 1 1 70 70 THR HA H 70 4.338 4.338 3.656 0.682 25757 8786 1 11 . 1 1 70 70 THR C C 70 176.169 176.169 175.989 0.180 25757 8787 1 11 . 1 1 70 70 THR CA C 70 66.700 66.700 66.561 0.139 25757 8788 1 11 . 1 1 70 70 THR CB C 70 68.379 68.379 68.588 -0.210 25757 8789 1 11 . 1 1 70 70 THR H H 70 7.493 7.493 7.311 0.182 25757 8790 1 11 . 1 1 71 71 MET N N 71 121.915 121.915 121.998 -0.083 25757 8791 1 11 . 1 1 71 71 MET HA H 71 3.718 3.718 4.013 -0.295 25757 8792 1 11 . 1 1 71 71 MET C C 71 178.190 178.190 178.288 -0.098 25757 8793 1 11 . 1 1 71 71 MET CA C 71 59.335 59.335 58.452 0.883 25757 8794 1 11 . 1 1 71 71 MET CB C 71 33.894 33.894 32.344 1.550 25757 8795 1 11 . 1 1 71 71 MET H H 71 7.924 7.924 7.779 0.145 25757 8796 1 11 . 1 1 72 72 MET N N 72 116.973 116.973 115.660 1.313 25757 8797 1 11 . 1 1 72 72 MET HA H 72 3.968 3.968 4.162 -0.194 25757 8798 1 11 . 1 1 72 72 MET C C 72 178.211 178.211 178.146 0.065 25757 8799 1 11 . 1 1 72 72 MET CA C 72 56.059 56.059 58.375 -2.316 25757 8800 1 11 . 1 1 72 72 MET CB C 72 31.639 31.639 31.692 -0.052 25757 8801 1 11 . 1 1 72 72 MET H H 72 8.276 8.276 7.838 0.438 25757 8802 1 11 . 1 1 73 73 ALA N N 73 122.499 122.499 123.494 -0.995 25757 8803 1 11 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.946 0.004 25757 8804 1 11 . 1 1 73 73 ALA C C 73 180.231 180.231 179.678 0.553 25757 8805 1 11 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.858 0.096 25757 8806 1 11 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.644 0.388 25757 8807 1 11 . 1 1 73 73 ALA H H 73 8.240 8.240 8.326 -0.086 25757 8808 1 11 . 1 1 74 74 ARG N N 74 116.098 116.098 118.921 -2.823 25757 8809 1 11 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.024 -0.032 25757 8810 1 11 . 1 1 74 74 ARG C C 74 178.567 178.567 178.462 0.105 25757 8811 1 11 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.401 0.424 25757 8812 1 11 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.910 0.165 25757 8813 1 11 . 1 1 74 74 ARG H H 74 7.420 7.420 7.799 -0.379 25757 8814 1 11 . 1 1 75 75 LYS N N 75 119.046 119.046 120.922 -1.876 25757 8815 1 11 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.080 -0.037 25757 8816 1 11 . 1 1 75 75 LYS C C 75 179.045 179.045 178.853 0.192 25757 8817 1 11 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.440 -0.551 25757 8818 1 11 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.904 -0.138 25757 8819 1 11 . 1 1 75 75 LYS H H 75 7.862 7.862 8.092 -0.230 25757 8820 1 11 . 1 1 76 76 MET N N 76 116.772 116.772 117.210 -0.438 25757 8821 1 11 . 1 1 76 76 MET H H 76 8.099 8.099 8.031 0.068 25757 8822 1 11 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.795 -0.161 25757 8823 1 11 . 1 1 78 78 ASP C C 78 176.395 176.395 176.769 -0.374 25757 8824 1 11 . 1 1 78 78 ASP CA C 78 54.644 54.644 53.109 1.535 25757 8825 1 11 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.308 0.166 25757 8826 1 11 . 1 1 79 79 THR N N 79 113.904 113.904 115.578 -1.674 25757 8827 1 11 . 1 1 79 79 THR HA H 79 4.215 4.215 4.071 0.144 25757 8828 1 11 . 1 1 79 79 THR C C 79 174.204 174.204 175.171 -0.967 25757 8829 1 11 . 1 1 79 79 THR CA C 79 62.264 62.264 63.737 -1.473 25757 8830 1 11 . 1 1 79 79 THR CB C 79 69.884 69.884 69.034 0.850 25757 8831 1 11 . 1 1 79 79 THR H H 79 8.039 8.039 8.409 -0.370 25757 8832 1 11 . 1 1 80 80 ASP N N 80 123.572 123.572 124.236 -0.664 25757 8833 1 11 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.810 -0.090 25757 8834 1 11 . 1 1 80 80 ASP C C 80 176.221 176.221 176.499 -0.278 25757 8835 1 11 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.677 -0.362 25757 8836 1 11 . 1 1 80 80 ASP CB C 80 41.427 41.427 39.498 1.929 25757 8837 1 11 . 1 1 80 80 ASP H H 80 8.441 8.441 7.983 0.458 25757 8838 1 11 . 1 1 81 81 SER N N 81 117.879 117.879 118.583 -0.704 25757 8839 1 11 . 1 1 81 81 SER HA H 81 3.925 3.925 4.499 -0.574 25757 8840 1 11 . 1 1 81 81 SER C C 81 175.264 175.264 175.225 0.039 25757 8841 1 11 . 1 1 81 81 SER CA C 81 58.860 58.860 59.136 -0.276 25757 8842 1 11 . 1 1 81 81 SER CB C 81 63.790 63.790 63.727 0.063 25757 8843 1 11 . 1 1 81 81 SER H H 81 8.503 8.503 8.130 0.373 25757 8844 1 11 . 1 1 82 82 GLU N N 82 123.206 123.206 122.195 1.011 25757 8845 1 11 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.937 0.121 25757 8846 1 11 . 1 1 82 82 GLU C C 82 178.378 178.378 177.988 0.390 25757 8847 1 11 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.397 -0.811 25757 8848 1 11 . 1 1 82 82 GLU CB C 82 29.603 29.603 28.977 0.626 25757 8849 1 11 . 1 1 82 82 GLU H H 82 8.563 8.563 8.639 -0.076 25757 8850 1 11 . 1 1 83 83 GLU N N 83 119.262 119.262 119.471 -0.209 25757 8851 1 11 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.859 0.098 25757 8852 1 11 . 1 1 83 83 GLU C C 83 178.606 178.606 178.420 0.186 25757 8853 1 11 . 1 1 83 83 GLU CA C 83 59.669 59.669 60.024 -0.355 25757 8854 1 11 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.476 -0.121 25757 8855 1 11 . 1 1 83 83 GLU H H 83 7.728 7.728 8.463 -0.735 25757 8856 1 11 . 1 1 84 84 GLU N N 84 118.432 118.432 119.177 -0.745 25757 8857 1 11 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.009 0.098 25757 8858 1 11 . 1 1 84 84 GLU C C 84 179.436 179.436 179.183 0.253 25757 8859 1 11 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.252 0.251 25757 8860 1 11 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.472 -0.365 25757 8861 1 11 . 1 1 84 84 GLU H H 84 8.346 8.346 8.249 0.097 25757 8862 1 11 . 1 1 85 85 ILE N N 85 120.925 120.925 120.417 0.508 25757 8863 1 11 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.744 0.004 25757 8864 1 11 . 1 1 85 85 ILE C C 85 177.661 177.661 178.009 -0.348 25757 8865 1 11 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.639 -0.149 25757 8866 1 11 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.703 -0.272 25757 8867 1 11 . 1 1 85 85 ILE H H 85 7.821 7.821 8.296 -0.475 25757 8868 1 11 . 1 1 86 86 ARG N N 86 121.916 121.916 118.605 3.311 25757 8869 1 11 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.695 0.441 25757 8870 1 11 . 1 1 86 86 ARG C C 86 179.208 179.208 178.932 0.276 25757 8871 1 11 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.446 0.925 25757 8872 1 11 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.728 0.370 25757 8873 1 11 . 1 1 86 86 ARG H H 86 8.432 8.432 8.137 0.295 25757 8874 1 11 . 1 1 87 87 GLU N N 87 118.261 118.261 118.546 -0.285 25757 8875 1 11 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.923 0.189 25757 8876 1 11 . 1 1 87 87 GLU C C 87 178.516 178.516 178.624 -0.108 25757 8877 1 11 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.175 -0.149 25757 8878 1 11 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.132 0.038 25757 8879 1 11 . 1 1 87 87 GLU H H 87 8.225 8.225 8.052 0.173 25757 8880 1 11 . 1 1 88 88 ALA N N 88 121.009 121.009 122.616 -1.607 25757 8881 1 11 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.475 0.352 25757 8882 1 11 . 1 1 88 88 ALA C C 88 177.947 177.947 178.074 -0.127 25757 8883 1 11 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.842 0.019 25757 8884 1 11 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.232 -0.277 25757 8885 1 11 . 1 1 88 88 ALA H H 88 7.789 7.789 7.986 -0.197 25757 8886 1 11 . 1 1 89 89 PHE N N 89 117.164 117.164 118.442 -1.278 25757 8887 1 11 . 1 1 89 89 PHE C C 89 176.134 176.134 177.306 -1.172 25757 8888 1 11 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.418 2.232 25757 8889 1 11 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.943 -0.050 25757 8890 1 11 . 1 1 89 89 PHE H H 89 8.337 8.337 7.414 0.923 25757 8891 1 11 . 1 1 90 90 ARG N N 90 114.900 114.900 117.500 -2.600 25757 8892 1 11 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.940 -0.026 25757 8893 1 11 . 1 1 90 90 ARG C C 90 178.296 178.296 177.412 0.884 25757 8894 1 11 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.729 1.350 25757 8895 1 11 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.152 -0.059 25757 8896 1 11 . 1 1 90 90 ARG H H 90 7.681 7.681 7.756 -0.075 25757 8897 1 11 . 1 1 91 91 VAL N N 91 116.927 116.927 115.528 1.399 25757 8898 1 11 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.902 -0.295 25757 8899 1 11 . 1 1 91 91 VAL C C 91 177.964 177.964 177.323 0.641 25757 8900 1 11 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.743 1.217 25757 8901 1 11 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.131 0.488 25757 8902 1 11 . 1 1 91 91 VAL H H 91 7.405 7.405 7.501 -0.096 25757 8903 1 11 . 1 1 92 92 PHE N N 92 119.026 119.026 117.629 1.397 25757 8904 1 11 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.330 0.032 25757 8905 1 11 . 1 1 92 92 PHE C C 92 177.639 177.639 176.192 1.447 25757 8906 1 11 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.451 -0.730 25757 8907 1 11 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.753 -0.326 25757 8908 1 11 . 1 1 92 92 PHE H H 92 7.886 7.886 7.478 0.408 25757 8909 1 11 . 1 1 93 93 ASP N N 93 118.238 118.238 118.870 -0.632 25757 8910 1 11 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.865 -0.403 25757 8911 1 11 . 1 1 93 93 ASP C C 93 176.979 176.979 176.532 0.447 25757 8912 1 11 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.800 -0.652 25757 8913 1 11 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.619 -1.470 25757 8914 1 11 . 1 1 93 93 ASP H H 93 8.009 8.009 7.389 0.620 25757 8915 1 11 . 1 1 94 94 LYS N N 94 125.792 125.792 124.747 1.045 25757 8916 1 11 . 1 1 94 94 LYS C C 94 178.213 178.213 177.518 0.695 25757 8917 1 11 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.991 0.327 25757 8918 1 11 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.647 -1.619 25757 8919 1 11 . 1 1 94 94 LYS H H 94 7.428 7.428 7.950 -0.522 25757 8920 1 11 . 1 1 95 95 ASP N N 95 113.833 113.833 116.898 -3.065 25757 8921 1 11 . 1 1 95 95 ASP C C 95 177.718 177.718 176.753 0.965 25757 8922 1 11 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.286 -1.341 25757 8923 1 11 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.522 -0.779 25757 8924 1 11 . 1 1 95 95 ASP H H 95 8.159 8.159 8.414 -0.255 25757 8925 1 11 . 1 1 96 96 GLY N N 96 109.414 109.414 108.142 1.272 25757 8926 1 11 . 1 1 96 96 GLY C C 96 175.093 175.093 175.064 0.029 25757 8927 1 11 . 1 1 96 96 GLY CA C 96 47.254 47.254 46.097 1.157 25757 8928 1 11 . 1 1 96 96 GLY H H 96 7.848 7.848 8.237 -0.389 25757 8929 1 11 . 1 1 97 97 ASN N N 97 119.590 119.590 117.313 2.277 25757 8930 1 11 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.517 0.095 25757 8931 1 11 . 1 1 97 97 ASN C C 97 175.937 175.937 176.364 -0.427 25757 8932 1 11 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.217 -0.329 25757 8933 1 11 . 1 1 97 97 ASN CB C 97 38.320 38.320 38.860 -0.540 25757 8934 1 11 . 1 1 97 97 ASN H H 97 8.338 8.338 8.340 -0.002 25757 8935 1 11 . 1 1 98 98 GLY N N 98 112.940 112.940 108.128 4.812 25757 8936 1 11 . 1 1 98 98 GLY C C 98 172.429 172.429 172.495 -0.066 25757 8937 1 11 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.009 0.083 25757 8938 1 11 . 1 1 98 98 GLY H H 98 10.695 10.695 8.960 1.735 25757 8939 1 11 . 1 1 99 99 TYR N N 99 115.544 115.544 118.075 -2.531 25757 8940 1 11 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.365 -0.278 25757 8941 1 11 . 1 1 99 99 TYR C C 99 174.859 174.859 174.911 -0.052 25757 8942 1 11 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.910 -0.892 25757 8943 1 11 . 1 1 99 99 TYR CB C 99 43.353 43.353 41.837 1.516 25757 8944 1 11 . 1 1 99 99 TYR H H 99 7.597 7.597 7.914 -0.317 25757 8945 1 11 . 1 1 100 100 ILE N N 100 127.078 127.078 124.296 2.782 25757 8946 1 11 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.671 0.118 25757 8947 1 11 . 1 1 100 100 ILE C C 100 175.387 175.387 176.177 -0.790 25757 8948 1 11 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.327 -0.321 25757 8949 1 11 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.927 -1.137 25757 8950 1 11 . 1 1 100 100 ILE H H 100 10.267 10.267 9.397 0.870 25757 8951 1 11 . 1 1 101 101 SER N N 101 124.102 124.102 122.040 2.062 25757 8952 1 11 . 1 1 101 101 SER HA H 101 4.417 4.417 5.317 -0.900 25757 8953 1 11 . 1 1 101 101 SER C C 101 175.360 175.360 175.217 0.143 25757 8954 1 11 . 1 1 101 101 SER CA C 101 56.036 56.036 56.464 -0.428 25757 8955 1 11 . 1 1 101 101 SER CB C 101 66.896 66.896 66.421 0.475 25757 8956 1 11 . 1 1 101 101 SER H H 101 8.985 8.985 7.867 1.118 25757 8957 1 11 . 1 1 102 102 ALA N N 102 122.780 122.780 123.987 -1.207 25757 8958 1 11 . 1 1 102 102 ALA HA H 102 3.744 3.744 4.048 -0.304 25757 8959 1 11 . 1 1 102 102 ALA C C 102 179.175 179.175 178.635 0.540 25757 8960 1 11 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.229 1.061 25757 8961 1 11 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.309 -0.282 25757 8962 1 11 . 1 1 102 102 ALA H H 102 9.269 9.269 9.157 0.112 25757 8963 1 11 . 1 1 103 103 ALA N N 103 118.513 118.513 121.816 -3.303 25757 8964 1 11 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.905 0.106 25757 8965 1 11 . 1 1 103 103 ALA C C 103 181.521 181.521 178.889 2.632 25757 8966 1 11 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.365 -0.011 25757 8967 1 11 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.280 0.011 25757 8968 1 11 . 1 1 103 103 ALA H H 103 8.321 8.321 8.331 -0.010 25757 8969 1 11 . 1 1 104 104 GLU N N 104 119.550 119.550 118.823 0.727 25757 8970 1 11 . 1 1 104 104 GLU HA H 104 4.006 4.006 3.912 0.094 25757 8971 1 11 . 1 1 104 104 GLU C C 104 179.750 179.750 178.642 1.108 25757 8972 1 11 . 1 1 104 104 GLU CA C 104 59.169 59.169 58.524 0.645 25757 8973 1 11 . 1 1 104 104 GLU CB C 104 29.215 29.215 28.590 0.625 25757 8974 1 11 . 1 1 104 104 GLU H H 104 7.867 7.867 7.992 -0.125 25757 8975 1 11 . 1 1 105 105 LEU N N 105 122.688 122.688 121.698 0.990 25757 8976 1 11 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.855 0.063 25757 8977 1 11 . 1 1 105 105 LEU C C 105 178.233 178.233 178.838 -0.605 25757 8978 1 11 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.075 -0.341 25757 8979 1 11 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.692 0.328 25757 8980 1 11 . 1 1 105 105 LEU H H 105 8.746 8.746 8.105 0.641 25757 8981 1 11 . 1 1 106 106 ARG N N 106 118.835 118.835 117.727 1.108 25757 8982 1 11 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.787 -0.137 25757 8983 1 11 . 1 1 106 106 ARG C C 106 178.742 178.742 178.829 -0.087 25757 8984 1 11 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.992 -0.029 25757 8985 1 11 . 1 1 106 106 ARG CB C 106 30.046 30.046 30.065 -0.019 25757 8986 1 11 . 1 1 106 106 ARG H H 106 8.684 8.684 7.882 0.802 25757 8987 1 11 . 1 1 107 107 HIS N N 107 119.258 119.258 118.726 0.532 25757 8988 1 11 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.299 -0.032 25757 8989 1 11 . 1 1 107 107 HIS C C 107 177.244 177.244 178.070 -0.826 25757 8990 1 11 . 1 1 107 107 HIS CA C 107 60.152 60.152 59.201 0.951 25757 8991 1 11 . 1 1 107 107 HIS CB C 107 30.575 30.575 30.027 0.548 25757 8992 1 11 . 1 1 107 107 HIS H H 107 7.691 7.691 8.316 -0.625 25757 8993 1 11 . 1 1 108 108 VAL N N 108 118.996 118.996 121.026 -2.030 25757 8994 1 11 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.789 -0.351 25757 8995 1 11 . 1 1 108 108 VAL C C 108 177.998 177.998 178.194 -0.196 25757 8996 1 11 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.710 -0.279 25757 8997 1 11 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.693 -0.269 25757 8998 1 11 . 1 1 108 108 VAL H H 108 7.599 7.599 8.337 -0.738 25757 8999 1 11 . 1 1 109 109 MET N N 109 114.880 114.880 117.860 -2.980 25757 9000 1 11 . 1 1 109 109 MET C C 109 179.119 179.119 178.797 0.322 25757 9001 1 11 . 1 1 109 109 MET CA C 109 56.979 56.979 57.296 -0.317 25757 9002 1 11 . 1 1 109 109 MET CB C 109 29.253 29.253 31.477 -2.224 25757 9003 1 11 . 1 1 109 109 MET H H 109 7.911 7.911 8.201 -0.290 25757 9004 1 11 . 1 1 110 110 THR N N 110 116.943 116.943 114.152 2.791 25757 9005 1 11 . 1 1 110 110 THR HA H 110 4.229 4.229 4.073 0.156 25757 9006 1 11 . 1 1 110 110 THR C C 110 178.506 178.506 176.641 1.865 25757 9007 1 11 . 1 1 110 110 THR CA C 110 66.573 66.573 65.010 1.563 25757 9008 1 11 . 1 1 110 110 THR CB C 110 68.575 68.575 68.559 0.016 25757 9009 1 11 . 1 1 110 110 THR H H 110 8.353 8.353 8.050 0.303 25757 9010 1 11 . 1 1 111 111 ASN N N 111 123.829 123.829 119.554 4.275 25757 9011 1 11 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.377 -0.015 25757 9012 1 11 . 1 1 111 111 ASN C C 111 177.197 177.197 177.317 -0.120 25757 9013 1 11 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.865 0.094 25757 9014 1 11 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.564 -1.341 25757 9015 1 11 . 1 1 111 111 ASN H H 111 8.053 8.053 7.877 0.176 25757 9016 1 11 . 1 1 112 112 LEU N N 112 119.036 119.036 116.460 2.576 25757 9017 1 11 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.157 0.013 25757 9018 1 11 . 1 1 112 112 LEU C C 112 176.377 176.377 177.184 -0.807 25757 9019 1 11 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.424 -0.919 25757 9020 1 11 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.640 -0.280 25757 9021 1 11 . 1 1 112 112 LEU H H 112 7.794 7.794 7.613 0.181 25757 9022 1 11 . 1 1 113 113 GLY N N 113 106.045 106.045 104.979 1.066 25757 9023 1 11 . 1 1 113 113 GLY C C 113 174.248 174.248 174.269 -0.021 25757 9024 1 11 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.536 0.771 25757 9025 1 11 . 1 1 113 113 GLY H H 113 7.741 7.741 7.633 0.108 25757 9026 1 11 . 1 1 114 114 GLU N N 114 120.556 120.556 120.820 -0.264 25757 9027 1 11 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.056 0.254 25757 9028 1 11 . 1 1 114 114 GLU C C 114 174.993 174.993 176.058 -1.065 25757 9029 1 11 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.740 -2.103 25757 9030 1 11 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.737 1.480 25757 9031 1 11 . 1 1 114 114 GLU H H 114 7.980 7.980 7.874 0.106 25757 9032 1 11 . 1 1 115 115 LYS N N 115 124.986 124.986 126.699 -1.713 25757 9033 1 11 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.232 0.102 25757 9034 1 11 . 1 1 115 115 LYS C C 115 175.285 175.285 176.067 -0.782 25757 9035 1 11 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.339 -0.758 25757 9036 1 11 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.184 -0.211 25757 9037 1 11 . 1 1 115 115 LYS H H 115 8.613 8.613 8.343 0.270 25757 9038 1 11 . 1 1 116 116 LEU N N 116 125.243 125.243 123.091 2.152 25757 9039 1 11 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.850 -0.162 25757 9040 1 11 . 1 1 116 116 LEU C C 116 178.365 178.365 176.451 1.914 25757 9041 1 11 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.174 1.174 25757 9042 1 11 . 1 1 116 116 LEU CB C 116 44.289 44.289 42.739 1.550 25757 9043 1 11 . 1 1 116 116 LEU H H 116 8.066 8.066 8.164 -0.098 25757 9044 1 11 . 1 1 117 117 THR N N 117 114.324 114.324 112.976 1.348 25757 9045 1 11 . 1 1 117 117 THR HA H 117 4.713 4.713 4.552 0.161 25757 9046 1 11 . 1 1 117 117 THR C C 117 175.539 175.539 174.738 0.801 25757 9047 1 11 . 1 1 117 117 THR CA C 117 60.756 60.756 60.158 0.598 25757 9048 1 11 . 1 1 117 117 THR CB C 117 71.144 71.144 71.230 -0.086 25757 9049 1 11 . 1 1 117 117 THR H H 117 9.228 9.228 7.974 1.254 25757 9050 1 11 . 1 1 118 118 ASP N N 118 121.016 121.016 123.842 -2.826 25757 9051 1 11 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.327 -0.172 25757 9052 1 11 . 1 1 118 118 ASP H H 118 8.919 8.919 8.762 0.157 25757 9053 1 11 . 1 1 119 119 GLU N N 119 121.016 121.016 119.238 1.778 25757 9054 1 11 . 1 1 119 119 GLU C C 119 179.204 179.204 178.620 0.584 25757 9055 1 11 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.446 -1.376 25757 9056 1 11 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.542 -0.498 25757 9057 1 11 . 1 1 119 119 GLU H H 119 8.919 8.919 7.711 1.208 25757 9058 1 11 . 1 1 120 120 GLU N N 120 120.566 120.566 119.773 0.793 25757 9059 1 11 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.905 0.096 25757 9060 1 11 . 1 1 120 120 GLU C C 120 180.329 180.329 178.876 1.453 25757 9061 1 11 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.517 -0.426 25757 9062 1 11 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.563 1.075 25757 9063 1 11 . 1 1 120 120 GLU H H 120 7.732 7.732 7.497 0.235 25757 9064 1 11 . 1 1 121 121 VAL N N 121 121.875 121.875 118.759 3.116 25757 9065 1 11 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.557 -0.092 25757 9066 1 11 . 1 1 121 121 VAL C C 121 177.477 177.477 177.796 -0.319 25757 9067 1 11 . 1 1 121 121 VAL CA C 121 67.171 67.171 65.976 1.195 25757 9068 1 11 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.064 0.370 25757 9069 1 11 . 1 1 121 121 VAL H H 121 8.104 8.104 7.447 0.657 25757 9070 1 11 . 1 1 122 122 ASP N N 122 120.566 120.566 119.698 0.868 25757 9071 1 11 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.243 0.092 25757 9072 1 11 . 1 1 122 122 ASP C C 122 179.298 179.298 178.379 0.919 25757 9073 1 11 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.779 0.060 25757 9074 1 11 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.890 -0.578 25757 9075 1 11 . 1 1 122 122 ASP H H 122 8.089 8.089 8.209 -0.120 25757 9076 1 11 . 1 1 123 123 GLU N N 123 119.821 119.821 118.804 1.017 25757 9077 1 11 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.016 0.033 25757 9078 1 11 . 1 1 123 123 GLU C C 123 178.749 178.749 179.087 -0.338 25757 9079 1 11 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.962 0.355 25757 9080 1 11 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.436 -0.050 25757 9081 1 11 . 1 1 123 123 GLU H H 123 8.105 8.105 8.250 -0.145 25757 9082 1 11 . 1 1 124 124 MET N N 124 119.288 119.288 120.204 -0.916 25757 9083 1 11 . 1 1 124 124 MET C C 124 180.865 180.865 178.836 2.029 25757 9084 1 11 . 1 1 124 124 MET CA C 124 60.684 60.684 59.398 1.286 25757 9085 1 11 . 1 1 124 124 MET CB C 124 33.141 33.141 32.503 0.638 25757 9086 1 11 . 1 1 124 124 MET H H 124 7.726 7.726 8.053 -0.327 25757 9087 1 11 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.981 -0.252 25757 9088 1 11 . 1 1 125 125 ILE C C 125 177.341 177.341 177.845 -0.504 25757 9089 1 11 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.917 -0.116 25757 9090 1 11 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.130 -1.565 25757 9091 1 11 . 1 1 126 126 ARG N N 126 118.555 118.555 119.230 -0.675 25757 9092 1 11 . 1 1 126 126 ARG C C 126 179.164 179.164 177.824 1.340 25757 9093 1 11 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.247 0.677 25757 9094 1 11 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.911 -0.046 25757 9095 1 11 . 1 1 126 126 ARG H H 126 8.380 8.380 8.154 0.226 25757 9096 1 11 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.382 -0.457 25757 9097 1 11 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.780 1.277 25757 9098 1 11 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.354 0.474 25757 9099 1 11 . 1 1 128 128 ALA N N 128 116.764 116.764 120.225 -3.461 25757 9100 1 11 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.205 0.212 25757 9101 1 11 . 1 1 128 128 ALA C C 128 177.885 177.885 176.675 1.210 25757 9102 1 11 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.630 -0.674 25757 9103 1 11 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.705 2.862 25757 9104 1 11 . 1 1 128 128 ALA H H 128 7.152 7.152 7.769 -0.617 25757 9105 1 11 . 1 1 129 129 ASP N N 129 117.762 117.762 117.651 0.111 25757 9106 1 11 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.311 -0.834 25757 9107 1 11 . 1 1 129 129 ASP C C 129 175.935 175.935 176.527 -0.592 25757 9108 1 11 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.176 2.339 25757 9109 1 11 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.513 -0.768 25757 9110 1 11 . 1 1 129 129 ASP H H 129 8.007 8.007 7.767 0.240 25757 9111 1 11 . 1 1 130 130 ILE N N 130 128.249 128.249 125.571 2.678 25757 9112 1 11 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.788 0.076 25757 9113 1 11 . 1 1 130 130 ILE C C 130 177.764 177.764 177.373 0.391 25757 9114 1 11 . 1 1 130 130 ILE CA C 130 63.548 63.548 64.302 -0.754 25757 9115 1 11 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.329 0.319 25757 9116 1 11 . 1 1 130 130 ILE H H 130 8.412 8.412 8.624 -0.212 25757 9117 1 11 . 1 1 131 131 ASP N N 131 116.430 116.430 116.857 -0.427 25757 9118 1 11 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.614 -0.080 25757 9119 1 11 . 1 1 131 131 ASP C C 131 178.313 178.313 176.675 1.638 25757 9120 1 11 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.684 -0.800 25757 9121 1 11 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.739 -0.777 25757 9122 1 11 . 1 1 131 131 ASP H H 131 8.254 8.254 8.236 0.018 25757 9123 1 11 . 1 1 132 132 GLY N N 132 108.460 108.460 108.338 0.122 25757 9124 1 11 . 1 1 132 132 GLY C C 132 175.211 175.211 174.790 0.421 25757 9125 1 11 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.141 1.462 25757 9126 1 11 . 1 1 132 132 GLY H H 132 7.547 7.547 8.137 -0.590 25757 9127 1 11 . 1 1 133 133 ASP N N 133 120.909 120.909 119.376 1.533 25757 9128 1 11 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.549 -0.086 25757 9129 1 11 . 1 1 133 133 ASP C C 133 177.691 177.691 177.669 0.022 25757 9130 1 11 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.695 1.119 25757 9131 1 11 . 1 1 133 133 ASP CB C 133 40.298 40.298 39.948 0.350 25757 9132 1 11 . 1 1 133 133 ASP H H 133 8.339 8.339 8.332 0.007 25757 9133 1 11 . 1 1 134 134 GLY N N 134 112.704 112.704 107.609 5.095 25757 9134 1 11 . 1 1 134 134 GLY C C 134 172.722 172.722 173.716 -0.994 25757 9135 1 11 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.557 0.480 25757 9136 1 11 . 1 1 134 134 GLY H H 134 10.396 10.396 7.881 2.515 25757 9137 1 11 . 1 1 135 135 GLN N N 135 114.799 114.799 118.221 -3.422 25757 9138 1 11 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.299 -0.435 25757 9139 1 11 . 1 1 135 135 GLN C C 135 174.760 174.760 175.334 -0.574 25757 9140 1 11 . 1 1 135 135 GLN CA C 135 53.321 53.321 53.953 -0.632 25757 9141 1 11 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.489 -0.424 25757 9142 1 11 . 1 1 135 135 GLN H H 135 7.975 7.975 8.569 -0.594 25757 9143 1 11 . 1 1 136 136 VAL N N 136 125.364 125.364 125.303 0.061 25757 9144 1 11 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.605 0.603 25757 9145 1 11 . 1 1 136 136 VAL C C 136 175.831 175.831 175.259 0.572 25757 9146 1 11 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.421 0.396 25757 9147 1 11 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.156 0.518 25757 9148 1 11 . 1 1 136 136 VAL H H 136 9.169 9.169 9.235 -0.066 25757 9149 1 11 . 1 1 137 137 ASN N N 137 129.155 129.155 125.370 3.785 25757 9150 1 11 . 1 1 137 137 ASN C C 137 174.737 174.737 175.703 -0.966 25757 9151 1 11 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.277 0.074 25757 9152 1 11 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.885 -3.562 25757 9153 1 11 . 1 1 137 137 ASN H H 137 9.652 9.652 8.781 0.871 25757 9154 1 11 . 1 1 138 138 TYR N N 138 118.504 118.504 122.470 -3.966 25757 9155 1 11 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.492 -0.213 25757 9156 1 11 . 1 1 138 138 TYR C C 138 176.174 176.174 177.429 -1.255 25757 9157 1 11 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.130 1.444 25757 9158 1 11 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.050 -0.320 25757 9159 1 11 . 1 1 138 138 TYR H H 138 8.460 8.460 8.758 -0.298 25757 9160 1 11 . 1 1 139 139 GLU N N 139 118.644 118.644 116.303 2.341 25757 9161 1 11 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.651 -0.103 25757 9162 1 11 . 1 1 139 139 GLU C C 139 180.265 180.265 179.032 1.233 25757 9163 1 11 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.489 0.997 25757 9164 1 11 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.780 0.211 25757 9165 1 11 . 1 1 139 139 GLU H H 139 8.136 8.136 8.084 0.052 25757 9166 1 11 . 1 1 140 140 GLU N N 140 120.030 120.030 118.120 1.910 25757 9167 1 11 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.082 -0.194 25757 9168 1 11 . 1 1 140 140 GLU C C 140 179.627 179.627 178.436 1.191 25757 9169 1 11 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.971 0.706 25757 9170 1 11 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.470 0.257 25757 9171 1 11 . 1 1 140 140 GLU H H 140 8.798 8.798 7.407 1.391 25757 9172 1 11 . 1 1 141 141 PHE N N 141 123.154 123.154 121.574 1.580 25757 9173 1 11 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.890 -0.193 25757 9174 1 11 . 1 1 141 141 PHE C C 141 176.952 176.952 178.089 -1.137 25757 9175 1 11 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.881 1.171 25757 9176 1 11 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.625 0.506 25757 9177 1 11 . 1 1 141 141 PHE H H 141 8.633 8.633 8.015 0.618 25757 9178 1 11 . 1 1 142 142 VAL N N 142 120.046 120.046 116.058 3.988 25757 9179 1 11 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.591 -0.635 25757 9180 1 11 . 1 1 142 142 VAL C C 142 179.627 179.627 177.420 2.207 25757 9181 1 11 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.609 1.634 25757 9182 1 11 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.075 0.065 25757 9183 1 11 . 1 1 142 142 VAL H H 142 8.894 8.894 8.247 0.647 25757 9184 1 11 . 1 1 143 143 GLN N N 143 118.996 118.996 120.530 -1.534 25757 9185 1 11 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.994 -0.218 25757 9186 1 11 . 1 1 143 143 GLN C C 143 178.443 178.443 177.983 0.460 25757 9187 1 11 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.186 0.943 25757 9188 1 11 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.300 -0.557 25757 9189 1 11 . 1 1 143 143 GLN H H 143 7.627 7.627 7.761 -0.134 25757 9190 1 11 . 1 1 144 144 MET N N 144 116.361 116.361 117.819 -1.458 25757 9191 1 11 . 1 1 144 144 MET HA H 144 4.169 4.169 4.121 0.048 25757 9192 1 11 . 1 1 144 144 MET C C 144 178.418 178.418 176.978 1.440 25757 9193 1 11 . 1 1 144 144 MET CA C 144 56.137 56.137 57.667 -1.530 25757 9194 1 11 . 1 1 144 144 MET CB C 144 31.095 31.095 32.491 -1.396 25757 9195 1 11 . 1 1 144 144 MET H H 144 7.179 7.179 7.331 -0.152 25757 9196 1 11 . 1 1 145 145 MET N N 145 115.373 115.373 117.029 -1.656 25757 9197 1 11 . 1 1 145 145 MET HA H 145 4.334 4.334 4.542 -0.208 25757 9198 1 11 . 1 1 145 145 MET C C 145 177.217 177.217 175.705 1.512 25757 9199 1 11 . 1 1 145 145 MET CA C 145 55.296 55.296 55.188 0.108 25757 9200 1 11 . 1 1 145 145 MET CB C 145 34.458 34.458 33.693 0.765 25757 9201 1 11 . 1 1 145 145 MET H H 145 7.776 7.776 7.644 0.132 25757 9202 1 11 . 1 1 146 146 THR N N 146 107.988 107.988 111.441 -3.453 25757 9203 1 11 . 1 1 146 146 THR HA H 146 4.239 4.239 4.485 -0.246 25757 9204 1 11 . 1 1 146 146 THR C C 146 175.378 175.378 174.903 0.475 25757 9205 1 11 . 1 1 146 146 THR CA C 146 61.625 61.625 61.475 0.150 25757 9206 1 11 . 1 1 146 146 THR CB C 146 70.817 70.817 68.738 2.079 25757 9207 1 11 . 1 1 146 146 THR H H 146 7.736 7.736 7.666 0.070 25757 9208 1 11 . 1 1 147 147 GLY N N 147 110.157 110.157 110.201 -0.044 25757 9209 1 11 . 1 1 147 147 GLY C C 147 174.046 174.046 174.139 -0.093 25757 9210 1 11 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.696 0.848 25757 9211 1 11 . 1 1 147 147 GLY H H 147 7.793 7.793 8.191 -0.398 25757 9212 1 11 . 1 1 150 150 THR HA H 150 4.239 4.239 4.386 -0.147 25757 9213 1 11 . 1 1 150 150 THR C C 150 174.397 174.397 174.651 -0.254 25757 9214 1 11 . 1 1 150 150 THR CA C 150 61.260 61.260 61.583 -0.323 25757 9215 1 11 . 1 1 150 150 THR CB C 150 70.358 70.358 69.543 0.815 25757 9216 1 11 . 1 1 151 151 ALA N N 151 126.304 126.304 123.683 2.621 25757 9217 1 11 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.710 -0.422 25757 9218 1 11 . 1 1 151 151 ALA C C 151 177.678 177.678 177.713 -0.035 25757 9219 1 11 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.298 0.850 25757 9220 1 11 . 1 1 151 151 ALA CB C 151 19.419 19.419 20.084 -0.665 25757 9221 1 11 . 1 1 151 151 ALA H H 151 8.618 8.618 7.315 1.303 25757 9222 1 11 . 1 1 152 152 ALA N N 152 123.861 123.861 120.960 2.901 25757 9223 1 11 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.368 -0.250 25757 9224 1 11 . 1 1 152 152 ALA C C 152 178.823 178.823 178.246 0.577 25757 9225 1 11 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.451 2.043 25757 9226 1 11 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.285 0.472 25757 9227 1 11 . 1 1 152 152 ALA H H 152 8.354 8.354 8.756 -0.402 25757 9228 1 11 . 1 1 153 153 GLY N N 153 109.984 109.984 107.411 2.573 25757 9229 1 11 . 1 1 153 153 GLY C C 153 174.389 174.389 175.627 -1.238 25757 9230 1 11 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.168 -2.037 25757 9231 1 11 . 1 1 153 153 GLY H H 153 9.028 9.028 8.253 0.775 25757 9232 1 11 . 1 1 154 154 SER N N 154 113.934 113.934 118.241 -4.307 25757 9233 1 11 . 1 1 154 154 SER HA H 154 4.255 4.255 3.974 0.281 25757 9234 1 11 . 1 1 154 154 SER C C 154 177.929 177.929 176.885 1.044 25757 9235 1 11 . 1 1 154 154 SER CA C 154 59.379 59.379 61.872 -2.493 25757 9236 1 11 . 1 1 154 154 SER CB C 154 64.090 64.090 62.726 1.364 25757 9237 1 11 . 1 1 154 154 SER H H 154 7.962 7.962 8.143 -0.181 25757 9238 1 11 . 1 1 155 155 GLY N N 155 115.337 115.337 109.069 6.268 25757 9239 1 11 . 1 1 155 155 GLY C C 155 175.891 175.891 175.439 0.452 25757 9240 1 11 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.686 0.960 25757 9241 1 11 . 1 1 155 155 GLY H H 155 9.451 9.451 7.700 1.751 25757 9242 1 11 . 1 1 156 156 TRP N N 156 119.600 119.600 122.193 -2.593 25757 9243 1 11 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.297 -0.026 25757 9244 1 11 . 1 1 156 156 TRP C C 156 178.947 178.947 179.142 -0.195 25757 9245 1 11 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.310 -0.146 25757 9246 1 11 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.002 0.601 25757 9247 1 11 . 1 1 156 156 TRP H H 156 8.542 8.542 7.323 1.219 25757 9248 1 11 . 1 1 157 157 ARG N N 157 118.583 118.583 119.220 -0.637 25757 9249 1 11 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.015 -0.033 25757 9250 1 11 . 1 1 157 157 ARG C C 157 177.894 177.894 178.373 -0.479 25757 9251 1 11 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.099 -0.761 25757 9252 1 11 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.026 0.031 25757 9253 1 11 . 1 1 157 157 ARG H H 157 7.747 7.747 8.458 -0.711 25757 9254 1 11 . 1 1 158 158 LYS N N 158 117.033 117.033 121.382 -4.349 25757 9255 1 11 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.247 -0.304 25757 9256 1 11 . 1 1 158 158 LYS C C 158 176.973 176.973 178.922 -1.949 25757 9257 1 11 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.645 0.729 25757 9258 1 11 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.473 -0.182 25757 9259 1 11 . 1 1 158 158 LYS H H 158 7.529 7.529 8.024 -0.495 25757 9260 1 11 . 1 1 159 159 ILE N N 159 116.553 116.553 120.109 -3.556 25757 9261 1 11 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.782 -0.238 25757 9262 1 11 . 1 1 159 159 ILE C C 159 176.894 176.894 177.554 -0.660 25757 9263 1 11 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.967 0.549 25757 9264 1 11 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.956 -0.152 25757 9265 1 11 . 1 1 159 159 ILE H H 159 7.348 7.348 8.258 -0.910 25757 9266 1 11 . 1 1 160 160 LYS N N 160 119.278 119.278 120.338 -1.060 25757 9267 1 11 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.346 -0.307 25757 9268 1 11 . 1 1 160 160 LYS C C 160 178.566 178.566 179.237 -0.671 25757 9269 1 11 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.914 0.460 25757 9270 1 11 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.622 0.196 25757 9271 1 11 . 1 1 160 160 LYS H H 160 8.225 8.225 8.108 0.117 25757 9272 1 11 . 1 1 161 161 LEU N N 161 117.056 117.056 119.523 -2.467 25757 9273 1 11 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.101 -0.041 25757 9274 1 11 . 1 1 161 161 LEU C C 161 178.977 178.977 178.959 0.018 25757 9275 1 11 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.876 0.148 25757 9276 1 11 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.916 0.066 25757 9277 1 11 . 1 1 161 161 LEU H H 161 8.057 8.057 8.350 -0.293 25757 9278 1 11 . 1 1 162 162 ALA N N 162 121.814 121.814 122.023 -0.209 25757 9279 1 11 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.081 0.011 25757 9280 1 11 . 1 1 162 162 ALA C C 162 178.374 178.374 179.584 -1.210 25757 9281 1 11 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.171 0.619 25757 9282 1 11 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.765 -0.439 25757 9283 1 11 . 1 1 162 162 ALA H H 162 8.170 8.170 8.186 -0.016 25757 9284 1 11 . 1 1 163 163 VAL N N 163 115.449 115.449 115.837 -0.388 25757 9285 1 11 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.787 -0.169 25757 9286 1 11 . 1 1 163 163 VAL C C 163 178.362 178.362 177.601 0.761 25757 9287 1 11 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.860 0.412 25757 9288 1 11 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.413 0.624 25757 9289 1 11 . 1 1 163 163 VAL H H 163 8.499 8.499 8.197 0.302 25757 9290 1 11 . 1 1 164 164 ARG N N 164 115.775 115.775 119.737 -3.962 25757 9291 1 11 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.336 -0.139 25757 9292 1 11 . 1 1 164 164 ARG C C 164 178.938 178.938 178.676 0.262 25757 9293 1 11 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.922 -1.239 25757 9294 1 11 . 1 1 164 164 ARG CB C 164 29.834 29.834 29.927 -0.093 25757 9295 1 11 . 1 1 164 164 ARG H H 164 8.165 8.165 8.488 -0.323 25757 9296 1 11 . 1 1 165 165 GLY N N 165 105.570 105.570 107.668 -2.098 25757 9297 1 11 . 1 1 165 165 GLY C C 165 173.134 173.134 174.804 -1.670 25757 9298 1 11 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.882 0.860 25757 9299 1 11 . 1 1 165 165 GLY H H 165 8.455 8.455 8.048 0.407 25757 9300 1 11 . 1 1 166 166 ALA N N 166 120.648 120.648 122.407 -1.759 25757 9301 1 11 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.192 0.150 25757 9302 1 11 . 1 1 166 166 ALA C C 166 176.155 176.155 178.260 -2.105 25757 9303 1 11 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.749 -1.976 25757 9304 1 11 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.215 0.263 25757 9305 1 11 . 1 1 166 166 ALA H H 166 7.826 7.826 7.901 -0.075 25757 9306 1 11 . 1 1 167 167 GLN N N 167 117.315 117.315 115.477 1.838 25757 9307 1 11 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.357 -0.080 25757 9308 1 11 . 1 1 167 167 GLN C C 167 175.571 175.571 176.498 -0.927 25757 9309 1 11 . 1 1 167 167 GLN CA C 167 55.927 55.927 55.708 0.219 25757 9310 1 11 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.144 0.041 25757 9311 1 11 . 1 1 167 167 GLN H H 167 7.498 7.498 7.589 -0.091 25757 9312 1 11 . 1 1 168 168 ALA N N 168 126.706 126.706 125.812 0.894 25757 9313 1 11 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.166 0.113 25757 9314 1 11 . 1 1 168 168 ALA C C 168 177.227 177.227 177.037 0.190 25757 9315 1 11 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.206 -1.140 25757 9316 1 11 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.476 0.230 25757 9317 1 11 . 1 1 168 168 ALA H H 168 8.534 8.534 7.584 0.950 25757 9318 1 12 . 1 1 9 9 ILE N N 9 116.733 116.733 121.420 -4.687 25757 9319 1 12 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.010 -0.253 25757 9320 1 12 . 1 1 9 9 ILE C C 9 177.828 177.828 177.207 0.621 25757 9321 1 12 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.236 3.368 25757 9322 1 12 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.611 -0.013 25757 9323 1 12 . 1 1 9 9 ILE H H 9 7.366 7.366 8.330 -0.964 25757 9324 1 12 . 1 1 10 10 ALA N N 10 121.080 121.080 122.557 -1.477 25757 9325 1 12 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.878 0.197 25757 9326 1 12 . 1 1 10 10 ALA C C 10 180.921 180.921 178.904 2.017 25757 9327 1 12 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.251 0.352 25757 9328 1 12 . 1 1 10 10 ALA CB C 10 17.984 17.984 18.119 -0.135 25757 9329 1 12 . 1 1 10 10 ALA H H 10 8.039 8.039 8.388 -0.349 25757 9330 1 12 . 1 1 11 11 GLU N N 11 119.580 119.580 118.860 0.720 25757 9331 1 12 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.913 0.176 25757 9332 1 12 . 1 1 11 11 GLU C C 11 179.561 179.561 179.063 0.498 25757 9333 1 12 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.186 0.699 25757 9334 1 12 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.322 0.141 25757 9335 1 12 . 1 1 11 11 GLU H H 11 7.741 7.741 7.645 0.096 25757 9336 1 12 . 1 1 12 12 PHE N N 12 118.509 118.509 117.267 1.242 25757 9337 1 12 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.311 0.515 25757 9338 1 12 . 1 1 12 12 PHE C C 12 179.000 179.000 178.638 0.362 25757 9339 1 12 . 1 1 12 12 PHE CA C 12 60.164 60.164 60.077 0.087 25757 9340 1 12 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.912 0.198 25757 9341 1 12 . 1 1 12 12 PHE H H 12 8.470 8.470 7.184 1.286 25757 9342 1 12 . 1 1 13 13 LYS N N 13 123.523 123.523 119.509 4.014 25757 9343 1 12 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.197 -0.171 25757 9344 1 12 . 1 1 13 13 LYS C C 13 179.260 179.260 179.440 -0.180 25757 9345 1 12 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.522 0.642 25757 9346 1 12 . 1 1 13 13 LYS CB C 13 31.833 31.833 31.767 0.066 25757 9347 1 12 . 1 1 13 13 LYS H H 13 9.171 9.171 8.417 0.754 25757 9348 1 12 . 1 1 14 14 GLU N N 14 120.415 120.415 118.668 1.747 25757 9349 1 12 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.058 0.037 25757 9350 1 12 . 1 1 14 14 GLU C C 14 179.851 179.851 179.027 0.824 25757 9351 1 12 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.251 0.335 25757 9352 1 12 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.205 0.356 25757 9353 1 12 . 1 1 14 14 GLU H H 14 7.822 7.822 8.176 -0.354 25757 9354 1 12 . 1 1 15 15 ALA N N 15 122.143 122.143 122.977 -0.834 25757 9355 1 12 . 1 1 15 15 ALA HA H 15 4.130 4.130 3.999 0.131 25757 9356 1 12 . 1 1 15 15 ALA C C 15 178.222 178.222 179.949 -1.727 25757 9357 1 12 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.099 0.091 25757 9358 1 12 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.545 -0.043 25757 9359 1 12 . 1 1 15 15 ALA H H 15 8.244 8.244 8.230 0.014 25757 9360 1 12 . 1 1 16 16 PHE N N 16 119.809 119.809 117.465 2.344 25757 9361 1 12 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.354 -0.342 25757 9362 1 12 . 1 1 16 16 PHE C C 16 177.444 177.444 177.985 -0.541 25757 9363 1 12 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.839 1.225 25757 9364 1 12 . 1 1 16 16 PHE CB C 16 39.432 39.432 38.576 0.856 25757 9365 1 12 . 1 1 16 16 PHE H H 16 8.891 8.891 8.537 0.354 25757 9366 1 12 . 1 1 17 17 SER N N 17 112.631 112.631 115.425 -2.794 25757 9367 1 12 . 1 1 17 17 SER HA H 17 4.034 4.034 4.207 -0.173 25757 9368 1 12 . 1 1 17 17 SER C C 17 174.675 174.675 176.106 -1.431 25757 9369 1 12 . 1 1 17 17 SER CA C 17 61.507 61.507 61.785 -0.278 25757 9370 1 12 . 1 1 17 17 SER CB C 17 63.414 63.414 63.482 -0.068 25757 9371 1 12 . 1 1 17 17 SER H H 17 7.910 7.910 8.236 -0.326 25757 9372 1 12 . 1 1 18 18 LEU N N 18 120.614 120.614 117.418 3.196 25757 9373 1 12 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.339 -0.327 25757 9374 1 12 . 1 1 18 18 LEU C C 18 177.366 177.366 177.264 0.102 25757 9375 1 12 . 1 1 18 18 LEU CA C 18 57.386 57.386 56.539 0.847 25757 9376 1 12 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.638 -0.043 25757 9377 1 12 . 1 1 18 18 LEU H H 18 7.423 7.423 7.913 -0.490 25757 9378 1 12 . 1 1 19 19 PHE N N 19 114.602 114.602 117.565 -2.963 25757 9379 1 12 . 1 1 19 19 PHE C C 19 176.961 176.961 176.015 0.946 25757 9380 1 12 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.579 -1.095 25757 9381 1 12 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.563 1.206 25757 9382 1 12 . 1 1 19 19 PHE H H 19 7.254 7.254 7.494 -0.240 25757 9383 1 12 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.721 -0.146 25757 9384 1 12 . 1 1 22 22 ASP CA C 22 52.648 52.648 53.325 -0.677 25757 9385 1 12 . 1 1 22 22 ASP CB C 22 40.010 40.010 41.221 -1.211 25757 9386 1 12 . 1 1 23 23 GLY N N 23 108.244 108.244 109.915 -1.671 25757 9387 1 12 . 1 1 23 23 GLY C C 23 175.188 175.188 175.398 -0.210 25757 9388 1 12 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.280 1.123 25757 9389 1 12 . 1 1 23 23 GLY H H 23 7.555 7.555 7.941 -0.386 25757 9390 1 12 . 1 1 24 24 ASP N N 24 120.667 120.667 120.112 0.555 25757 9391 1 12 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.475 -0.006 25757 9392 1 12 . 1 1 24 24 ASP C C 24 177.457 177.457 177.701 -0.244 25757 9393 1 12 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.359 0.433 25757 9394 1 12 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.009 -0.493 25757 9395 1 12 . 1 1 24 24 ASP H H 24 8.397 8.397 8.039 0.358 25757 9396 1 12 . 1 1 25 25 GLY N N 25 112.989 112.989 108.400 4.589 25757 9397 1 12 . 1 1 25 25 GLY C C 25 173.639 173.639 173.317 0.322 25757 9398 1 12 . 1 1 25 25 GLY CA C 25 45.501 45.501 44.875 0.626 25757 9399 1 12 . 1 1 25 25 GLY H H 25 10.592 10.592 7.835 2.757 25757 9400 1 12 . 1 1 26 26 THR N N 26 112.948 112.948 113.105 -0.157 25757 9401 1 12 . 1 1 26 26 THR HA H 26 5.282 5.282 4.930 0.352 25757 9402 1 12 . 1 1 26 26 THR C C 26 172.853 172.853 172.473 0.380 25757 9403 1 12 . 1 1 26 26 THR CA C 26 59.817 59.817 61.678 -1.861 25757 9404 1 12 . 1 1 26 26 THR CB C 26 72.465 72.465 70.851 1.614 25757 9405 1 12 . 1 1 26 26 THR H H 26 8.121 8.121 7.828 0.293 25757 9406 1 12 . 1 1 27 27 ILE N N 27 127.195 127.195 123.481 3.714 25757 9407 1 12 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.877 0.036 25757 9408 1 12 . 1 1 27 27 ILE C C 27 176.091 176.091 174.727 1.364 25757 9409 1 12 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.287 0.478 25757 9410 1 12 . 1 1 27 27 ILE CB C 27 39.705 39.705 42.143 -2.438 25757 9411 1 12 . 1 1 27 27 ILE H H 27 9.867 9.867 8.590 1.277 25757 9412 1 12 . 1 1 28 28 THR N N 28 116.655 116.655 120.107 -3.452 25757 9413 1 12 . 1 1 28 28 THR HA H 28 4.790 4.790 4.876 -0.086 25757 9414 1 12 . 1 1 28 28 THR C C 28 176.696 176.696 176.303 0.393 25757 9415 1 12 . 1 1 28 28 THR CA C 28 59.590 59.590 59.341 0.249 25757 9416 1 12 . 1 1 28 28 THR CB C 28 72.457 72.457 70.857 1.600 25757 9417 1 12 . 1 1 28 28 THR H H 28 8.457 8.457 8.489 -0.032 25757 9418 1 12 . 1 1 29 29 THR N N 29 111.878 111.878 116.631 -4.753 25757 9419 1 12 . 1 1 29 29 THR HA H 29 4.188 4.188 3.942 0.246 25757 9420 1 12 . 1 1 29 29 THR C C 29 177.399 177.399 176.314 1.085 25757 9421 1 12 . 1 1 29 29 THR CA C 29 66.386 66.386 66.370 0.016 25757 9422 1 12 . 1 1 29 29 THR CB C 29 67.726 67.726 68.664 -0.938 25757 9423 1 12 . 1 1 29 29 THR H H 29 9.211 9.211 8.954 0.257 25757 9424 1 12 . 1 1 30 30 LYS N N 30 121.140 121.140 121.403 -0.263 25757 9425 1 12 . 1 1 30 30 LYS HA H 30 4.077 4.077 4.003 0.074 25757 9426 1 12 . 1 1 30 30 LYS C C 30 179.793 179.793 179.010 0.783 25757 9427 1 12 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.597 -0.305 25757 9428 1 12 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.896 0.551 25757 9429 1 12 . 1 1 30 30 LYS H H 30 7.580 7.580 7.550 0.030 25757 9430 1 12 . 1 1 31 31 GLU N N 31 121.865 121.865 119.828 2.037 25757 9431 1 12 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.011 -0.017 25757 9432 1 12 . 1 1 31 31 GLU C C 31 179.355 179.355 179.030 0.325 25757 9433 1 12 . 1 1 31 31 GLU CA C 31 59.633 59.633 60.227 -0.594 25757 9434 1 12 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.551 0.301 25757 9435 1 12 . 1 1 31 31 GLU H H 31 7.708 7.708 7.653 0.055 25757 9436 1 12 . 1 1 32 32 LEU N N 32 120.597 120.597 117.718 2.879 25757 9437 1 12 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.094 0.022 25757 9438 1 12 . 1 1 32 32 LEU C C 32 178.885 178.885 179.070 -0.185 25757 9439 1 12 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.359 0.002 25757 9440 1 12 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.904 2.132 25757 9441 1 12 . 1 1 32 32 LEU H H 32 8.688 8.688 7.648 1.040 25757 9442 1 12 . 1 1 33 33 GLY N N 33 104.837 104.837 107.894 -3.057 25757 9443 1 12 . 1 1 33 33 GLY C C 33 175.123 175.123 175.971 -0.848 25757 9444 1 12 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.618 0.629 25757 9445 1 12 . 1 1 33 33 GLY H H 33 8.694 8.694 8.522 0.172 25757 9446 1 12 . 1 1 34 34 THR N N 34 117.631 117.631 119.572 -1.941 25757 9447 1 12 . 1 1 34 34 THR HA H 34 3.899 3.899 3.861 0.038 25757 9448 1 12 . 1 1 34 34 THR C C 34 176.951 176.951 176.976 -0.025 25757 9449 1 12 . 1 1 34 34 THR CA C 34 67.234 67.234 66.381 0.853 25757 9450 1 12 . 1 1 34 34 THR CB C 34 68.863 68.863 68.736 0.127 25757 9451 1 12 . 1 1 34 34 THR H H 34 7.960 7.960 8.024 -0.064 25757 9452 1 12 . 1 1 35 35 VAL N N 35 121.659 121.659 121.929 -0.270 25757 9453 1 12 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.678 -0.161 25757 9454 1 12 . 1 1 35 35 VAL C C 35 178.265 178.265 178.473 -0.208 25757 9455 1 12 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.532 0.143 25757 9456 1 12 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.278 0.015 25757 9457 1 12 . 1 1 35 35 VAL H H 35 7.358 7.358 8.315 -0.957 25757 9458 1 12 . 1 1 36 36 MET N N 36 117.456 117.456 116.459 0.997 25757 9459 1 12 . 1 1 36 36 MET C C 36 179.088 179.088 178.092 0.996 25757 9460 1 12 . 1 1 36 36 MET CA C 36 60.477 60.477 58.839 1.639 25757 9461 1 12 . 1 1 36 36 MET CB C 36 32.443 32.443 32.032 0.411 25757 9462 1 12 . 1 1 36 36 MET H H 36 8.194 8.194 8.254 -0.060 25757 9463 1 12 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.658 0.489 25757 9464 1 12 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.313 0.037 25757 9465 1 12 . 1 1 38 38 SER HA H 38 4.085 4.085 4.359 -0.274 25757 9466 1 12 . 1 1 38 38 SER C C 38 173.788 173.788 175.119 -1.331 25757 9467 1 12 . 1 1 38 38 SER CA C 38 61.617 61.617 61.124 0.493 25757 9468 1 12 . 1 1 38 38 SER CB C 38 62.943 62.943 62.947 -0.003 25757 9469 1 12 . 1 1 39 39 LEU N N 39 119.003 119.003 118.996 0.007 25757 9470 1 12 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.436 0.058 25757 9471 1 12 . 1 1 39 39 LEU C C 39 176.470 176.470 177.191 -0.721 25757 9472 1 12 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.844 -0.165 25757 9473 1 12 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.268 0.246 25757 9474 1 12 . 1 1 39 39 LEU H H 39 7.230 7.230 7.321 -0.091 25757 9475 1 12 . 1 1 40 40 GLY N N 40 105.026 105.026 105.622 -0.596 25757 9476 1 12 . 1 1 40 40 GLY C C 40 174.322 174.322 174.476 -0.154 25757 9477 1 12 . 1 1 40 40 GLY CA C 40 46.215 46.215 44.850 1.365 25757 9478 1 12 . 1 1 40 40 GLY H H 40 7.698 7.698 7.731 -0.033 25757 9479 1 12 . 1 1 41 41 GLN N N 41 117.929 117.929 120.399 -2.470 25757 9480 1 12 . 1 1 41 41 GLN C C 41 174.557 174.557 174.648 -0.091 25757 9481 1 12 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.812 1.032 25757 9482 1 12 . 1 1 41 41 GLN H H 41 7.866 7.866 7.752 0.114 25757 9483 1 12 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.547 0.189 25757 9484 1 12 . 1 1 43 43 PRO C C 43 177.805 177.805 176.326 1.479 25757 9485 1 12 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.708 -0.203 25757 9486 1 12 . 1 1 43 43 PRO CB C 43 32.162 32.162 33.181 -1.019 25757 9487 1 12 . 1 1 44 44 THR N N 44 113.167 113.167 113.823 -0.656 25757 9488 1 12 . 1 1 44 44 THR HA H 44 4.684 4.684 4.502 0.182 25757 9489 1 12 . 1 1 44 44 THR C C 44 175.139 175.139 175.562 -0.423 25757 9490 1 12 . 1 1 44 44 THR CA C 44 60.556 60.556 59.396 1.160 25757 9491 1 12 . 1 1 44 44 THR CB C 44 71.064 71.064 70.317 0.747 25757 9492 1 12 . 1 1 44 44 THR H H 44 8.798 8.798 7.759 1.039 25757 9493 1 12 . 1 1 45 45 GLU N N 45 120.673 120.673 122.694 -2.021 25757 9494 1 12 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.950 0.041 25757 9495 1 12 . 1 1 45 45 GLU C C 45 178.940 178.940 178.133 0.807 25757 9496 1 12 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.465 -0.564 25757 9497 1 12 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.575 -0.546 25757 9498 1 12 . 1 1 45 45 GLU H H 45 8.812 8.812 9.049 -0.237 25757 9499 1 12 . 1 1 46 46 ALA N N 46 120.576 120.576 121.632 -1.056 25757 9500 1 12 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.027 -0.060 25757 9501 1 12 . 1 1 46 46 ALA C C 46 180.290 180.290 179.788 0.502 25757 9502 1 12 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.432 -0.513 25757 9503 1 12 . 1 1 46 46 ALA CB C 46 18.161 18.161 17.855 0.306 25757 9504 1 12 . 1 1 46 46 ALA H H 46 8.276 8.276 8.338 -0.062 25757 9505 1 12 . 1 1 47 47 GLU N N 47 116.104 116.104 119.104 -3.000 25757 9506 1 12 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.017 -0.017 25757 9507 1 12 . 1 1 47 47 GLU C C 47 180.224 180.224 179.227 0.997 25757 9508 1 12 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.603 -0.672 25757 9509 1 12 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.328 0.661 25757 9510 1 12 . 1 1 47 47 GLU H H 47 7.425 7.425 8.225 -0.800 25757 9511 1 12 . 1 1 48 48 LEU N N 48 120.425 120.425 119.881 0.544 25757 9512 1 12 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.881 0.169 25757 9513 1 12 . 1 1 48 48 LEU C C 48 178.551 178.551 179.252 -0.701 25757 9514 1 12 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.343 -0.504 25757 9515 1 12 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.405 1.164 25757 9516 1 12 . 1 1 48 48 LEU H H 48 8.121 8.121 8.071 0.050 25757 9517 1 12 . 1 1 49 49 GLN N N 49 118.372 118.372 118.493 -0.121 25757 9518 1 12 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.872 -0.110 25757 9519 1 12 . 1 1 49 49 GLN C C 49 178.567 178.567 178.439 0.128 25757 9520 1 12 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.259 -0.396 25757 9521 1 12 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.419 -0.177 25757 9522 1 12 . 1 1 49 49 GLN H H 49 8.302 8.302 8.274 0.028 25757 9523 1 12 . 1 1 50 50 ASP N N 50 119.992 119.992 120.589 -0.597 25757 9524 1 12 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.333 0.027 25757 9525 1 12 . 1 1 50 50 ASP C C 50 178.600 178.600 178.622 -0.022 25757 9526 1 12 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.048 0.655 25757 9527 1 12 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.597 -0.130 25757 9528 1 12 . 1 1 50 50 ASP H H 50 8.150 8.150 8.216 -0.066 25757 9529 1 12 . 1 1 51 51 MET N N 51 119.238 119.238 120.330 -1.092 25757 9530 1 12 . 1 1 51 51 MET HA H 51 3.981 3.981 3.982 -0.001 25757 9531 1 12 . 1 1 51 51 MET C C 51 179.006 179.006 178.512 0.494 25757 9532 1 12 . 1 1 51 51 MET CA C 51 59.443 59.443 58.412 1.031 25757 9533 1 12 . 1 1 51 51 MET CB C 51 33.380 33.380 32.616 0.764 25757 9534 1 12 . 1 1 51 51 MET H H 51 7.844 7.844 8.327 -0.483 25757 9535 1 12 . 1 1 52 52 ILE N N 52 118.161 118.161 118.013 0.148 25757 9536 1 12 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.630 -0.152 25757 9537 1 12 . 1 1 52 52 ILE C C 52 177.847 177.847 178.806 -0.959 25757 9538 1 12 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.436 0.559 25757 9539 1 12 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.587 0.536 25757 9540 1 12 . 1 1 52 52 ILE H H 52 7.686 7.686 8.252 -0.566 25757 9541 1 12 . 1 1 53 53 ASN N N 53 117.884 117.884 117.406 0.478 25757 9542 1 12 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.473 -0.108 25757 9543 1 12 . 1 1 53 53 ASN C C 53 177.515 177.515 177.444 0.071 25757 9544 1 12 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.775 0.432 25757 9545 1 12 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.544 -0.466 25757 9546 1 12 . 1 1 53 53 ASN H H 53 8.713 8.713 8.283 0.430 25757 9547 1 12 . 1 1 54 54 GLU N N 54 116.178 116.178 118.727 -2.549 25757 9548 1 12 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.291 -0.302 25757 9549 1 12 . 1 1 54 54 GLU C C 54 177.557 177.557 177.183 0.374 25757 9550 1 12 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.775 1.215 25757 9551 1 12 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.410 0.053 25757 9552 1 12 . 1 1 54 54 GLU H H 54 7.530 7.530 8.036 -0.506 25757 9553 1 12 . 1 1 55 55 VAL N N 55 107.164 107.164 110.579 -3.415 25757 9554 1 12 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.360 0.162 25757 9555 1 12 . 1 1 55 55 VAL C C 55 175.602 175.602 174.460 1.142 25757 9556 1 12 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.678 -0.326 25757 9557 1 12 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.211 0.392 25757 9558 1 12 . 1 1 55 55 VAL H H 55 7.175 7.175 7.557 -0.382 25757 9559 1 12 . 1 1 56 56 ASP N N 56 122.126 122.126 121.502 0.624 25757 9560 1 12 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.104 -0.505 25757 9561 1 12 . 1 1 56 56 ASP C C 56 176.182 176.182 175.964 0.218 25757 9562 1 12 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.576 0.230 25757 9563 1 12 . 1 1 56 56 ASP CB C 56 40.270 40.270 41.714 -1.444 25757 9564 1 12 . 1 1 56 56 ASP H H 56 7.569 7.569 7.448 0.121 25757 9565 1 12 . 1 1 57 57 ALA N N 57 103.782 103.782 128.546 -24.764 25757 9566 1 12 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.106 0.074 25757 9567 1 12 . 1 1 57 57 ALA C C 57 178.584 178.584 178.022 0.562 25757 9568 1 12 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.960 0.384 25757 9569 1 12 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.595 -0.071 25757 9570 1 12 . 1 1 57 57 ALA H H 57 8.515 8.515 8.411 0.104 25757 9571 1 12 . 1 1 58 58 ASP N N 58 113.602 113.602 116.277 -2.675 25757 9572 1 12 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.636 -0.050 25757 9573 1 12 . 1 1 58 58 ASP C C 58 177.756 177.756 177.163 0.593 25757 9574 1 12 . 1 1 58 58 ASP CA C 58 52.762 52.762 53.724 -0.962 25757 9575 1 12 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.267 -1.589 25757 9576 1 12 . 1 1 58 58 ASP H H 58 8.130 8.130 8.073 0.057 25757 9577 1 12 . 1 1 59 59 GLY N N 59 109.195 109.195 110.001 -0.806 25757 9578 1 12 . 1 1 59 59 GLY C C 59 175.139 175.139 174.943 0.196 25757 9579 1 12 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.324 1.940 25757 9580 1 12 . 1 1 59 59 GLY H H 59 7.694 7.694 8.172 -0.478 25757 9581 1 12 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.685 -0.080 25757 9582 1 12 . 1 1 61 61 GLY N N 61 113.316 113.316 108.537 4.779 25757 9583 1 12 . 1 1 61 61 GLY C C 61 173.234 173.234 173.329 -0.095 25757 9584 1 12 . 1 1 61 61 GLY CA C 61 45.698 45.698 44.888 0.810 25757 9585 1 12 . 1 1 61 61 GLY H H 61 10.633 10.633 8.670 1.963 25757 9586 1 12 . 1 1 62 62 THR N N 62 108.892 108.892 111.141 -2.249 25757 9587 1 12 . 1 1 62 62 THR HA H 62 4.736 4.736 4.746 -0.010 25757 9588 1 12 . 1 1 62 62 THR C C 62 173.091 173.091 173.213 -0.122 25757 9589 1 12 . 1 1 62 62 THR CA C 62 59.617 59.617 60.063 -0.446 25757 9590 1 12 . 1 1 62 62 THR CB C 62 72.004 72.004 72.404 -0.400 25757 9591 1 12 . 1 1 62 62 THR H H 62 7.673 7.673 8.191 -0.518 25757 9592 1 12 . 1 1 63 63 ILE N N 63 123.324 123.324 123.310 0.014 25757 9593 1 12 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.620 0.509 25757 9594 1 12 . 1 1 63 63 ILE C C 63 175.652 175.652 175.464 0.188 25757 9595 1 12 . 1 1 63 63 ILE CA C 63 60.486 60.486 61.116 -0.630 25757 9596 1 12 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.241 -0.284 25757 9597 1 12 . 1 1 63 63 ILE H H 63 8.907 8.907 8.825 0.082 25757 9598 1 12 . 1 1 64 64 ASP N N 64 128.253 128.253 126.589 1.664 25757 9599 1 12 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.930 0.391 25757 9600 1 12 . 1 1 64 64 ASP C C 64 176.431 176.431 177.237 -0.806 25757 9601 1 12 . 1 1 64 64 ASP CA C 64 52.331 52.331 52.739 -0.408 25757 9602 1 12 . 1 1 64 64 ASP CB C 64 42.053 42.053 43.278 -1.225 25757 9603 1 12 . 1 1 64 64 ASP H H 64 8.864 8.864 8.876 -0.012 25757 9604 1 12 . 1 1 65 65 PHE N N 65 118.583 118.583 120.929 -2.346 25757 9605 1 12 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.215 -0.355 25757 9606 1 12 . 1 1 65 65 PHE C C 65 173.458 173.458 174.360 -0.902 25757 9607 1 12 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.499 2.300 25757 9608 1 12 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.690 -0.810 25757 9609 1 12 . 1 1 65 65 PHE H H 65 8.962 8.962 8.929 0.033 25757 9610 1 12 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.742 0.376 25757 9611 1 12 . 1 1 66 66 PRO C C 66 180.038 180.038 178.589 1.449 25757 9612 1 12 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.225 1.465 25757 9613 1 12 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.785 -0.108 25757 9614 1 12 . 1 1 67 67 GLU N N 67 118.402 118.402 119.070 -0.668 25757 9615 1 12 . 1 1 67 67 GLU C C 67 178.737 178.737 178.816 -0.079 25757 9616 1 12 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.840 -0.832 25757 9617 1 12 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.189 0.496 25757 9618 1 12 . 1 1 67 67 GLU H H 67 7.953 7.953 8.479 -0.526 25757 9619 1 12 . 1 1 68 68 PHE N N 68 123.421 123.421 119.900 3.521 25757 9620 1 12 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.040 -0.068 25757 9621 1 12 . 1 1 68 68 PHE C C 68 177.184 177.184 177.381 -0.197 25757 9622 1 12 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.795 -0.458 25757 9623 1 12 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.126 0.843 25757 9624 1 12 . 1 1 68 68 PHE H H 68 8.928 8.928 7.586 1.342 25757 9625 1 12 . 1 1 69 69 LEU N N 69 119.284 119.284 119.255 0.029 25757 9626 1 12 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.648 -0.313 25757 9627 1 12 . 1 1 69 69 LEU C C 69 178.987 178.987 178.555 0.432 25757 9628 1 12 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.703 -0.841 25757 9629 1 12 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.665 -0.833 25757 9630 1 12 . 1 1 69 69 LEU H H 69 8.374 8.374 7.775 0.599 25757 9631 1 12 . 1 1 70 70 THR N N 70 116.017 116.017 114.607 1.410 25757 9632 1 12 . 1 1 70 70 THR HA H 70 4.338 4.338 3.807 0.531 25757 9633 1 12 . 1 1 70 70 THR C C 70 176.169 176.169 176.455 -0.286 25757 9634 1 12 . 1 1 70 70 THR CA C 70 66.700 66.700 66.514 0.186 25757 9635 1 12 . 1 1 70 70 THR CB C 70 68.379 68.379 68.421 -0.042 25757 9636 1 12 . 1 1 70 70 THR H H 70 7.493 7.493 8.083 -0.590 25757 9637 1 12 . 1 1 71 71 MET N N 71 121.915 121.915 122.647 -0.732 25757 9638 1 12 . 1 1 71 71 MET HA H 71 3.718 3.718 3.904 -0.186 25757 9639 1 12 . 1 1 71 71 MET C C 71 178.190 178.190 177.737 0.453 25757 9640 1 12 . 1 1 71 71 MET CA C 71 59.335 59.335 59.232 0.103 25757 9641 1 12 . 1 1 71 71 MET CB C 71 33.894 33.894 32.412 1.482 25757 9642 1 12 . 1 1 71 71 MET H H 71 7.924 7.924 7.842 0.082 25757 9643 1 12 . 1 1 72 72 MET N N 72 116.973 116.973 114.707 2.266 25757 9644 1 12 . 1 1 72 72 MET HA H 72 3.968 3.968 4.211 -0.243 25757 9645 1 12 . 1 1 72 72 MET C C 72 178.211 178.211 178.828 -0.617 25757 9646 1 12 . 1 1 72 72 MET CA C 72 56.059 56.059 58.236 -2.178 25757 9647 1 12 . 1 1 72 72 MET CB C 72 31.639 31.639 32.011 -0.372 25757 9648 1 12 . 1 1 72 72 MET H H 72 8.276 8.276 7.854 0.422 25757 9649 1 12 . 1 1 73 73 ALA N N 73 122.499 122.499 122.763 -0.264 25757 9650 1 12 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.986 -0.036 25757 9651 1 12 . 1 1 73 73 ALA C C 73 180.231 180.231 179.399 0.832 25757 9652 1 12 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.774 0.179 25757 9653 1 12 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.964 0.068 25757 9654 1 12 . 1 1 73 73 ALA H H 73 8.240 8.240 8.199 0.041 25757 9655 1 12 . 1 1 74 74 ARG N N 74 116.098 116.098 118.989 -2.891 25757 9656 1 12 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.020 -0.028 25757 9657 1 12 . 1 1 74 74 ARG C C 74 178.567 178.567 178.211 0.356 25757 9658 1 12 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.105 -0.280 25757 9659 1 12 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.021 0.054 25757 9660 1 12 . 1 1 74 74 ARG H H 74 7.420 7.420 7.926 -0.506 25757 9661 1 12 . 1 1 75 75 LYS N N 75 119.046 119.046 120.400 -1.354 25757 9662 1 12 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.135 -0.092 25757 9663 1 12 . 1 1 75 75 LYS C C 75 179.045 179.045 178.752 0.293 25757 9664 1 12 . 1 1 75 75 LYS CA C 75 57.889 57.889 59.007 -1.118 25757 9665 1 12 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.022 -0.256 25757 9666 1 12 . 1 1 75 75 LYS H H 75 7.862 7.862 7.630 0.232 25757 9667 1 12 . 1 1 76 76 MET N N 76 116.772 116.772 118.677 -1.905 25757 9668 1 12 . 1 1 76 76 MET H H 76 8.099 8.099 7.701 0.398 25757 9669 1 12 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.646 -0.012 25757 9670 1 12 . 1 1 78 78 ASP C C 78 176.395 176.395 176.852 -0.457 25757 9671 1 12 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.113 0.531 25757 9672 1 12 . 1 1 78 78 ASP CB C 78 41.474 41.474 40.078 1.396 25757 9673 1 12 . 1 1 79 79 THR N N 79 113.904 113.904 112.828 1.076 25757 9674 1 12 . 1 1 79 79 THR HA H 79 4.215 4.215 3.995 0.220 25757 9675 1 12 . 1 1 79 79 THR C C 79 174.204 174.204 174.850 -0.646 25757 9676 1 12 . 1 1 79 79 THR CA C 79 62.264 62.264 63.927 -1.663 25757 9677 1 12 . 1 1 79 79 THR CB C 79 69.884 69.884 68.954 0.930 25757 9678 1 12 . 1 1 79 79 THR H H 79 8.039 8.039 7.946 0.093 25757 9679 1 12 . 1 1 80 80 ASP N N 80 123.572 123.572 122.609 0.963 25757 9680 1 12 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.639 0.081 25757 9681 1 12 . 1 1 80 80 ASP C C 80 176.221 176.221 176.504 -0.283 25757 9682 1 12 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.930 -0.615 25757 9683 1 12 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.200 1.226 25757 9684 1 12 . 1 1 80 80 ASP H H 80 8.441 8.441 8.057 0.384 25757 9685 1 12 . 1 1 81 81 SER N N 81 117.879 117.879 119.082 -1.203 25757 9686 1 12 . 1 1 81 81 SER HA H 81 3.925 3.925 4.307 -0.382 25757 9687 1 12 . 1 1 81 81 SER C C 81 175.264 175.264 176.117 -0.853 25757 9688 1 12 . 1 1 81 81 SER CA C 81 58.860 58.860 59.775 -0.915 25757 9689 1 12 . 1 1 81 81 SER CB C 81 63.790 63.790 64.181 -0.391 25757 9690 1 12 . 1 1 81 81 SER H H 81 8.503 8.503 8.172 0.331 25757 9691 1 12 . 1 1 82 82 GLU N N 82 123.206 123.206 122.699 0.507 25757 9692 1 12 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.977 0.081 25757 9693 1 12 . 1 1 82 82 GLU C C 82 178.378 178.378 178.550 -0.172 25757 9694 1 12 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.749 -0.163 25757 9695 1 12 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.230 0.373 25757 9696 1 12 . 1 1 82 82 GLU H H 82 8.563 8.563 8.823 -0.260 25757 9697 1 12 . 1 1 83 83 GLU N N 83 119.262 119.262 118.482 0.780 25757 9698 1 12 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.891 0.066 25757 9699 1 12 . 1 1 83 83 GLU C C 83 178.606 178.606 178.793 -0.187 25757 9700 1 12 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.892 -0.223 25757 9701 1 12 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.103 0.252 25757 9702 1 12 . 1 1 83 83 GLU H H 83 7.728 7.728 8.327 -0.599 25757 9703 1 12 . 1 1 84 84 GLU N N 84 118.432 118.432 120.015 -1.583 25757 9704 1 12 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.123 -0.016 25757 9705 1 12 . 1 1 84 84 GLU C C 84 179.436 179.436 179.155 0.281 25757 9706 1 12 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.250 0.253 25757 9707 1 12 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.301 -0.194 25757 9708 1 12 . 1 1 84 84 GLU H H 84 8.346 8.346 7.712 0.634 25757 9709 1 12 . 1 1 85 85 ILE N N 85 120.925 120.925 119.921 1.004 25757 9710 1 12 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.928 -0.180 25757 9711 1 12 . 1 1 85 85 ILE C C 85 177.661 177.661 178.520 -0.859 25757 9712 1 12 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.499 0.992 25757 9713 1 12 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.567 0.864 25757 9714 1 12 . 1 1 85 85 ILE H H 85 7.821 7.821 8.377 -0.556 25757 9715 1 12 . 1 1 86 86 ARG N N 86 121.916 121.916 118.945 2.971 25757 9716 1 12 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.795 0.341 25757 9717 1 12 . 1 1 86 86 ARG C C 86 179.208 179.208 178.659 0.549 25757 9718 1 12 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.003 1.368 25757 9719 1 12 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.398 0.700 25757 9720 1 12 . 1 1 86 86 ARG H H 86 8.432 8.432 8.228 0.204 25757 9721 1 12 . 1 1 87 87 GLU N N 87 118.261 118.261 119.240 -0.979 25757 9722 1 12 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.942 0.170 25757 9723 1 12 . 1 1 87 87 GLU C C 87 178.516 178.516 178.544 -0.028 25757 9724 1 12 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.224 -0.199 25757 9725 1 12 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.101 0.069 25757 9726 1 12 . 1 1 87 87 GLU H H 87 8.225 8.225 8.114 0.111 25757 9727 1 12 . 1 1 88 88 ALA N N 88 121.009 121.009 122.096 -1.087 25757 9728 1 12 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.444 0.383 25757 9729 1 12 . 1 1 88 88 ALA C C 88 177.947 177.947 178.405 -0.458 25757 9730 1 12 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.939 -0.078 25757 9731 1 12 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.250 -0.295 25757 9732 1 12 . 1 1 88 88 ALA H H 88 7.789 7.789 7.870 -0.081 25757 9733 1 12 . 1 1 89 89 PHE N N 89 117.164 117.164 118.639 -1.475 25757 9734 1 12 . 1 1 89 89 PHE C C 89 176.134 176.134 177.108 -0.974 25757 9735 1 12 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.546 2.104 25757 9736 1 12 . 1 1 89 89 PHE CB C 89 38.893 38.893 39.139 -0.246 25757 9737 1 12 . 1 1 89 89 PHE H H 89 8.337 8.337 7.448 0.889 25757 9738 1 12 . 1 1 90 90 ARG N N 90 114.900 114.900 119.569 -4.669 25757 9739 1 12 . 1 1 90 90 ARG HA H 90 3.914 3.914 4.103 -0.189 25757 9740 1 12 . 1 1 90 90 ARG C C 90 178.296 178.296 176.939 1.357 25757 9741 1 12 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.917 0.162 25757 9742 1 12 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.396 -0.303 25757 9743 1 12 . 1 1 90 90 ARG H H 90 7.681 7.681 7.848 -0.167 25757 9744 1 12 . 1 1 91 91 VAL N N 91 116.927 116.927 114.949 1.978 25757 9745 1 12 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.995 -0.388 25757 9746 1 12 . 1 1 91 91 VAL C C 91 177.964 177.964 176.985 0.979 25757 9747 1 12 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.576 0.384 25757 9748 1 12 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.985 -0.366 25757 9749 1 12 . 1 1 91 91 VAL H H 91 7.405 7.405 7.485 -0.080 25757 9750 1 12 . 1 1 92 92 PHE N N 92 119.026 119.026 116.433 2.593 25757 9751 1 12 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.325 0.037 25757 9752 1 12 . 1 1 92 92 PHE C C 92 177.639 177.639 175.803 1.836 25757 9753 1 12 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.132 -0.411 25757 9754 1 12 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.797 -0.370 25757 9755 1 12 . 1 1 92 92 PHE H H 92 7.886 7.886 7.492 0.394 25757 9756 1 12 . 1 1 93 93 ASP N N 93 118.238 118.238 118.889 -0.651 25757 9757 1 12 . 1 1 93 93 ASP HA H 93 4.462 4.462 5.054 -0.592 25757 9758 1 12 . 1 1 93 93 ASP C C 93 176.979 176.979 176.415 0.564 25757 9759 1 12 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.829 -0.681 25757 9760 1 12 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.204 -2.055 25757 9761 1 12 . 1 1 93 93 ASP H H 93 8.009 8.009 7.618 0.391 25757 9762 1 12 . 1 1 94 94 LYS N N 94 125.792 125.792 125.106 0.686 25757 9763 1 12 . 1 1 94 94 LYS C C 94 178.213 178.213 177.952 0.261 25757 9764 1 12 . 1 1 94 94 LYS CA C 94 59.318 59.318 59.043 0.275 25757 9765 1 12 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.671 -1.643 25757 9766 1 12 . 1 1 94 94 LYS H H 94 7.428 7.428 7.985 -0.557 25757 9767 1 12 . 1 1 95 95 ASP N N 95 113.833 113.833 114.885 -1.052 25757 9768 1 12 . 1 1 95 95 ASP C C 95 177.718 177.718 177.085 0.633 25757 9769 1 12 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.111 -1.166 25757 9770 1 12 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.487 -0.744 25757 9771 1 12 . 1 1 95 95 ASP H H 95 8.159 8.159 8.003 0.156 25757 9772 1 12 . 1 1 96 96 GLY N N 96 109.414 109.414 108.162 1.252 25757 9773 1 12 . 1 1 96 96 GLY C C 96 175.093 175.093 175.681 -0.588 25757 9774 1 12 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.825 1.429 25757 9775 1 12 . 1 1 96 96 GLY H H 96 7.848 7.848 7.762 0.086 25757 9776 1 12 . 1 1 97 97 ASN N N 97 119.590 119.590 119.433 0.157 25757 9777 1 12 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.603 0.009 25757 9778 1 12 . 1 1 97 97 ASN C C 97 175.937 175.937 176.918 -0.981 25757 9779 1 12 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.321 -0.433 25757 9780 1 12 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.041 -0.721 25757 9781 1 12 . 1 1 97 97 ASN H H 97 8.338 8.338 8.782 -0.444 25757 9782 1 12 . 1 1 98 98 GLY N N 98 112.940 112.940 107.443 5.497 25757 9783 1 12 . 1 1 98 98 GLY C C 98 172.429 172.429 172.928 -0.499 25757 9784 1 12 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.114 -0.022 25757 9785 1 12 . 1 1 98 98 GLY H H 98 10.695 10.695 8.654 2.041 25757 9786 1 12 . 1 1 99 99 TYR N N 99 115.544 115.544 118.558 -3.014 25757 9787 1 12 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.258 -0.171 25757 9788 1 12 . 1 1 99 99 TYR C C 99 174.859 174.859 174.728 0.131 25757 9789 1 12 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.463 -1.445 25757 9790 1 12 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.129 1.224 25757 9791 1 12 . 1 1 99 99 TYR H H 99 7.597 7.597 8.708 -1.111 25757 9792 1 12 . 1 1 100 100 ILE N N 100 127.078 127.078 126.189 0.889 25757 9793 1 12 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.524 0.265 25757 9794 1 12 . 1 1 100 100 ILE C C 100 175.387 175.387 175.868 -0.481 25757 9795 1 12 . 1 1 100 100 ILE CA C 100 61.006 61.006 61.004 0.002 25757 9796 1 12 . 1 1 100 100 ILE CB C 100 38.790 38.790 38.652 0.138 25757 9797 1 12 . 1 1 100 100 ILE H H 100 10.267 10.267 9.146 1.121 25757 9798 1 12 . 1 1 101 101 SER N N 101 124.102 124.102 123.170 0.932 25757 9799 1 12 . 1 1 101 101 SER HA H 101 4.417 4.417 5.056 -0.639 25757 9800 1 12 . 1 1 101 101 SER C C 101 175.360 175.360 175.240 0.120 25757 9801 1 12 . 1 1 101 101 SER CA C 101 56.036 56.036 57.221 -1.185 25757 9802 1 12 . 1 1 101 101 SER CB C 101 66.896 66.896 65.301 1.595 25757 9803 1 12 . 1 1 101 101 SER H H 101 8.985 8.985 8.065 0.920 25757 9804 1 12 . 1 1 102 102 ALA N N 102 122.780 122.780 124.798 -2.018 25757 9805 1 12 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.930 -0.186 25757 9806 1 12 . 1 1 102 102 ALA C C 102 179.175 179.175 178.481 0.694 25757 9807 1 12 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.511 0.779 25757 9808 1 12 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.315 -0.288 25757 9809 1 12 . 1 1 102 102 ALA H H 102 9.269 9.269 9.105 0.164 25757 9810 1 12 . 1 1 103 103 ALA N N 103 118.513 118.513 121.119 -2.606 25757 9811 1 12 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.903 0.108 25757 9812 1 12 . 1 1 103 103 ALA C C 103 181.521 181.521 179.333 2.188 25757 9813 1 12 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.269 0.085 25757 9814 1 12 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.323 -0.032 25757 9815 1 12 . 1 1 103 103 ALA H H 103 8.321 8.321 8.289 0.032 25757 9816 1 12 . 1 1 104 104 GLU N N 104 119.550 119.550 119.535 0.015 25757 9817 1 12 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.056 -0.050 25757 9818 1 12 . 1 1 104 104 GLU C C 104 179.750 179.750 179.316 0.434 25757 9819 1 12 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.866 -0.697 25757 9820 1 12 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.322 -0.107 25757 9821 1 12 . 1 1 104 104 GLU H H 104 7.867 7.867 8.367 -0.500 25757 9822 1 12 . 1 1 105 105 LEU N N 105 122.688 122.688 119.692 2.996 25757 9823 1 12 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.811 0.107 25757 9824 1 12 . 1 1 105 105 LEU C C 105 178.233 178.233 178.650 -0.417 25757 9825 1 12 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.041 -0.307 25757 9826 1 12 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.542 0.478 25757 9827 1 12 . 1 1 105 105 LEU H H 105 8.746 8.746 7.763 0.983 25757 9828 1 12 . 1 1 106 106 ARG N N 106 118.835 118.835 118.669 0.166 25757 9829 1 12 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.763 -0.113 25757 9830 1 12 . 1 1 106 106 ARG C C 106 178.742 178.742 178.891 -0.149 25757 9831 1 12 . 1 1 106 106 ARG CA C 106 59.963 59.963 60.240 -0.277 25757 9832 1 12 . 1 1 106 106 ARG CB C 106 30.046 30.046 30.011 0.035 25757 9833 1 12 . 1 1 106 106 ARG H H 106 8.684 8.684 8.082 0.602 25757 9834 1 12 . 1 1 107 107 HIS N N 107 119.258 119.258 118.539 0.719 25757 9835 1 12 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.290 -0.023 25757 9836 1 12 . 1 1 107 107 HIS C C 107 177.244 177.244 178.212 -0.968 25757 9837 1 12 . 1 1 107 107 HIS CA C 107 60.152 60.152 59.393 0.759 25757 9838 1 12 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.689 0.886 25757 9839 1 12 . 1 1 107 107 HIS H H 107 7.691 7.691 8.123 -0.432 25757 9840 1 12 . 1 1 108 108 VAL N N 108 118.996 118.996 122.008 -3.012 25757 9841 1 12 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.739 -0.301 25757 9842 1 12 . 1 1 108 108 VAL C C 108 177.998 177.998 177.903 0.095 25757 9843 1 12 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.928 -0.497 25757 9844 1 12 . 1 1 108 108 VAL CB C 108 31.424 31.424 32.105 -0.681 25757 9845 1 12 . 1 1 108 108 VAL H H 108 7.599 7.599 8.246 -0.647 25757 9846 1 12 . 1 1 109 109 MET N N 109 114.880 114.880 116.305 -1.425 25757 9847 1 12 . 1 1 109 109 MET C C 109 179.119 179.119 177.751 1.368 25757 9848 1 12 . 1 1 109 109 MET CA C 109 56.979 56.979 58.481 -1.502 25757 9849 1 12 . 1 1 109 109 MET CB C 109 29.253 29.253 32.870 -3.617 25757 9850 1 12 . 1 1 109 109 MET H H 109 7.911 7.911 7.969 -0.058 25757 9851 1 12 . 1 1 110 110 THR N N 110 116.943 116.943 115.902 1.041 25757 9852 1 12 . 1 1 110 110 THR HA H 110 4.229 4.229 4.456 -0.227 25757 9853 1 12 . 1 1 110 110 THR C C 110 178.506 178.506 177.293 1.213 25757 9854 1 12 . 1 1 110 110 THR CA C 110 66.573 66.573 66.062 0.511 25757 9855 1 12 . 1 1 110 110 THR CB C 110 68.575 68.575 68.590 -0.015 25757 9856 1 12 . 1 1 110 110 THR H H 110 8.353 8.353 8.211 0.142 25757 9857 1 12 . 1 1 111 111 ASN N N 111 123.829 123.829 121.023 2.806 25757 9858 1 12 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.505 -0.143 25757 9859 1 12 . 1 1 111 111 ASN C C 111 177.197 177.197 176.749 0.448 25757 9860 1 12 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.706 0.253 25757 9861 1 12 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.390 -1.167 25757 9862 1 12 . 1 1 111 111 ASN H H 111 8.053 8.053 8.303 -0.250 25757 9863 1 12 . 1 1 112 112 LEU N N 112 119.036 119.036 116.977 2.059 25757 9864 1 12 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.150 0.020 25757 9865 1 12 . 1 1 112 112 LEU C C 112 176.377 176.377 176.895 -0.518 25757 9866 1 12 . 1 1 112 112 LEU CA C 112 55.505 55.505 55.930 -0.425 25757 9867 1 12 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.553 -0.193 25757 9868 1 12 . 1 1 112 112 LEU H H 112 7.794 7.794 7.717 0.077 25757 9869 1 12 . 1 1 113 113 GLY N N 113 106.045 106.045 104.922 1.123 25757 9870 1 12 . 1 1 113 113 GLY C C 113 174.248 174.248 173.975 0.273 25757 9871 1 12 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.687 0.620 25757 9872 1 12 . 1 1 113 113 GLY H H 113 7.741 7.741 7.687 0.054 25757 9873 1 12 . 1 1 114 114 GLU N N 114 120.556 120.556 122.735 -2.179 25757 9874 1 12 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.268 0.042 25757 9875 1 12 . 1 1 114 114 GLU C C 114 174.993 174.993 175.678 -0.685 25757 9876 1 12 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.193 -0.556 25757 9877 1 12 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.127 1.090 25757 9878 1 12 . 1 1 114 114 GLU H H 114 7.980 7.980 7.906 0.074 25757 9879 1 12 . 1 1 115 115 LYS N N 115 124.986 124.986 127.489 -2.503 25757 9880 1 12 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.282 0.052 25757 9881 1 12 . 1 1 115 115 LYS C C 115 175.285 175.285 175.704 -0.419 25757 9882 1 12 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.222 -0.641 25757 9883 1 12 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.690 -0.717 25757 9884 1 12 . 1 1 115 115 LYS H H 115 8.613 8.613 8.506 0.107 25757 9885 1 12 . 1 1 116 116 LEU N N 116 125.243 125.243 122.457 2.786 25757 9886 1 12 . 1 1 116 116 LEU HA H 116 4.688 4.688 5.015 -0.327 25757 9887 1 12 . 1 1 116 116 LEU C C 116 178.365 178.365 176.832 1.533 25757 9888 1 12 . 1 1 116 116 LEU CA C 116 54.348 54.348 52.771 1.577 25757 9889 1 12 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.821 0.468 25757 9890 1 12 . 1 1 116 116 LEU H H 116 8.066 8.066 8.396 -0.330 25757 9891 1 12 . 1 1 117 117 THR N N 117 114.324 114.324 114.714 -0.390 25757 9892 1 12 . 1 1 117 117 THR HA H 117 4.713 4.713 4.576 0.137 25757 9893 1 12 . 1 1 117 117 THR C C 117 175.539 175.539 174.543 0.996 25757 9894 1 12 . 1 1 117 117 THR CA C 117 60.756 60.756 60.703 0.053 25757 9895 1 12 . 1 1 117 117 THR CB C 117 71.144 71.144 70.606 0.538 25757 9896 1 12 . 1 1 117 117 THR H H 117 9.228 9.228 8.282 0.946 25757 9897 1 12 . 1 1 118 118 ASP N N 118 121.016 121.016 122.517 -1.501 25757 9898 1 12 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.264 -0.109 25757 9899 1 12 . 1 1 118 118 ASP H H 118 8.919 8.919 8.688 0.231 25757 9900 1 12 . 1 1 119 119 GLU N N 119 121.016 121.016 118.584 2.432 25757 9901 1 12 . 1 1 119 119 GLU C C 119 179.204 179.204 178.552 0.652 25757 9902 1 12 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.254 -1.184 25757 9903 1 12 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.490 -0.446 25757 9904 1 12 . 1 1 119 119 GLU H H 119 8.919 8.919 8.722 0.197 25757 9905 1 12 . 1 1 120 120 GLU N N 120 120.566 120.566 120.374 0.192 25757 9906 1 12 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.970 0.031 25757 9907 1 12 . 1 1 120 120 GLU C C 120 180.329 180.329 178.822 1.507 25757 9908 1 12 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.262 -0.171 25757 9909 1 12 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.525 1.113 25757 9910 1 12 . 1 1 120 120 GLU H H 120 7.732 7.732 7.623 0.109 25757 9911 1 12 . 1 1 121 121 VAL N N 121 121.875 121.875 118.993 2.882 25757 9912 1 12 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.493 -0.028 25757 9913 1 12 . 1 1 121 121 VAL C C 121 177.477 177.477 178.064 -0.587 25757 9914 1 12 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.254 0.917 25757 9915 1 12 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.671 -0.237 25757 9916 1 12 . 1 1 121 121 VAL H H 121 8.104 8.104 7.442 0.662 25757 9917 1 12 . 1 1 122 122 ASP N N 122 120.566 120.566 118.780 1.786 25757 9918 1 12 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.321 0.014 25757 9919 1 12 . 1 1 122 122 ASP C C 122 179.298 179.298 178.584 0.714 25757 9920 1 12 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.527 0.312 25757 9921 1 12 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.877 -0.564 25757 9922 1 12 . 1 1 122 122 ASP H H 122 8.089 8.089 8.226 -0.137 25757 9923 1 12 . 1 1 123 123 GLU N N 123 119.821 119.821 120.167 -0.346 25757 9924 1 12 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.011 0.038 25757 9925 1 12 . 1 1 123 123 GLU C C 123 178.749 178.749 178.982 -0.233 25757 9926 1 12 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.570 -0.252 25757 9927 1 12 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.846 -0.461 25757 9928 1 12 . 1 1 123 123 GLU H H 123 8.105 8.105 7.764 0.341 25757 9929 1 12 . 1 1 124 124 MET N N 124 119.288 119.288 118.234 1.054 25757 9930 1 12 . 1 1 124 124 MET C C 124 180.865 180.865 179.182 1.683 25757 9931 1 12 . 1 1 124 124 MET CA C 124 60.684 60.684 59.036 1.648 25757 9932 1 12 . 1 1 124 124 MET CB C 124 33.141 33.141 32.019 1.122 25757 9933 1 12 . 1 1 124 124 MET H H 124 7.726 7.726 8.143 -0.417 25757 9934 1 12 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.050 -0.321 25757 9935 1 12 . 1 1 125 125 ILE C C 125 177.341 177.341 177.640 -0.299 25757 9936 1 12 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.449 0.352 25757 9937 1 12 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.062 -1.497 25757 9938 1 12 . 1 1 126 126 ARG N N 126 118.555 118.555 119.409 -0.854 25757 9939 1 12 . 1 1 126 126 ARG C C 126 179.164 179.164 178.614 0.550 25757 9940 1 12 . 1 1 126 126 ARG CA C 126 59.924 59.924 58.871 1.053 25757 9941 1 12 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.285 -0.420 25757 9942 1 12 . 1 1 126 126 ARG H H 126 8.380 8.380 7.934 0.446 25757 9943 1 12 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.394 -0.469 25757 9944 1 12 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.686 1.371 25757 9945 1 12 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.287 0.541 25757 9946 1 12 . 1 1 128 128 ALA N N 128 116.764 116.764 119.987 -3.223 25757 9947 1 12 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.292 0.125 25757 9948 1 12 . 1 1 128 128 ALA C C 128 177.885 177.885 176.332 1.553 25757 9949 1 12 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.209 -0.254 25757 9950 1 12 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.588 2.979 25757 9951 1 12 . 1 1 128 128 ALA H H 128 7.152 7.152 7.658 -0.506 25757 9952 1 12 . 1 1 129 129 ASP N N 129 117.762 117.762 117.391 0.371 25757 9953 1 12 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.129 -0.652 25757 9954 1 12 . 1 1 129 129 ASP C C 129 175.935 175.935 176.360 -0.425 25757 9955 1 12 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.250 2.265 25757 9956 1 12 . 1 1 129 129 ASP CB C 129 40.745 40.745 43.211 -2.466 25757 9957 1 12 . 1 1 129 129 ASP H H 129 8.007 8.007 7.506 0.501 25757 9958 1 12 . 1 1 130 130 ILE N N 130 128.249 128.249 123.912 4.337 25757 9959 1 12 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.964 -0.100 25757 9960 1 12 . 1 1 130 130 ILE C C 130 177.764 177.764 177.367 0.397 25757 9961 1 12 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.605 0.944 25757 9962 1 12 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.825 0.823 25757 9963 1 12 . 1 1 130 130 ILE H H 130 8.412 8.412 8.381 0.031 25757 9964 1 12 . 1 1 131 131 ASP N N 131 116.430 116.430 116.309 0.121 25757 9965 1 12 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.692 -0.158 25757 9966 1 12 . 1 1 131 131 ASP C C 131 178.313 178.313 177.117 1.196 25757 9967 1 12 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.685 -0.801 25757 9968 1 12 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.450 -1.488 25757 9969 1 12 . 1 1 131 131 ASP H H 131 8.254 8.254 8.027 0.227 25757 9970 1 12 . 1 1 132 132 GLY N N 132 108.460 108.460 109.833 -1.373 25757 9971 1 12 . 1 1 132 132 GLY C C 132 175.211 175.211 174.522 0.689 25757 9972 1 12 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.833 1.770 25757 9973 1 12 . 1 1 132 132 GLY H H 132 7.547 7.547 7.971 -0.424 25757 9974 1 12 . 1 1 133 133 ASP N N 133 120.909 120.909 119.932 0.977 25757 9975 1 12 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.627 -0.164 25757 9976 1 12 . 1 1 133 133 ASP C C 133 177.691 177.691 177.594 0.097 25757 9977 1 12 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.176 0.638 25757 9978 1 12 . 1 1 133 133 ASP CB C 133 40.298 40.298 41.493 -1.195 25757 9979 1 12 . 1 1 133 133 ASP H H 133 8.339 8.339 8.569 -0.230 25757 9980 1 12 . 1 1 134 134 GLY N N 134 112.704 112.704 108.355 4.349 25757 9981 1 12 . 1 1 134 134 GLY C C 134 172.722 172.722 173.481 -0.759 25757 9982 1 12 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.058 0.979 25757 9983 1 12 . 1 1 134 134 GLY H H 134 10.396 10.396 8.415 1.981 25757 9984 1 12 . 1 1 135 135 GLN N N 135 114.799 114.799 118.922 -4.123 25757 9985 1 12 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.015 -0.151 25757 9986 1 12 . 1 1 135 135 GLN C C 135 174.760 174.760 175.179 -0.419 25757 9987 1 12 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.344 -1.023 25757 9988 1 12 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.277 -0.212 25757 9989 1 12 . 1 1 135 135 GLN H H 135 7.975 7.975 8.341 -0.366 25757 9990 1 12 . 1 1 136 136 VAL N N 136 125.364 125.364 125.381 -0.017 25757 9991 1 12 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.623 0.585 25757 9992 1 12 . 1 1 136 136 VAL C C 136 175.831 175.831 175.281 0.550 25757 9993 1 12 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.530 0.287 25757 9994 1 12 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.315 0.359 25757 9995 1 12 . 1 1 136 136 VAL H H 136 9.169 9.169 9.000 0.169 25757 9996 1 12 . 1 1 137 137 ASN N N 137 129.155 129.155 124.892 4.263 25757 9997 1 12 . 1 1 137 137 ASN C C 137 174.737 174.737 175.435 -0.698 25757 9998 1 12 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.112 0.239 25757 9999 1 12 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.196 -2.873 25757 10000 1 12 . 1 1 137 137 ASN H H 137 9.652 9.652 8.414 1.238 25757 10001 1 12 . 1 1 138 138 TYR N N 138 118.504 118.504 121.038 -2.534 25757 10002 1 12 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.798 -0.519 25757 10003 1 12 . 1 1 138 138 TYR C C 138 176.174 176.174 177.420 -1.246 25757 10004 1 12 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.056 1.518 25757 10005 1 12 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.438 -0.708 25757 10006 1 12 . 1 1 138 138 TYR H H 138 8.460 8.460 8.456 0.004 25757 10007 1 12 . 1 1 139 139 GLU N N 139 118.644 118.644 117.253 1.391 25757 10008 1 12 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.715 -0.167 25757 10009 1 12 . 1 1 139 139 GLU C C 139 180.265 180.265 178.495 1.770 25757 10010 1 12 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.452 1.034 25757 10011 1 12 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.987 0.004 25757 10012 1 12 . 1 1 139 139 GLU H H 139 8.136 8.136 8.721 -0.585 25757 10013 1 12 . 1 1 140 140 GLU N N 140 120.030 120.030 117.099 2.931 25757 10014 1 12 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.116 -0.228 25757 10015 1 12 . 1 1 140 140 GLU C C 140 179.627 179.627 177.557 2.070 25757 10016 1 12 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.837 0.841 25757 10017 1 12 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.454 0.273 25757 10018 1 12 . 1 1 140 140 GLU H H 140 8.798 8.798 8.412 0.386 25757 10019 1 12 . 1 1 141 141 PHE N N 141 123.154 123.154 120.893 2.261 25757 10020 1 12 . 1 1 141 141 PHE HA H 141 3.697 3.697 4.070 -0.373 25757 10021 1 12 . 1 1 141 141 PHE C C 141 176.952 176.952 177.858 -0.906 25757 10022 1 12 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.324 1.728 25757 10023 1 12 . 1 1 141 141 PHE CB C 141 40.131 40.131 40.236 -0.105 25757 10024 1 12 . 1 1 141 141 PHE H H 141 8.633 8.633 7.652 0.981 25757 10025 1 12 . 1 1 142 142 VAL N N 142 120.046 120.046 116.356 3.690 25757 10026 1 12 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.612 -0.656 25757 10027 1 12 . 1 1 142 142 VAL C C 142 179.627 179.627 177.108 2.519 25757 10028 1 12 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.403 1.840 25757 10029 1 12 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.055 0.085 25757 10030 1 12 . 1 1 142 142 VAL H H 142 8.894 8.894 8.343 0.551 25757 10031 1 12 . 1 1 143 143 GLN N N 143 118.996 118.996 120.545 -1.549 25757 10032 1 12 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.988 -0.212 25757 10033 1 12 . 1 1 143 143 GLN C C 143 178.443 178.443 177.774 0.669 25757 10034 1 12 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.331 0.798 25757 10035 1 12 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.143 -0.400 25757 10036 1 12 . 1 1 143 143 GLN H H 143 7.627 7.627 7.851 -0.224 25757 10037 1 12 . 1 1 144 144 MET N N 144 116.361 116.361 117.855 -1.494 25757 10038 1 12 . 1 1 144 144 MET HA H 144 4.169 4.169 4.098 0.071 25757 10039 1 12 . 1 1 144 144 MET C C 144 178.418 178.418 176.991 1.427 25757 10040 1 12 . 1 1 144 144 MET CA C 144 56.137 56.137 57.607 -1.470 25757 10041 1 12 . 1 1 144 144 MET CB C 144 31.095 31.095 32.354 -1.259 25757 10042 1 12 . 1 1 144 144 MET H H 144 7.179 7.179 7.291 -0.112 25757 10043 1 12 . 1 1 145 145 MET N N 145 115.373 115.373 116.838 -1.465 25757 10044 1 12 . 1 1 145 145 MET HA H 145 4.334 4.334 4.539 -0.205 25757 10045 1 12 . 1 1 145 145 MET C C 145 177.217 177.217 175.825 1.392 25757 10046 1 12 . 1 1 145 145 MET CA C 145 55.296 55.296 55.083 0.213 25757 10047 1 12 . 1 1 145 145 MET CB C 145 34.458 34.458 33.104 1.354 25757 10048 1 12 . 1 1 145 145 MET H H 145 7.776 7.776 7.778 -0.002 25757 10049 1 12 . 1 1 146 146 THR N N 146 107.988 107.988 111.608 -3.620 25757 10050 1 12 . 1 1 146 146 THR HA H 146 4.239 4.239 4.464 -0.225 25757 10051 1 12 . 1 1 146 146 THR C C 146 175.378 175.378 174.908 0.470 25757 10052 1 12 . 1 1 146 146 THR CA C 146 61.625 61.625 61.582 0.043 25757 10053 1 12 . 1 1 146 146 THR CB C 146 70.817 70.817 68.793 2.024 25757 10054 1 12 . 1 1 146 146 THR H H 146 7.736 7.736 7.645 0.091 25757 10055 1 12 . 1 1 147 147 GLY N N 147 110.157 110.157 110.119 0.038 25757 10056 1 12 . 1 1 147 147 GLY C C 147 174.046 174.046 174.126 -0.080 25757 10057 1 12 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.684 0.859 25757 10058 1 12 . 1 1 147 147 GLY H H 147 7.793 7.793 8.161 -0.368 25757 10059 1 12 . 1 1 150 150 THR HA H 150 4.239 4.239 4.388 -0.149 25757 10060 1 12 . 1 1 150 150 THR C C 150 174.397 174.397 174.623 -0.226 25757 10061 1 12 . 1 1 150 150 THR CA C 150 61.260 61.260 62.985 -1.725 25757 10062 1 12 . 1 1 150 150 THR CB C 150 70.358 70.358 69.251 1.107 25757 10063 1 12 . 1 1 151 151 ALA N N 151 126.304 126.304 123.677 2.627 25757 10064 1 12 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.322 -0.034 25757 10065 1 12 . 1 1 151 151 ALA C C 151 177.678 177.678 177.445 0.233 25757 10066 1 12 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.934 0.214 25757 10067 1 12 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.649 -0.230 25757 10068 1 12 . 1 1 151 151 ALA H H 151 8.618 8.618 7.660 0.958 25757 10069 1 12 . 1 1 152 152 ALA N N 152 123.861 123.861 121.835 2.026 25757 10070 1 12 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.446 -0.328 25757 10071 1 12 . 1 1 152 152 ALA C C 152 178.823 178.823 178.555 0.268 25757 10072 1 12 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.482 2.012 25757 10073 1 12 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.247 0.510 25757 10074 1 12 . 1 1 152 152 ALA H H 152 8.354 8.354 8.638 -0.284 25757 10075 1 12 . 1 1 153 153 GLY N N 153 109.984 109.984 107.276 2.708 25757 10076 1 12 . 1 1 153 153 GLY C C 153 174.389 174.389 175.411 -1.022 25757 10077 1 12 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.245 -2.114 25757 10078 1 12 . 1 1 153 153 GLY H H 153 9.028 9.028 8.188 0.840 25757 10079 1 12 . 1 1 154 154 SER N N 154 113.934 113.934 117.598 -3.664 25757 10080 1 12 . 1 1 154 154 SER HA H 154 4.255 4.255 4.001 0.254 25757 10081 1 12 . 1 1 154 154 SER C C 154 177.929 177.929 176.769 1.160 25757 10082 1 12 . 1 1 154 154 SER CA C 154 59.379 59.379 61.592 -2.213 25757 10083 1 12 . 1 1 154 154 SER CB C 154 64.090 64.090 62.252 1.838 25757 10084 1 12 . 1 1 154 154 SER H H 154 7.962 7.962 7.971 -0.009 25757 10085 1 12 . 1 1 155 155 GLY N N 155 115.337 115.337 109.826 5.511 25757 10086 1 12 . 1 1 155 155 GLY C C 155 175.891 175.891 175.666 0.225 25757 10087 1 12 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.561 1.085 25757 10088 1 12 . 1 1 155 155 GLY H H 155 9.451 9.451 7.717 1.734 25757 10089 1 12 . 1 1 156 156 TRP N N 156 119.600 119.600 121.695 -2.095 25757 10090 1 12 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.279 -0.008 25757 10091 1 12 . 1 1 156 156 TRP C C 156 178.947 178.947 178.780 0.167 25757 10092 1 12 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.017 0.147 25757 10093 1 12 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.213 0.390 25757 10094 1 12 . 1 1 156 156 TRP H H 156 8.542 8.542 7.335 1.207 25757 10095 1 12 . 1 1 157 157 ARG N N 157 118.583 118.583 121.046 -2.463 25757 10096 1 12 . 1 1 157 157 ARG HA H 157 3.982 3.982 3.965 0.017 25757 10097 1 12 . 1 1 157 157 ARG C C 157 177.894 177.894 178.000 -0.106 25757 10098 1 12 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.038 -0.701 25757 10099 1 12 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.313 -0.256 25757 10100 1 12 . 1 1 157 157 ARG H H 157 7.747 7.747 8.421 -0.674 25757 10101 1 12 . 1 1 158 158 LYS N N 158 117.033 117.033 119.387 -2.354 25757 10102 1 12 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.926 0.017 25757 10103 1 12 . 1 1 158 158 LYS C C 158 176.973 176.973 179.116 -2.143 25757 10104 1 12 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.450 0.923 25757 10105 1 12 . 1 1 158 158 LYS CB C 158 32.291 32.291 31.882 0.409 25757 10106 1 12 . 1 1 158 158 LYS H H 158 7.529 7.529 8.027 -0.498 25757 10107 1 12 . 1 1 159 159 ILE N N 159 116.553 116.553 120.784 -4.231 25757 10108 1 12 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.736 -0.192 25757 10109 1 12 . 1 1 159 159 ILE C C 159 176.894 176.894 177.173 -0.279 25757 10110 1 12 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.567 0.949 25757 10111 1 12 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.026 -0.222 25757 10112 1 12 . 1 1 159 159 ILE H H 159 7.348 7.348 8.233 -0.885 25757 10113 1 12 . 1 1 160 160 LYS N N 160 119.278 119.278 120.730 -1.452 25757 10114 1 12 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.329 -0.290 25757 10115 1 12 . 1 1 160 160 LYS C C 160 178.566 178.566 179.146 -0.580 25757 10116 1 12 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.666 0.708 25757 10117 1 12 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.513 0.305 25757 10118 1 12 . 1 1 160 160 LYS H H 160 8.225 8.225 7.922 0.303 25757 10119 1 12 . 1 1 161 161 LEU N N 161 117.056 117.056 120.226 -3.170 25757 10120 1 12 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.275 -0.215 25757 10121 1 12 . 1 1 161 161 LEU C C 161 178.977 178.977 178.620 0.357 25757 10122 1 12 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.032 0.992 25757 10123 1 12 . 1 1 161 161 LEU CB C 161 41.982 41.982 40.968 1.014 25757 10124 1 12 . 1 1 161 161 LEU H H 161 8.057 8.057 8.422 -0.365 25757 10125 1 12 . 1 1 162 162 ALA N N 162 121.814 121.814 121.869 -0.055 25757 10126 1 12 . 1 1 162 162 ALA HA H 162 4.092 4.092 3.736 0.356 25757 10127 1 12 . 1 1 162 162 ALA C C 162 178.374 178.374 179.891 -1.517 25757 10128 1 12 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.044 0.746 25757 10129 1 12 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.564 -0.239 25757 10130 1 12 . 1 1 162 162 ALA H H 162 8.170 8.170 8.049 0.121 25757 10131 1 12 . 1 1 163 163 VAL N N 163 115.449 115.449 115.617 -0.168 25757 10132 1 12 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.830 -0.212 25757 10133 1 12 . 1 1 163 163 VAL C C 163 178.362 178.362 177.835 0.527 25757 10134 1 12 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.907 0.365 25757 10135 1 12 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.408 0.629 25757 10136 1 12 . 1 1 163 163 VAL H H 163 8.499 8.499 8.149 0.350 25757 10137 1 12 . 1 1 164 164 ARG N N 164 115.775 115.775 119.238 -3.463 25757 10138 1 12 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.248 -0.051 25757 10139 1 12 . 1 1 164 164 ARG C C 164 178.938 178.938 177.922 1.016 25757 10140 1 12 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.792 -1.109 25757 10141 1 12 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.072 -0.238 25757 10142 1 12 . 1 1 164 164 ARG H H 164 8.165 8.165 8.380 -0.215 25757 10143 1 12 . 1 1 165 165 GLY N N 165 105.570 105.570 106.632 -1.062 25757 10144 1 12 . 1 1 165 165 GLY C C 165 173.134 173.134 175.026 -1.892 25757 10145 1 12 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.066 1.676 25757 10146 1 12 . 1 1 165 165 GLY H H 165 8.455 8.455 8.039 0.416 25757 10147 1 12 . 1 1 166 166 ALA N N 166 120.648 120.648 123.773 -3.125 25757 10148 1 12 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.416 -0.074 25757 10149 1 12 . 1 1 166 166 ALA C C 166 176.155 176.155 177.622 -1.467 25757 10150 1 12 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.212 -2.439 25757 10151 1 12 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.258 0.220 25757 10152 1 12 . 1 1 166 166 ALA H H 166 7.826 7.826 8.017 -0.191 25757 10153 1 12 . 1 1 167 167 GLN N N 167 117.315 117.315 114.946 2.369 25757 10154 1 12 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.479 -0.202 25757 10155 1 12 . 1 1 167 167 GLN C C 167 175.571 175.571 175.055 0.516 25757 10156 1 12 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.205 1.722 25757 10157 1 12 . 1 1 167 167 GLN CB C 167 30.185 30.185 30.867 -0.683 25757 10158 1 12 . 1 1 167 167 GLN H H 167 7.498 7.498 7.538 -0.040 25757 10159 1 12 . 1 1 168 168 ALA N N 168 126.706 126.706 122.134 4.572 25757 10160 1 12 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.222 0.057 25757 10161 1 12 . 1 1 168 168 ALA C C 168 177.227 177.227 178.107 -0.880 25757 10162 1 12 . 1 1 168 168 ALA CA C 168 52.066 52.066 52.660 -0.594 25757 10163 1 12 . 1 1 168 168 ALA CB C 168 19.706 19.706 18.688 1.018 25757 10164 1 12 . 1 1 168 168 ALA H H 168 8.534 8.534 8.467 0.067 25757 10165 1 13 . 1 1 9 9 ILE N N 9 116.733 116.733 121.769 -5.036 25757 10166 1 13 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.976 -0.219 25757 10167 1 13 . 1 1 9 9 ILE C C 9 177.828 177.828 177.541 0.287 25757 10168 1 13 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.509 3.095 25757 10169 1 13 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.250 0.348 25757 10170 1 13 . 1 1 9 9 ILE H H 9 7.366 7.366 8.267 -0.901 25757 10171 1 13 . 1 1 10 10 ALA N N 10 121.080 121.080 122.525 -1.445 25757 10172 1 13 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.970 0.105 25757 10173 1 13 . 1 1 10 10 ALA C C 10 180.921 180.921 179.497 1.424 25757 10174 1 13 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.209 0.394 25757 10175 1 13 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.894 0.090 25757 10176 1 13 . 1 1 10 10 ALA H H 10 8.039 8.039 8.289 -0.250 25757 10177 1 13 . 1 1 11 11 GLU N N 11 119.580 119.580 119.251 0.329 25757 10178 1 13 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.924 0.165 25757 10179 1 13 . 1 1 11 11 GLU C C 11 179.561 179.561 178.928 0.633 25757 10180 1 13 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.547 0.338 25757 10181 1 13 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.294 0.169 25757 10182 1 13 . 1 1 11 11 GLU H H 11 7.741 7.741 7.558 0.183 25757 10183 1 13 . 1 1 12 12 PHE N N 12 118.509 118.509 117.531 0.978 25757 10184 1 13 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.422 0.404 25757 10185 1 13 . 1 1 12 12 PHE C C 12 179.000 179.000 178.694 0.306 25757 10186 1 13 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.749 0.415 25757 10187 1 13 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.044 0.067 25757 10188 1 13 . 1 1 12 12 PHE H H 12 8.470 8.470 7.238 1.232 25757 10189 1 13 . 1 1 13 13 LYS N N 13 123.523 123.523 119.548 3.975 25757 10190 1 13 . 1 1 13 13 LYS HA H 13 4.026 4.026 3.978 0.048 25757 10191 1 13 . 1 1 13 13 LYS C C 13 179.260 179.260 178.645 0.615 25757 10192 1 13 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.507 0.657 25757 10193 1 13 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.017 -0.184 25757 10194 1 13 . 1 1 13 13 LYS H H 13 9.171 9.171 8.539 0.632 25757 10195 1 13 . 1 1 14 14 GLU N N 14 120.415 120.415 118.796 1.619 25757 10196 1 13 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.002 0.093 25757 10197 1 13 . 1 1 14 14 GLU C C 14 179.851 179.851 179.026 0.825 25757 10198 1 13 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.373 0.213 25757 10199 1 13 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.311 0.250 25757 10200 1 13 . 1 1 14 14 GLU H H 14 7.822 7.822 8.273 -0.451 25757 10201 1 13 . 1 1 15 15 ALA N N 15 122.143 122.143 121.857 0.286 25757 10202 1 13 . 1 1 15 15 ALA HA H 15 4.130 4.130 3.956 0.174 25757 10203 1 13 . 1 1 15 15 ALA C C 15 178.222 178.222 179.040 -0.818 25757 10204 1 13 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.095 0.095 25757 10205 1 13 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.643 -0.141 25757 10206 1 13 . 1 1 15 15 ALA H H 15 8.244 8.244 8.136 0.108 25757 10207 1 13 . 1 1 16 16 PHE N N 16 119.809 119.809 118.715 1.094 25757 10208 1 13 . 1 1 16 16 PHE HA H 16 4.012 4.012 3.826 0.186 25757 10209 1 13 . 1 1 16 16 PHE C C 16 177.444 177.444 177.233 0.211 25757 10210 1 13 . 1 1 16 16 PHE CA C 16 62.064 62.064 61.222 0.841 25757 10211 1 13 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.651 -0.219 25757 10212 1 13 . 1 1 16 16 PHE H H 16 8.891 8.891 8.236 0.655 25757 10213 1 13 . 1 1 17 17 SER N N 17 112.631 112.631 115.329 -2.698 25757 10214 1 13 . 1 1 17 17 SER HA H 17 4.034 4.034 4.238 -0.204 25757 10215 1 13 . 1 1 17 17 SER C C 17 174.675 174.675 176.148 -1.473 25757 10216 1 13 . 1 1 17 17 SER CA C 17 61.507 61.507 61.264 0.242 25757 10217 1 13 . 1 1 17 17 SER CB C 17 63.414 63.414 63.296 0.118 25757 10218 1 13 . 1 1 17 17 SER H H 17 7.910 7.910 8.158 -0.248 25757 10219 1 13 . 1 1 18 18 LEU N N 18 120.614 120.614 121.252 -0.638 25757 10220 1 13 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.093 -0.081 25757 10221 1 13 . 1 1 18 18 LEU C C 18 177.366 177.366 177.417 -0.051 25757 10222 1 13 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.700 -0.314 25757 10223 1 13 . 1 1 18 18 LEU CB C 18 41.595 41.595 42.128 -0.533 25757 10224 1 13 . 1 1 18 18 LEU H H 18 7.423 7.423 7.574 -0.151 25757 10225 1 13 . 1 1 19 19 PHE N N 19 114.602 114.602 108.958 5.644 25757 10226 1 13 . 1 1 19 19 PHE C C 19 176.961 176.961 175.981 0.980 25757 10227 1 13 . 1 1 19 19 PHE CA C 19 59.484 59.484 55.491 3.993 25757 10228 1 13 . 1 1 19 19 PHE CB C 19 40.769 40.769 38.553 2.216 25757 10229 1 13 . 1 1 19 19 PHE H H 19 7.254 7.254 6.470 0.784 25757 10230 1 13 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.609 -0.034 25757 10231 1 13 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.581 -1.933 25757 10232 1 13 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.793 -0.783 25757 10233 1 13 . 1 1 23 23 GLY N N 23 108.244 108.244 108.534 -0.290 25757 10234 1 13 . 1 1 23 23 GLY C C 23 175.188 175.188 174.683 0.505 25757 10235 1 13 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.279 1.124 25757 10236 1 13 . 1 1 23 23 GLY H H 23 7.555 7.555 8.440 -0.885 25757 10237 1 13 . 1 1 24 24 ASP N N 24 120.667 120.667 119.539 1.128 25757 10238 1 13 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.575 -0.106 25757 10239 1 13 . 1 1 24 24 ASP C C 24 177.457 177.457 177.805 -0.348 25757 10240 1 13 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.322 0.470 25757 10241 1 13 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.204 -0.688 25757 10242 1 13 . 1 1 24 24 ASP H H 24 8.397 8.397 8.045 0.352 25757 10243 1 13 . 1 1 25 25 GLY N N 25 112.989 112.989 108.598 4.391 25757 10244 1 13 . 1 1 25 25 GLY C C 25 173.639 173.639 173.584 0.055 25757 10245 1 13 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.561 -0.060 25757 10246 1 13 . 1 1 25 25 GLY H H 25 10.592 10.592 8.264 2.328 25757 10247 1 13 . 1 1 26 26 THR N N 26 112.948 112.948 113.193 -0.245 25757 10248 1 13 . 1 1 26 26 THR HA H 26 5.282 5.282 5.269 0.013 25757 10249 1 13 . 1 1 26 26 THR C C 26 172.853 172.853 173.018 -0.165 25757 10250 1 13 . 1 1 26 26 THR CA C 26 59.817 59.817 60.824 -1.007 25757 10251 1 13 . 1 1 26 26 THR CB C 26 72.465 72.465 71.515 0.950 25757 10252 1 13 . 1 1 26 26 THR H H 26 8.121 8.121 8.253 -0.132 25757 10253 1 13 . 1 1 27 27 ILE N N 27 127.195 127.195 122.531 4.664 25757 10254 1 13 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.480 0.433 25757 10255 1 13 . 1 1 27 27 ILE C C 27 176.091 176.091 174.383 1.708 25757 10256 1 13 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.138 0.627 25757 10257 1 13 . 1 1 27 27 ILE CB C 27 39.705 39.705 42.323 -2.618 25757 10258 1 13 . 1 1 27 27 ILE H H 27 9.867 9.867 8.614 1.253 25757 10259 1 13 . 1 1 28 28 THR N N 28 116.655 116.655 118.751 -2.096 25757 10260 1 13 . 1 1 28 28 THR HA H 28 4.790 4.790 4.786 0.004 25757 10261 1 13 . 1 1 28 28 THR C C 28 176.696 176.696 176.008 0.688 25757 10262 1 13 . 1 1 28 28 THR CA C 28 59.590 59.590 59.889 -0.299 25757 10263 1 13 . 1 1 28 28 THR CB C 28 72.457 72.457 71.122 1.335 25757 10264 1 13 . 1 1 28 28 THR H H 28 8.457 8.457 8.151 0.306 25757 10265 1 13 . 1 1 29 29 THR N N 29 111.878 111.878 116.834 -4.956 25757 10266 1 13 . 1 1 29 29 THR HA H 29 4.188 4.188 3.976 0.212 25757 10267 1 13 . 1 1 29 29 THR C C 29 177.399 177.399 176.320 1.079 25757 10268 1 13 . 1 1 29 29 THR CA C 29 66.386 66.386 66.501 -0.116 25757 10269 1 13 . 1 1 29 29 THR CB C 29 67.726 67.726 68.321 -0.595 25757 10270 1 13 . 1 1 29 29 THR H H 29 9.211 9.211 8.874 0.337 25757 10271 1 13 . 1 1 30 30 LYS N N 30 121.140 121.140 120.341 0.799 25757 10272 1 13 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.962 0.115 25757 10273 1 13 . 1 1 30 30 LYS C C 30 179.793 179.793 178.924 0.869 25757 10274 1 13 . 1 1 30 30 LYS CA C 30 59.292 59.292 58.903 0.389 25757 10275 1 13 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.748 0.698 25757 10276 1 13 . 1 1 30 30 LYS H H 30 7.580 7.580 7.928 -0.348 25757 10277 1 13 . 1 1 31 31 GLU N N 31 121.865 121.865 119.310 2.555 25757 10278 1 13 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.946 0.048 25757 10279 1 13 . 1 1 31 31 GLU C C 31 179.355 179.355 178.788 0.567 25757 10280 1 13 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.733 -0.100 25757 10281 1 13 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.323 0.529 25757 10282 1 13 . 1 1 31 31 GLU H H 31 7.708 7.708 7.387 0.321 25757 10283 1 13 . 1 1 32 32 LEU N N 32 120.597 120.597 117.734 2.863 25757 10284 1 13 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.748 0.368 25757 10285 1 13 . 1 1 32 32 LEU C C 32 178.885 178.885 178.992 -0.107 25757 10286 1 13 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.267 0.093 25757 10287 1 13 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.675 2.361 25757 10288 1 13 . 1 1 32 32 LEU H H 32 8.688 8.688 7.540 1.148 25757 10289 1 13 . 1 1 33 33 GLY N N 33 104.837 104.837 107.407 -2.570 25757 10290 1 13 . 1 1 33 33 GLY C C 33 175.123 175.123 175.888 -0.765 25757 10291 1 13 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.472 0.775 25757 10292 1 13 . 1 1 33 33 GLY H H 33 8.694 8.694 8.485 0.209 25757 10293 1 13 . 1 1 34 34 THR N N 34 117.631 117.631 119.388 -1.757 25757 10294 1 13 . 1 1 34 34 THR HA H 34 3.899 3.899 3.825 0.074 25757 10295 1 13 . 1 1 34 34 THR C C 34 176.951 176.951 176.482 0.469 25757 10296 1 13 . 1 1 34 34 THR CA C 34 67.234 67.234 66.859 0.375 25757 10297 1 13 . 1 1 34 34 THR CB C 34 68.863 68.863 68.685 0.178 25757 10298 1 13 . 1 1 34 34 THR H H 34 7.960 7.960 7.850 0.110 25757 10299 1 13 . 1 1 35 35 VAL N N 35 121.659 121.659 121.827 -0.168 25757 10300 1 13 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.662 -0.145 25757 10301 1 13 . 1 1 35 35 VAL C C 35 178.265 178.265 178.829 -0.564 25757 10302 1 13 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.943 -0.268 25757 10303 1 13 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.398 -0.105 25757 10304 1 13 . 1 1 35 35 VAL H H 35 7.358 7.358 8.484 -1.126 25757 10305 1 13 . 1 1 36 36 MET N N 36 117.456 117.456 116.501 0.955 25757 10306 1 13 . 1 1 36 36 MET C C 36 179.088 179.088 178.660 0.428 25757 10307 1 13 . 1 1 36 36 MET CA C 36 60.477 60.477 58.747 1.730 25757 10308 1 13 . 1 1 36 36 MET CB C 36 32.443 32.443 32.031 0.412 25757 10309 1 13 . 1 1 36 36 MET H H 36 8.194 8.194 8.246 -0.052 25757 10310 1 13 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.851 0.296 25757 10311 1 13 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.998 0.352 25757 10312 1 13 . 1 1 38 38 SER HA H 38 4.085 4.085 4.314 -0.229 25757 10313 1 13 . 1 1 38 38 SER C C 38 173.788 173.788 175.227 -1.439 25757 10314 1 13 . 1 1 38 38 SER CA C 38 61.617 61.617 60.946 0.672 25757 10315 1 13 . 1 1 38 38 SER CB C 38 62.943 62.943 62.992 -0.049 25757 10316 1 13 . 1 1 39 39 LEU N N 39 119.003 119.003 120.501 -1.498 25757 10317 1 13 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.581 -0.087 25757 10318 1 13 . 1 1 39 39 LEU C C 39 176.470 176.470 177.262 -0.792 25757 10319 1 13 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.522 0.157 25757 10320 1 13 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.229 1.285 25757 10321 1 13 . 1 1 39 39 LEU H H 39 7.230 7.230 7.435 -0.205 25757 10322 1 13 . 1 1 40 40 GLY N N 40 105.026 105.026 107.863 -2.837 25757 10323 1 13 . 1 1 40 40 GLY C C 40 174.322 174.322 174.136 0.186 25757 10324 1 13 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.613 0.602 25757 10325 1 13 . 1 1 40 40 GLY H H 40 7.698 7.698 7.872 -0.174 25757 10326 1 13 . 1 1 41 41 GLN N N 41 117.929 117.929 118.999 -1.070 25757 10327 1 13 . 1 1 41 41 GLN C C 41 174.557 174.557 175.555 -0.998 25757 10328 1 13 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.975 0.869 25757 10329 1 13 . 1 1 41 41 GLN H H 41 7.866 7.866 7.657 0.209 25757 10330 1 13 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.612 0.124 25757 10331 1 13 . 1 1 43 43 PRO C C 43 177.805 177.805 176.181 1.624 25757 10332 1 13 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.900 -0.395 25757 10333 1 13 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.896 -0.734 25757 10334 1 13 . 1 1 44 44 THR N N 44 113.167 113.167 111.498 1.669 25757 10335 1 13 . 1 1 44 44 THR HA H 44 4.684 4.684 4.531 0.153 25757 10336 1 13 . 1 1 44 44 THR C C 44 175.139 175.139 175.977 -0.838 25757 10337 1 13 . 1 1 44 44 THR CA C 44 60.556 60.556 59.199 1.357 25757 10338 1 13 . 1 1 44 44 THR CB C 44 71.064 71.064 71.161 -0.097 25757 10339 1 13 . 1 1 44 44 THR H H 44 8.798 8.798 7.926 0.872 25757 10340 1 13 . 1 1 45 45 GLU N N 45 120.673 120.673 121.550 -0.877 25757 10341 1 13 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.924 0.067 25757 10342 1 13 . 1 1 45 45 GLU C C 45 178.940 178.940 178.783 0.157 25757 10343 1 13 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.061 -0.160 25757 10344 1 13 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.172 -0.143 25757 10345 1 13 . 1 1 45 45 GLU H H 45 8.812 8.812 8.945 -0.133 25757 10346 1 13 . 1 1 46 46 ALA N N 46 120.576 120.576 121.124 -0.548 25757 10347 1 13 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.079 -0.112 25757 10348 1 13 . 1 1 46 46 ALA C C 46 180.290 180.290 179.883 0.407 25757 10349 1 13 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.091 -0.172 25757 10350 1 13 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.215 -0.054 25757 10351 1 13 . 1 1 46 46 ALA H H 46 8.276 8.276 8.491 -0.215 25757 10352 1 13 . 1 1 47 47 GLU N N 47 116.104 116.104 119.295 -3.191 25757 10353 1 13 . 1 1 47 47 GLU HA H 47 4.000 4.000 3.986 0.014 25757 10354 1 13 . 1 1 47 47 GLU C C 47 180.224 180.224 179.066 1.158 25757 10355 1 13 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.586 -0.655 25757 10356 1 13 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.411 0.578 25757 10357 1 13 . 1 1 47 47 GLU H H 47 7.425 7.425 7.638 -0.213 25757 10358 1 13 . 1 1 48 48 LEU N N 48 120.425 120.425 119.901 0.524 25757 10359 1 13 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.929 0.121 25757 10360 1 13 . 1 1 48 48 LEU C C 48 178.551 178.551 179.009 -0.458 25757 10361 1 13 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.255 -0.416 25757 10362 1 13 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.315 1.254 25757 10363 1 13 . 1 1 48 48 LEU H H 48 8.121 8.121 7.567 0.554 25757 10364 1 13 . 1 1 49 49 GLN N N 49 118.372 118.372 118.743 -0.371 25757 10365 1 13 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.849 -0.087 25757 10366 1 13 . 1 1 49 49 GLN C C 49 178.567 178.567 178.440 0.127 25757 10367 1 13 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.253 -0.390 25757 10368 1 13 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.425 -0.183 25757 10369 1 13 . 1 1 49 49 GLN H H 49 8.302 8.302 8.279 0.023 25757 10370 1 13 . 1 1 50 50 ASP N N 50 119.992 119.992 120.932 -0.940 25757 10371 1 13 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.334 0.026 25757 10372 1 13 . 1 1 50 50 ASP C C 50 178.600 178.600 178.749 -0.149 25757 10373 1 13 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.255 0.448 25757 10374 1 13 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.510 -0.043 25757 10375 1 13 . 1 1 50 50 ASP H H 50 8.150 8.150 8.201 -0.051 25757 10376 1 13 . 1 1 51 51 MET N N 51 119.238 119.238 119.497 -0.259 25757 10377 1 13 . 1 1 51 51 MET HA H 51 3.981 3.981 4.051 -0.070 25757 10378 1 13 . 1 1 51 51 MET C C 51 179.006 179.006 178.942 0.064 25757 10379 1 13 . 1 1 51 51 MET CA C 51 59.443 59.443 59.617 -0.174 25757 10380 1 13 . 1 1 51 51 MET CB C 51 33.380 33.380 32.827 0.553 25757 10381 1 13 . 1 1 51 51 MET H H 51 7.844 7.844 8.015 -0.171 25757 10382 1 13 . 1 1 52 52 ILE N N 52 118.161 118.161 119.094 -0.933 25757 10383 1 13 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.592 -0.115 25757 10384 1 13 . 1 1 52 52 ILE C C 52 177.847 177.847 177.896 -0.049 25757 10385 1 13 . 1 1 52 52 ILE CA C 52 64.995 64.995 65.092 -0.097 25757 10386 1 13 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.928 0.195 25757 10387 1 13 . 1 1 52 52 ILE H H 52 7.686 7.686 8.310 -0.624 25757 10388 1 13 . 1 1 53 53 ASN N N 53 117.884 117.884 116.385 1.499 25757 10389 1 13 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.393 -0.028 25757 10390 1 13 . 1 1 53 53 ASN C C 53 177.515 177.515 176.795 0.720 25757 10391 1 13 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.741 0.466 25757 10392 1 13 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.647 -0.569 25757 10393 1 13 . 1 1 53 53 ASN H H 53 8.713 8.713 8.176 0.537 25757 10394 1 13 . 1 1 54 54 GLU N N 54 116.178 116.178 117.637 -1.459 25757 10395 1 13 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.212 -0.223 25757 10396 1 13 . 1 1 54 54 GLU C C 54 177.557 177.557 177.751 -0.194 25757 10397 1 13 . 1 1 54 54 GLU CA C 54 58.990 58.990 58.330 0.660 25757 10398 1 13 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.542 -0.079 25757 10399 1 13 . 1 1 54 54 GLU H H 54 7.530 7.530 8.038 -0.508 25757 10400 1 13 . 1 1 55 55 VAL N N 55 107.164 107.164 112.254 -5.090 25757 10401 1 13 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.174 0.348 25757 10402 1 13 . 1 1 55 55 VAL C C 55 175.602 175.602 175.703 -0.101 25757 10403 1 13 . 1 1 55 55 VAL CA C 55 60.352 60.352 61.977 -1.625 25757 10404 1 13 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.819 -0.216 25757 10405 1 13 . 1 1 55 55 VAL H H 55 7.175 7.175 7.665 -0.490 25757 10406 1 13 . 1 1 56 56 ASP N N 56 122.126 122.126 121.565 0.561 25757 10407 1 13 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.785 -0.186 25757 10408 1 13 . 1 1 56 56 ASP C C 56 176.182 176.182 176.440 -0.258 25757 10409 1 13 . 1 1 56 56 ASP CA C 56 53.806 53.806 55.013 -1.207 25757 10410 1 13 . 1 1 56 56 ASP CB C 56 40.270 40.270 40.106 0.164 25757 10411 1 13 . 1 1 56 56 ASP H H 56 7.569 7.569 7.900 -0.331 25757 10412 1 13 . 1 1 57 57 ALA N N 57 103.782 103.782 129.203 -25.421 25757 10413 1 13 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.140 0.040 25757 10414 1 13 . 1 1 57 57 ALA C C 57 178.584 178.584 178.126 0.458 25757 10415 1 13 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.754 0.590 25757 10416 1 13 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.888 -0.364 25757 10417 1 13 . 1 1 57 57 ALA H H 57 8.515 8.515 9.312 -0.797 25757 10418 1 13 . 1 1 58 58 ASP N N 58 113.602 113.602 116.437 -2.835 25757 10419 1 13 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.639 -0.053 25757 10420 1 13 . 1 1 58 58 ASP C C 58 177.756 177.756 177.206 0.550 25757 10421 1 13 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.101 -1.339 25757 10422 1 13 . 1 1 58 58 ASP CB C 58 39.678 39.678 42.009 -2.331 25757 10423 1 13 . 1 1 58 58 ASP H H 58 8.130 8.130 8.030 0.100 25757 10424 1 13 . 1 1 59 59 GLY N N 59 109.195 109.195 110.928 -1.733 25757 10425 1 13 . 1 1 59 59 GLY C C 59 175.139 175.139 174.612 0.527 25757 10426 1 13 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.217 2.047 25757 10427 1 13 . 1 1 59 59 GLY H H 59 7.694 7.694 8.106 -0.412 25757 10428 1 13 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.749 -0.144 25757 10429 1 13 . 1 1 61 61 GLY N N 61 113.316 113.316 109.986 3.330 25757 10430 1 13 . 1 1 61 61 GLY C C 61 173.234 173.234 173.163 0.071 25757 10431 1 13 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.052 0.646 25757 10432 1 13 . 1 1 61 61 GLY H H 61 10.633 10.633 8.449 2.184 25757 10433 1 13 . 1 1 62 62 THR N N 62 108.892 108.892 109.809 -0.917 25757 10434 1 13 . 1 1 62 62 THR HA H 62 4.736 4.736 4.718 0.018 25757 10435 1 13 . 1 1 62 62 THR C C 62 173.091 173.091 172.867 0.224 25757 10436 1 13 . 1 1 62 62 THR CA C 62 59.617 59.617 59.510 0.107 25757 10437 1 13 . 1 1 62 62 THR CB C 62 72.004 72.004 72.264 -0.260 25757 10438 1 13 . 1 1 62 62 THR H H 62 7.673 7.673 8.144 -0.471 25757 10439 1 13 . 1 1 63 63 ILE N N 63 123.324 123.324 122.666 0.658 25757 10440 1 13 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.666 0.463 25757 10441 1 13 . 1 1 63 63 ILE C C 63 175.652 175.652 175.139 0.513 25757 10442 1 13 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.754 -0.268 25757 10443 1 13 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.467 -0.510 25757 10444 1 13 . 1 1 63 63 ILE H H 63 8.907 8.907 8.729 0.178 25757 10445 1 13 . 1 1 64 64 ASP N N 64 128.253 128.253 128.259 -0.006 25757 10446 1 13 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.875 0.446 25757 10447 1 13 . 1 1 64 64 ASP C C 64 176.431 176.431 177.561 -1.130 25757 10448 1 13 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.994 -1.663 25757 10449 1 13 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.957 -0.904 25757 10450 1 13 . 1 1 64 64 ASP H H 64 8.864 8.864 9.251 -0.387 25757 10451 1 13 . 1 1 65 65 PHE N N 65 118.583 118.583 121.345 -2.762 25757 10452 1 13 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.596 -0.736 25757 10453 1 13 . 1 1 65 65 PHE C C 65 173.458 173.458 174.501 -1.043 25757 10454 1 13 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.720 2.079 25757 10455 1 13 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.763 -0.882 25757 10456 1 13 . 1 1 65 65 PHE H H 65 8.962 8.962 8.905 0.057 25757 10457 1 13 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.658 0.460 25757 10458 1 13 . 1 1 66 66 PRO C C 66 180.038 180.038 178.588 1.450 25757 10459 1 13 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.924 1.766 25757 10460 1 13 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.900 -0.223 25757 10461 1 13 . 1 1 67 67 GLU N N 67 118.402 118.402 119.635 -1.233 25757 10462 1 13 . 1 1 67 67 GLU C C 67 178.737 178.737 178.614 0.123 25757 10463 1 13 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.761 -0.753 25757 10464 1 13 . 1 1 67 67 GLU CB C 67 29.685 29.685 28.990 0.695 25757 10465 1 13 . 1 1 67 67 GLU H H 67 7.953 7.953 8.166 -0.213 25757 10466 1 13 . 1 1 68 68 PHE N N 68 123.421 123.421 119.744 3.677 25757 10467 1 13 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.254 -0.282 25757 10468 1 13 . 1 1 68 68 PHE C C 68 177.184 177.184 177.368 -0.184 25757 10469 1 13 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.505 -0.167 25757 10470 1 13 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.301 0.668 25757 10471 1 13 . 1 1 68 68 PHE H H 68 8.928 8.928 7.655 1.273 25757 10472 1 13 . 1 1 69 69 LEU N N 69 119.284 119.284 120.050 -0.766 25757 10473 1 13 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.669 -0.334 25757 10474 1 13 . 1 1 69 69 LEU C C 69 178.987 178.987 178.439 0.548 25757 10475 1 13 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.871 -1.009 25757 10476 1 13 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.583 -0.751 25757 10477 1 13 . 1 1 69 69 LEU H H 69 8.374 8.374 7.529 0.845 25757 10478 1 13 . 1 1 70 70 THR N N 70 116.017 116.017 113.167 2.850 25757 10479 1 13 . 1 1 70 70 THR HA H 70 4.338 4.338 3.770 0.568 25757 10480 1 13 . 1 1 70 70 THR C C 70 176.169 176.169 176.673 -0.504 25757 10481 1 13 . 1 1 70 70 THR CA C 70 66.700 66.700 65.570 1.130 25757 10482 1 13 . 1 1 70 70 THR CB C 70 68.379 68.379 68.788 -0.409 25757 10483 1 13 . 1 1 70 70 THR H H 70 7.493 7.493 7.836 -0.343 25757 10484 1 13 . 1 1 71 71 MET N N 71 121.915 121.915 120.651 1.264 25757 10485 1 13 . 1 1 71 71 MET HA H 71 3.718 3.718 3.996 -0.278 25757 10486 1 13 . 1 1 71 71 MET C C 71 178.190 178.190 178.252 -0.062 25757 10487 1 13 . 1 1 71 71 MET CA C 71 59.335 59.335 58.904 0.430 25757 10488 1 13 . 1 1 71 71 MET CB C 71 33.894 33.894 32.495 1.399 25757 10489 1 13 . 1 1 71 71 MET H H 71 7.924 7.924 7.850 0.074 25757 10490 1 13 . 1 1 72 72 MET N N 72 116.973 116.973 114.110 2.863 25757 10491 1 13 . 1 1 72 72 MET HA H 72 3.968 3.968 4.531 -0.563 25757 10492 1 13 . 1 1 72 72 MET C C 72 178.211 178.211 177.905 0.306 25757 10493 1 13 . 1 1 72 72 MET CA C 72 56.059 56.059 57.679 -1.620 25757 10494 1 13 . 1 1 72 72 MET CB C 72 31.639 31.639 32.315 -0.676 25757 10495 1 13 . 1 1 72 72 MET H H 72 8.276 8.276 7.991 0.285 25757 10496 1 13 . 1 1 73 73 ALA N N 73 122.499 122.499 124.230 -1.731 25757 10497 1 13 . 1 1 73 73 ALA HA H 73 3.950 3.950 4.072 -0.122 25757 10498 1 13 . 1 1 73 73 ALA C C 73 180.231 180.231 179.890 0.341 25757 10499 1 13 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.881 0.072 25757 10500 1 13 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.627 0.405 25757 10501 1 13 . 1 1 73 73 ALA H H 73 8.240 8.240 8.337 -0.097 25757 10502 1 13 . 1 1 74 74 ARG N N 74 116.098 116.098 116.773 -0.675 25757 10503 1 13 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.054 -0.062 25757 10504 1 13 . 1 1 74 74 ARG C C 74 178.567 178.567 178.600 -0.033 25757 10505 1 13 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.176 0.649 25757 10506 1 13 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.483 0.592 25757 10507 1 13 . 1 1 74 74 ARG H H 74 7.420 7.420 7.733 -0.313 25757 10508 1 13 . 1 1 75 75 LYS N N 75 119.046 119.046 119.067 -0.021 25757 10509 1 13 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.303 -0.260 25757 10510 1 13 . 1 1 75 75 LYS C C 75 179.045 179.045 178.061 0.984 25757 10511 1 13 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.012 0.877 25757 10512 1 13 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.036 -0.270 25757 10513 1 13 . 1 1 75 75 LYS H H 75 7.862 7.862 8.110 -0.248 25757 10514 1 13 . 1 1 76 76 MET N N 76 116.772 116.772 118.334 -1.562 25757 10515 1 13 . 1 1 76 76 MET H H 76 8.099 8.099 8.221 -0.122 25757 10516 1 13 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.427 0.207 25757 10517 1 13 . 1 1 78 78 ASP C C 78 176.395 176.395 176.579 -0.184 25757 10518 1 13 . 1 1 78 78 ASP CA C 78 54.644 54.644 55.129 -0.485 25757 10519 1 13 . 1 1 78 78 ASP CB C 78 41.474 41.474 39.910 1.564 25757 10520 1 13 . 1 1 79 79 THR N N 79 113.904 113.904 109.984 3.920 25757 10521 1 13 . 1 1 79 79 THR HA H 79 4.215 4.215 4.351 -0.137 25757 10522 1 13 . 1 1 79 79 THR C C 79 174.204 174.204 174.708 -0.504 25757 10523 1 13 . 1 1 79 79 THR CA C 79 62.264 62.264 63.048 -0.784 25757 10524 1 13 . 1 1 79 79 THR CB C 79 69.884 69.884 70.115 -0.231 25757 10525 1 13 . 1 1 79 79 THR H H 79 8.039 8.039 8.235 -0.196 25757 10526 1 13 . 1 1 80 80 ASP N N 80 123.572 123.572 122.170 1.402 25757 10527 1 13 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.868 -0.148 25757 10528 1 13 . 1 1 80 80 ASP C C 80 176.221 176.221 175.870 0.351 25757 10529 1 13 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.472 -0.157 25757 10530 1 13 . 1 1 80 80 ASP CB C 80 41.427 41.427 41.776 -0.349 25757 10531 1 13 . 1 1 80 80 ASP H H 80 8.441 8.441 8.000 0.441 25757 10532 1 13 . 1 1 81 81 SER N N 81 117.879 117.879 118.200 -0.321 25757 10533 1 13 . 1 1 81 81 SER HA H 81 3.925 3.925 4.347 -0.422 25757 10534 1 13 . 1 1 81 81 SER C C 81 175.264 175.264 175.754 -0.490 25757 10535 1 13 . 1 1 81 81 SER CA C 81 58.860 58.860 60.521 -1.661 25757 10536 1 13 . 1 1 81 81 SER CB C 81 63.790 63.790 63.859 -0.069 25757 10537 1 13 . 1 1 81 81 SER H H 81 8.503 8.503 8.649 -0.146 25757 10538 1 13 . 1 1 82 82 GLU N N 82 123.206 123.206 121.513 1.693 25757 10539 1 13 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.955 0.103 25757 10540 1 13 . 1 1 82 82 GLU C C 82 178.378 178.378 178.643 -0.265 25757 10541 1 13 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.149 -0.563 25757 10542 1 13 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.327 0.276 25757 10543 1 13 . 1 1 82 82 GLU H H 82 8.563 8.563 8.810 -0.247 25757 10544 1 13 . 1 1 83 83 GLU N N 83 119.262 119.262 118.222 1.040 25757 10545 1 13 . 1 1 83 83 GLU HA H 83 3.957 3.957 4.005 -0.048 25757 10546 1 13 . 1 1 83 83 GLU C C 83 178.606 178.606 179.486 -0.880 25757 10547 1 13 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.539 0.130 25757 10548 1 13 . 1 1 83 83 GLU CB C 83 29.355 29.355 28.970 0.385 25757 10549 1 13 . 1 1 83 83 GLU H H 83 7.728 7.728 8.439 -0.711 25757 10550 1 13 . 1 1 84 84 GLU N N 84 118.432 118.432 119.299 -0.867 25757 10551 1 13 . 1 1 84 84 GLU HA H 84 4.107 4.107 3.987 0.120 25757 10552 1 13 . 1 1 84 84 GLU C C 84 179.436 179.436 179.232 0.204 25757 10553 1 13 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.517 -0.014 25757 10554 1 13 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.580 -0.473 25757 10555 1 13 . 1 1 84 84 GLU H H 84 8.346 8.346 7.944 0.402 25757 10556 1 13 . 1 1 85 85 ILE N N 85 120.925 120.925 120.633 0.292 25757 10557 1 13 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.743 0.005 25757 10558 1 13 . 1 1 85 85 ILE C C 85 177.661 177.661 177.864 -0.203 25757 10559 1 13 . 1 1 85 85 ILE CA C 85 65.490 65.490 66.132 -0.642 25757 10560 1 13 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.920 -0.489 25757 10561 1 13 . 1 1 85 85 ILE H H 85 7.821 7.821 8.221 -0.400 25757 10562 1 13 . 1 1 86 86 ARG N N 86 121.916 121.916 119.232 2.684 25757 10563 1 13 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.149 -0.013 25757 10564 1 13 . 1 1 86 86 ARG C C 86 179.208 179.208 178.734 0.474 25757 10565 1 13 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.571 0.800 25757 10566 1 13 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.519 0.579 25757 10567 1 13 . 1 1 86 86 ARG H H 86 8.432 8.432 8.312 0.120 25757 10568 1 13 . 1 1 87 87 GLU N N 87 118.261 118.261 119.914 -1.653 25757 10569 1 13 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.986 0.126 25757 10570 1 13 . 1 1 87 87 GLU C C 87 178.516 178.516 178.777 -0.261 25757 10571 1 13 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.194 -0.169 25757 10572 1 13 . 1 1 87 87 GLU CB C 87 29.170 29.170 28.729 0.441 25757 10573 1 13 . 1 1 87 87 GLU H H 87 8.225 8.225 8.285 -0.060 25757 10574 1 13 . 1 1 88 88 ALA N N 88 121.009 121.009 122.854 -1.845 25757 10575 1 13 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.528 0.299 25757 10576 1 13 . 1 1 88 88 ALA C C 88 177.947 177.947 178.159 -0.212 25757 10577 1 13 . 1 1 88 88 ALA CA C 88 54.861 54.861 55.001 -0.140 25757 10578 1 13 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.393 -0.438 25757 10579 1 13 . 1 1 88 88 ALA H H 88 7.789 7.789 7.998 -0.209 25757 10580 1 13 . 1 1 89 89 PHE N N 89 117.164 117.164 118.567 -1.403 25757 10581 1 13 . 1 1 89 89 PHE C C 89 176.134 176.134 177.320 -1.186 25757 10582 1 13 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.504 2.146 25757 10583 1 13 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.928 -0.035 25757 10584 1 13 . 1 1 89 89 PHE H H 89 8.337 8.337 7.640 0.697 25757 10585 1 13 . 1 1 90 90 ARG N N 90 114.900 114.900 117.847 -2.947 25757 10586 1 13 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.966 -0.052 25757 10587 1 13 . 1 1 90 90 ARG C C 90 178.296 178.296 177.547 0.749 25757 10588 1 13 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.869 1.210 25757 10589 1 13 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.227 -0.134 25757 10590 1 13 . 1 1 90 90 ARG H H 90 7.681 7.681 7.850 -0.169 25757 10591 1 13 . 1 1 91 91 VAL N N 91 116.927 116.927 115.142 1.785 25757 10592 1 13 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.852 -0.245 25757 10593 1 13 . 1 1 91 91 VAL C C 91 177.964 177.964 177.518 0.446 25757 10594 1 13 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.851 0.109 25757 10595 1 13 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.695 -0.076 25757 10596 1 13 . 1 1 91 91 VAL H H 91 7.405 7.405 7.515 -0.110 25757 10597 1 13 . 1 1 92 92 PHE N N 92 119.026 119.026 117.228 1.798 25757 10598 1 13 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.328 0.034 25757 10599 1 13 . 1 1 92 92 PHE C C 92 177.639 177.639 176.344 1.295 25757 10600 1 13 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.059 -0.338 25757 10601 1 13 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.618 -0.191 25757 10602 1 13 . 1 1 92 92 PHE H H 92 7.886 7.886 7.488 0.398 25757 10603 1 13 . 1 1 93 93 ASP N N 93 118.238 118.238 118.709 -0.471 25757 10604 1 13 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.703 -0.241 25757 10605 1 13 . 1 1 93 93 ASP C C 93 176.979 176.979 176.706 0.273 25757 10606 1 13 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.417 -1.269 25757 10607 1 13 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.860 -1.711 25757 10608 1 13 . 1 1 93 93 ASP H H 93 8.009 8.009 7.338 0.671 25757 10609 1 13 . 1 1 94 94 LYS N N 94 125.792 125.792 125.901 -0.109 25757 10610 1 13 . 1 1 94 94 LYS C C 94 178.213 178.213 177.557 0.656 25757 10611 1 13 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.926 0.392 25757 10612 1 13 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.517 -1.489 25757 10613 1 13 . 1 1 94 94 LYS H H 94 7.428 7.428 8.120 -0.692 25757 10614 1 13 . 1 1 95 95 ASP N N 95 113.833 113.833 115.132 -1.299 25757 10615 1 13 . 1 1 95 95 ASP C C 95 177.718 177.718 176.785 0.933 25757 10616 1 13 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.409 -1.464 25757 10617 1 13 . 1 1 95 95 ASP CB C 95 39.743 39.743 41.076 -1.333 25757 10618 1 13 . 1 1 95 95 ASP H H 95 8.159 8.159 7.958 0.201 25757 10619 1 13 . 1 1 96 96 GLY N N 96 109.414 109.414 108.003 1.411 25757 10620 1 13 . 1 1 96 96 GLY C C 96 175.093 175.093 175.321 -0.228 25757 10621 1 13 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.730 1.524 25757 10622 1 13 . 1 1 96 96 GLY H H 96 7.848 7.848 7.611 0.237 25757 10623 1 13 . 1 1 97 97 ASN N N 97 119.590 119.590 118.560 1.030 25757 10624 1 13 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.509 0.103 25757 10625 1 13 . 1 1 97 97 ASN C C 97 175.937 175.937 176.468 -0.531 25757 10626 1 13 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.773 -0.885 25757 10627 1 13 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.544 -1.224 25757 10628 1 13 . 1 1 97 97 ASN H H 97 8.338 8.338 8.759 -0.421 25757 10629 1 13 . 1 1 98 98 GLY N N 98 112.940 112.940 107.735 5.205 25757 10630 1 13 . 1 1 98 98 GLY C C 98 172.429 172.429 172.540 -0.111 25757 10631 1 13 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.957 0.135 25757 10632 1 13 . 1 1 98 98 GLY H H 98 10.695 10.695 8.889 1.806 25757 10633 1 13 . 1 1 99 99 TYR N N 99 115.544 115.544 117.704 -2.160 25757 10634 1 13 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.231 -0.144 25757 10635 1 13 . 1 1 99 99 TYR C C 99 174.859 174.859 174.684 0.175 25757 10636 1 13 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.009 -0.991 25757 10637 1 13 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.294 1.059 25757 10638 1 13 . 1 1 99 99 TYR H H 99 7.597 7.597 8.254 -0.657 25757 10639 1 13 . 1 1 100 100 ILE N N 100 127.078 127.078 124.644 2.434 25757 10640 1 13 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.671 0.118 25757 10641 1 13 . 1 1 100 100 ILE C C 100 175.387 175.387 176.258 -0.871 25757 10642 1 13 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.867 0.139 25757 10643 1 13 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.102 -0.312 25757 10644 1 13 . 1 1 100 100 ILE H H 100 10.267 10.267 9.343 0.924 25757 10645 1 13 . 1 1 101 101 SER N N 101 124.102 124.102 123.757 0.345 25757 10646 1 13 . 1 1 101 101 SER HA H 101 4.417 4.417 5.184 -0.767 25757 10647 1 13 . 1 1 101 101 SER C C 101 175.360 175.360 175.454 -0.094 25757 10648 1 13 . 1 1 101 101 SER CA C 101 56.036 56.036 57.820 -1.784 25757 10649 1 13 . 1 1 101 101 SER CB C 101 66.896 66.896 64.978 1.918 25757 10650 1 13 . 1 1 101 101 SER H H 101 8.985 8.985 8.279 0.706 25757 10651 1 13 . 1 1 102 102 ALA N N 102 122.780 122.780 124.267 -1.487 25757 10652 1 13 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.974 -0.230 25757 10653 1 13 . 1 1 102 102 ALA C C 102 179.175 179.175 178.661 0.514 25757 10654 1 13 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.616 0.674 25757 10655 1 13 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.243 -0.216 25757 10656 1 13 . 1 1 102 102 ALA H H 102 9.269 9.269 8.955 0.314 25757 10657 1 13 . 1 1 103 103 ALA N N 103 118.513 118.513 120.995 -2.482 25757 10658 1 13 . 1 1 103 103 ALA HA H 103 4.011 4.011 4.030 -0.019 25757 10659 1 13 . 1 1 103 103 ALA C C 103 181.521 181.521 179.624 1.897 25757 10660 1 13 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.194 0.160 25757 10661 1 13 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.331 -0.040 25757 10662 1 13 . 1 1 103 103 ALA H H 103 8.321 8.321 8.396 -0.075 25757 10663 1 13 . 1 1 104 104 GLU N N 104 119.550 119.550 119.150 0.400 25757 10664 1 13 . 1 1 104 104 GLU HA H 104 4.006 4.006 3.990 0.016 25757 10665 1 13 . 1 1 104 104 GLU C C 104 179.750 179.750 179.185 0.565 25757 10666 1 13 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.617 -0.448 25757 10667 1 13 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.340 -0.125 25757 10668 1 13 . 1 1 104 104 GLU H H 104 7.867 7.867 8.370 -0.503 25757 10669 1 13 . 1 1 105 105 LEU N N 105 122.688 122.688 121.083 1.605 25757 10670 1 13 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.912 0.006 25757 10671 1 13 . 1 1 105 105 LEU C C 105 178.233 178.233 177.746 0.487 25757 10672 1 13 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.308 -0.574 25757 10673 1 13 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.823 0.197 25757 10674 1 13 . 1 1 105 105 LEU H H 105 8.746 8.746 8.234 0.512 25757 10675 1 13 . 1 1 106 106 ARG N N 106 118.835 118.835 118.080 0.755 25757 10676 1 13 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.770 -0.120 25757 10677 1 13 . 1 1 106 106 ARG C C 106 178.742 178.742 178.322 0.420 25757 10678 1 13 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.423 0.540 25757 10679 1 13 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.164 0.882 25757 10680 1 13 . 1 1 106 106 ARG H H 106 8.684 8.684 8.266 0.418 25757 10681 1 13 . 1 1 107 107 HIS N N 107 119.258 119.258 120.744 -1.486 25757 10682 1 13 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.450 -0.183 25757 10683 1 13 . 1 1 107 107 HIS C C 107 177.244 177.244 177.440 -0.196 25757 10684 1 13 . 1 1 107 107 HIS CA C 107 60.152 60.152 59.683 0.469 25757 10685 1 13 . 1 1 107 107 HIS CB C 107 30.575 30.575 30.380 0.195 25757 10686 1 13 . 1 1 107 107 HIS H H 107 7.691 7.691 8.229 -0.538 25757 10687 1 13 . 1 1 108 108 VAL N N 108 118.996 118.996 120.382 -1.386 25757 10688 1 13 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.845 -0.407 25757 10689 1 13 . 1 1 108 108 VAL C C 108 177.998 177.998 178.435 -0.437 25757 10690 1 13 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.031 0.400 25757 10691 1 13 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.346 0.078 25757 10692 1 13 . 1 1 108 108 VAL H H 108 7.599 7.599 8.251 -0.652 25757 10693 1 13 . 1 1 109 109 MET N N 109 114.880 114.880 119.844 -4.964 25757 10694 1 13 . 1 1 109 109 MET C C 109 179.119 179.119 177.696 1.423 25757 10695 1 13 . 1 1 109 109 MET CA C 109 56.979 56.979 58.534 -1.555 25757 10696 1 13 . 1 1 109 109 MET CB C 109 29.253 29.253 32.228 -2.975 25757 10697 1 13 . 1 1 109 109 MET H H 109 7.911 7.911 8.291 -0.380 25757 10698 1 13 . 1 1 110 110 THR N N 110 116.943 116.943 113.657 3.286 25757 10699 1 13 . 1 1 110 110 THR HA H 110 4.229 4.229 3.872 0.357 25757 10700 1 13 . 1 1 110 110 THR C C 110 178.506 178.506 177.180 1.326 25757 10701 1 13 . 1 1 110 110 THR CA C 110 66.573 66.573 65.411 1.162 25757 10702 1 13 . 1 1 110 110 THR CB C 110 68.575 68.575 68.510 0.065 25757 10703 1 13 . 1 1 110 110 THR H H 110 8.353 8.353 8.105 0.248 25757 10704 1 13 . 1 1 111 111 ASN N N 111 123.829 123.829 119.947 3.882 25757 10705 1 13 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.355 0.007 25757 10706 1 13 . 1 1 111 111 ASN C C 111 177.197 177.197 176.910 0.287 25757 10707 1 13 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.545 0.414 25757 10708 1 13 . 1 1 111 111 ASN CB C 111 37.223 37.223 37.840 -0.617 25757 10709 1 13 . 1 1 111 111 ASN H H 111 8.053 8.053 8.019 0.034 25757 10710 1 13 . 1 1 112 112 LEU N N 112 119.036 119.036 116.502 2.534 25757 10711 1 13 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.105 0.065 25757 10712 1 13 . 1 1 112 112 LEU C C 112 176.377 176.377 177.838 -1.461 25757 10713 1 13 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.055 -0.550 25757 10714 1 13 . 1 1 112 112 LEU CB C 112 42.360 42.360 41.920 0.440 25757 10715 1 13 . 1 1 112 112 LEU H H 112 7.794 7.794 7.271 0.523 25757 10716 1 13 . 1 1 113 113 GLY N N 113 106.045 106.045 104.522 1.523 25757 10717 1 13 . 1 1 113 113 GLY C C 113 174.248 174.248 174.308 -0.060 25757 10718 1 13 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.407 0.900 25757 10719 1 13 . 1 1 113 113 GLY H H 113 7.741 7.741 7.973 -0.232 25757 10720 1 13 . 1 1 114 114 GLU N N 114 120.556 120.556 119.636 0.920 25757 10721 1 13 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.735 -0.425 25757 10722 1 13 . 1 1 114 114 GLU C C 114 174.993 174.993 175.558 -0.565 25757 10723 1 13 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.372 0.265 25757 10724 1 13 . 1 1 114 114 GLU CB C 114 31.217 31.217 31.848 -0.631 25757 10725 1 13 . 1 1 114 114 GLU H H 114 7.980 7.980 7.698 0.282 25757 10726 1 13 . 1 1 115 115 LYS N N 115 124.986 124.986 121.438 3.548 25757 10727 1 13 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.674 -0.340 25757 10728 1 13 . 1 1 115 115 LYS C C 115 175.285 175.285 175.273 0.012 25757 10729 1 13 . 1 1 115 115 LYS CA C 115 55.581 55.581 55.656 -0.075 25757 10730 1 13 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.792 -0.819 25757 10731 1 13 . 1 1 115 115 LYS H H 115 8.613 8.613 8.462 0.151 25757 10732 1 13 . 1 1 116 116 LEU N N 116 125.243 125.243 126.688 -1.445 25757 10733 1 13 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.538 0.150 25757 10734 1 13 . 1 1 116 116 LEU C C 116 178.365 178.365 175.596 2.769 25757 10735 1 13 . 1 1 116 116 LEU CA C 116 54.348 54.348 55.051 -0.703 25757 10736 1 13 . 1 1 116 116 LEU CB C 116 44.289 44.289 45.489 -1.200 25757 10737 1 13 . 1 1 116 116 LEU H H 116 8.066 8.066 8.484 -0.418 25757 10738 1 13 . 1 1 117 117 THR N N 117 114.324 114.324 112.848 1.476 25757 10739 1 13 . 1 1 117 117 THR HA H 117 4.713 4.713 4.628 0.085 25757 10740 1 13 . 1 1 117 117 THR C C 117 175.539 175.539 174.748 0.791 25757 10741 1 13 . 1 1 117 117 THR CA C 117 60.756 60.756 59.867 0.889 25757 10742 1 13 . 1 1 117 117 THR CB C 117 71.144 71.144 71.147 -0.003 25757 10743 1 13 . 1 1 117 117 THR H H 117 9.228 9.228 7.876 1.352 25757 10744 1 13 . 1 1 118 118 ASP N N 118 121.016 121.016 120.236 0.780 25757 10745 1 13 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.268 -0.113 25757 10746 1 13 . 1 1 118 118 ASP H H 118 8.919 8.919 8.771 0.148 25757 10747 1 13 . 1 1 119 119 GLU N N 119 121.016 121.016 118.311 2.705 25757 10748 1 13 . 1 1 119 119 GLU C C 119 179.204 179.204 178.499 0.705 25757 10749 1 13 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.311 -1.241 25757 10750 1 13 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.623 -0.579 25757 10751 1 13 . 1 1 119 119 GLU H H 119 8.919 8.919 8.217 0.702 25757 10752 1 13 . 1 1 120 120 GLU N N 120 120.566 120.566 119.329 1.237 25757 10753 1 13 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.977 0.024 25757 10754 1 13 . 1 1 120 120 GLU C C 120 180.329 180.329 179.082 1.247 25757 10755 1 13 . 1 1 120 120 GLU CA C 120 59.091 59.091 58.908 0.183 25757 10756 1 13 . 1 1 120 120 GLU CB C 120 30.638 30.638 28.954 1.684 25757 10757 1 13 . 1 1 120 120 GLU H H 120 7.732 7.732 7.726 0.006 25757 10758 1 13 . 1 1 121 121 VAL N N 121 121.875 121.875 119.425 2.450 25757 10759 1 13 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.610 -0.145 25757 10760 1 13 . 1 1 121 121 VAL C C 121 177.477 177.477 178.452 -0.975 25757 10761 1 13 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.624 0.547 25757 10762 1 13 . 1 1 121 121 VAL CB C 121 31.434 31.434 30.904 0.530 25757 10763 1 13 . 1 1 121 121 VAL H H 121 8.104 8.104 7.845 0.259 25757 10764 1 13 . 1 1 122 122 ASP N N 122 120.566 120.566 118.860 1.706 25757 10765 1 13 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.338 -0.003 25757 10766 1 13 . 1 1 122 122 ASP C C 122 179.298 179.298 178.542 0.756 25757 10767 1 13 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.160 0.679 25757 10768 1 13 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.790 -0.478 25757 10769 1 13 . 1 1 122 122 ASP H H 122 8.089 8.089 8.230 -0.141 25757 10770 1 13 . 1 1 123 123 GLU N N 123 119.821 119.821 120.362 -0.541 25757 10771 1 13 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.075 -0.026 25757 10772 1 13 . 1 1 123 123 GLU C C 123 178.749 178.749 178.994 -0.245 25757 10773 1 13 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.426 -0.108 25757 10774 1 13 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.530 -0.144 25757 10775 1 13 . 1 1 123 123 GLU H H 123 8.105 8.105 7.994 0.111 25757 10776 1 13 . 1 1 124 124 MET N N 124 119.288 119.288 118.460 0.828 25757 10777 1 13 . 1 1 124 124 MET C C 124 180.865 180.865 178.986 1.879 25757 10778 1 13 . 1 1 124 124 MET CA C 124 60.684 60.684 59.168 1.516 25757 10779 1 13 . 1 1 124 124 MET CB C 124 33.141 33.141 31.990 1.151 25757 10780 1 13 . 1 1 124 124 MET H H 124 7.726 7.726 8.117 -0.391 25757 10781 1 13 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.010 -0.281 25757 10782 1 13 . 1 1 125 125 ILE C C 125 177.341 177.341 177.975 -0.634 25757 10783 1 13 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.755 0.046 25757 10784 1 13 . 1 1 125 125 ILE CB C 125 35.565 35.565 37.101 -1.536 25757 10785 1 13 . 1 1 126 126 ARG N N 126 118.555 118.555 119.437 -0.882 25757 10786 1 13 . 1 1 126 126 ARG C C 126 179.164 179.164 177.938 1.226 25757 10787 1 13 . 1 1 126 126 ARG CA C 126 59.924 59.924 58.939 0.985 25757 10788 1 13 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.108 -0.243 25757 10789 1 13 . 1 1 126 126 ARG H H 126 8.380 8.380 8.016 0.364 25757 10790 1 13 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.326 -0.401 25757 10791 1 13 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.815 1.242 25757 10792 1 13 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.172 0.655 25757 10793 1 13 . 1 1 128 128 ALA N N 128 116.764 116.764 119.338 -2.574 25757 10794 1 13 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.216 0.201 25757 10795 1 13 . 1 1 128 128 ALA C C 128 177.885 177.885 176.728 1.157 25757 10796 1 13 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.271 -0.316 25757 10797 1 13 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.458 3.109 25757 10798 1 13 . 1 1 128 128 ALA H H 128 7.152 7.152 7.792 -0.640 25757 10799 1 13 . 1 1 129 129 ASP N N 129 117.762 117.762 116.892 0.870 25757 10800 1 13 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.146 -0.669 25757 10801 1 13 . 1 1 129 129 ASP C C 129 175.935 175.935 176.235 -0.300 25757 10802 1 13 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.392 2.123 25757 10803 1 13 . 1 1 129 129 ASP CB C 129 40.745 40.745 43.599 -2.854 25757 10804 1 13 . 1 1 129 129 ASP H H 129 8.007 8.007 7.651 0.356 25757 10805 1 13 . 1 1 130 130 ILE N N 130 128.249 128.249 123.384 4.865 25757 10806 1 13 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.030 -0.166 25757 10807 1 13 . 1 1 130 130 ILE C C 130 177.764 177.764 177.380 0.384 25757 10808 1 13 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.076 1.472 25757 10809 1 13 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.830 0.818 25757 10810 1 13 . 1 1 130 130 ILE H H 130 8.412 8.412 8.177 0.235 25757 10811 1 13 . 1 1 131 131 ASP N N 131 116.430 116.430 117.319 -0.889 25757 10812 1 13 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.698 -0.164 25757 10813 1 13 . 1 1 131 131 ASP C C 131 178.313 178.313 176.748 1.565 25757 10814 1 13 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.358 -0.474 25757 10815 1 13 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.857 -0.895 25757 10816 1 13 . 1 1 131 131 ASP H H 131 8.254 8.254 8.021 0.233 25757 10817 1 13 . 1 1 132 132 GLY N N 132 108.460 108.460 108.894 -0.434 25757 10818 1 13 . 1 1 132 132 GLY C C 132 175.211 175.211 175.014 0.197 25757 10819 1 13 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.001 1.602 25757 10820 1 13 . 1 1 132 132 GLY H H 132 7.547 7.547 7.999 -0.452 25757 10821 1 13 . 1 1 133 133 ASP N N 133 120.909 120.909 119.931 0.978 25757 10822 1 13 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.557 -0.094 25757 10823 1 13 . 1 1 133 133 ASP C C 133 177.691 177.691 177.726 -0.035 25757 10824 1 13 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.971 0.842 25757 10825 1 13 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.744 -0.446 25757 10826 1 13 . 1 1 133 133 ASP H H 133 8.339 8.339 7.994 0.345 25757 10827 1 13 . 1 1 134 134 GLY N N 134 112.704 112.704 107.875 4.829 25757 10828 1 13 . 1 1 134 134 GLY C C 134 172.722 172.722 173.639 -0.917 25757 10829 1 13 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.266 0.771 25757 10830 1 13 . 1 1 134 134 GLY H H 134 10.396 10.396 8.011 2.385 25757 10831 1 13 . 1 1 135 135 GLN N N 135 114.799 114.799 118.801 -4.002 25757 10832 1 13 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.037 -0.173 25757 10833 1 13 . 1 1 135 135 GLN C C 135 174.760 174.760 175.239 -0.479 25757 10834 1 13 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.127 -0.806 25757 10835 1 13 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.210 -0.145 25757 10836 1 13 . 1 1 135 135 GLN H H 135 7.975 7.975 8.228 -0.253 25757 10837 1 13 . 1 1 136 136 VAL N N 136 125.364 125.364 125.934 -0.570 25757 10838 1 13 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.705 0.503 25757 10839 1 13 . 1 1 136 136 VAL C C 136 175.831 175.831 175.660 0.171 25757 10840 1 13 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.231 0.586 25757 10841 1 13 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.041 0.632 25757 10842 1 13 . 1 1 136 136 VAL H H 136 9.169 9.169 9.134 0.035 25757 10843 1 13 . 1 1 137 137 ASN N N 137 129.155 129.155 125.789 3.366 25757 10844 1 13 . 1 1 137 137 ASN C C 137 174.737 174.737 175.691 -0.954 25757 10845 1 13 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.489 -0.138 25757 10846 1 13 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.626 -3.303 25757 10847 1 13 . 1 1 137 137 ASN H H 137 9.652 9.652 8.604 1.048 25757 10848 1 13 . 1 1 138 138 TYR N N 138 118.504 118.504 122.738 -4.234 25757 10849 1 13 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.435 -0.156 25757 10850 1 13 . 1 1 138 138 TYR C C 138 176.174 176.174 177.432 -1.258 25757 10851 1 13 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.407 0.167 25757 10852 1 13 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.135 -0.405 25757 10853 1 13 . 1 1 138 138 TYR H H 138 8.460 8.460 8.696 -0.236 25757 10854 1 13 . 1 1 139 139 GLU N N 139 118.644 118.644 118.136 0.508 25757 10855 1 13 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.919 -0.371 25757 10856 1 13 . 1 1 139 139 GLU C C 139 180.265 180.265 178.685 1.580 25757 10857 1 13 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.320 0.166 25757 10858 1 13 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.865 0.126 25757 10859 1 13 . 1 1 139 139 GLU H H 139 8.136 8.136 8.122 0.014 25757 10860 1 13 . 1 1 140 140 GLU N N 140 120.030 120.030 117.369 2.661 25757 10861 1 13 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.013 -0.125 25757 10862 1 13 . 1 1 140 140 GLU C C 140 179.627 179.627 178.267 1.360 25757 10863 1 13 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.650 0.027 25757 10864 1 13 . 1 1 140 140 GLU CB C 140 29.727 29.727 28.941 0.786 25757 10865 1 13 . 1 1 140 140 GLU H H 140 8.798 8.798 8.544 0.254 25757 10866 1 13 . 1 1 141 141 PHE N N 141 123.154 123.154 122.249 0.905 25757 10867 1 13 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.864 -0.167 25757 10868 1 13 . 1 1 141 141 PHE C C 141 176.952 176.952 177.006 -0.054 25757 10869 1 13 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.164 0.888 25757 10870 1 13 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.263 0.868 25757 10871 1 13 . 1 1 141 141 PHE H H 141 8.633 8.633 8.022 0.611 25757 10872 1 13 . 1 1 142 142 VAL N N 142 120.046 120.046 114.688 5.358 25757 10873 1 13 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.469 -0.513 25757 10874 1 13 . 1 1 142 142 VAL C C 142 179.627 179.627 177.830 1.797 25757 10875 1 13 . 1 1 142 142 VAL CA C 142 67.243 67.243 64.936 2.307 25757 10876 1 13 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.710 0.430 25757 10877 1 13 . 1 1 142 142 VAL H H 142 8.894 8.894 7.825 1.069 25757 10878 1 13 . 1 1 143 143 GLN N N 143 118.996 118.996 118.743 0.253 25757 10879 1 13 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.047 -0.271 25757 10880 1 13 . 1 1 143 143 GLN C C 143 178.443 178.443 178.354 0.089 25757 10881 1 13 . 1 1 143 143 GLN CA C 143 59.129 59.129 57.990 1.139 25757 10882 1 13 . 1 1 143 143 GLN CB C 143 27.743 27.743 27.986 -0.243 25757 10883 1 13 . 1 1 143 143 GLN H H 143 7.627 7.627 7.374 0.253 25757 10884 1 13 . 1 1 144 144 MET N N 144 116.361 116.361 118.230 -1.869 25757 10885 1 13 . 1 1 144 144 MET HA H 144 4.169 4.169 4.129 0.040 25757 10886 1 13 . 1 1 144 144 MET C C 144 178.418 178.418 176.207 2.211 25757 10887 1 13 . 1 1 144 144 MET CA C 144 56.137 56.137 57.677 -1.540 25757 10888 1 13 . 1 1 144 144 MET CB C 144 31.095 31.095 31.793 -0.698 25757 10889 1 13 . 1 1 144 144 MET H H 144 7.179 7.179 7.277 -0.098 25757 10890 1 13 . 1 1 145 145 MET N N 145 115.373 115.373 114.733 0.640 25757 10891 1 13 . 1 1 145 145 MET HA H 145 4.334 4.334 4.448 -0.114 25757 10892 1 13 . 1 1 145 145 MET C C 145 177.217 177.217 176.373 0.844 25757 10893 1 13 . 1 1 145 145 MET CA C 145 55.296 55.296 55.743 -0.447 25757 10894 1 13 . 1 1 145 145 MET CB C 145 34.458 34.458 33.410 1.048 25757 10895 1 13 . 1 1 145 145 MET H H 145 7.776 7.776 7.147 0.629 25757 10896 1 13 . 1 1 146 146 THR N N 146 107.988 107.988 111.950 -3.962 25757 10897 1 13 . 1 1 146 146 THR HA H 146 4.239 4.239 4.371 -0.132 25757 10898 1 13 . 1 1 146 146 THR C C 146 175.378 175.378 174.726 0.652 25757 10899 1 13 . 1 1 146 146 THR CA C 146 61.625 61.625 61.460 0.165 25757 10900 1 13 . 1 1 146 146 THR CB C 146 70.817 70.817 67.697 3.120 25757 10901 1 13 . 1 1 146 146 THR H H 146 7.736 7.736 7.476 0.260 25757 10902 1 13 . 1 1 147 147 GLY N N 147 110.157 110.157 110.688 -0.531 25757 10903 1 13 . 1 1 147 147 GLY C C 147 174.046 174.046 174.021 0.025 25757 10904 1 13 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.795 0.749 25757 10905 1 13 . 1 1 147 147 GLY H H 147 7.793 7.793 7.553 0.240 25757 10906 1 13 . 1 1 150 150 THR HA H 150 4.239 4.239 4.439 -0.200 25757 10907 1 13 . 1 1 150 150 THR C C 150 174.397 174.397 174.406 -0.009 25757 10908 1 13 . 1 1 150 150 THR CA C 150 61.260 61.260 61.683 -0.423 25757 10909 1 13 . 1 1 150 150 THR CB C 150 70.358 70.358 69.362 0.996 25757 10910 1 13 . 1 1 151 151 ALA N N 151 126.304 126.304 123.480 2.824 25757 10911 1 13 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.370 -0.082 25757 10912 1 13 . 1 1 151 151 ALA C C 151 177.678 177.678 177.416 0.262 25757 10913 1 13 . 1 1 151 151 ALA CA C 151 52.148 52.148 52.025 0.123 25757 10914 1 13 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.672 -0.253 25757 10915 1 13 . 1 1 151 151 ALA H H 151 8.618 8.618 7.407 1.211 25757 10916 1 13 . 1 1 152 152 ALA N N 152 123.861 123.861 121.937 1.924 25757 10917 1 13 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.411 -0.293 25757 10918 1 13 . 1 1 152 152 ALA C C 152 178.823 178.823 178.477 0.346 25757 10919 1 13 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.495 1.999 25757 10920 1 13 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.246 0.511 25757 10921 1 13 . 1 1 152 152 ALA H H 152 8.354 8.354 8.642 -0.288 25757 10922 1 13 . 1 1 153 153 GLY N N 153 109.984 109.984 107.492 2.492 25757 10923 1 13 . 1 1 153 153 GLY C C 153 174.389 174.389 175.586 -1.197 25757 10924 1 13 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.160 -2.029 25757 10925 1 13 . 1 1 153 153 GLY H H 153 9.028 9.028 8.375 0.653 25757 10926 1 13 . 1 1 154 154 SER N N 154 113.934 113.934 118.280 -4.346 25757 10927 1 13 . 1 1 154 154 SER HA H 154 4.255 4.255 4.010 0.245 25757 10928 1 13 . 1 1 154 154 SER C C 154 177.929 177.929 176.522 1.407 25757 10929 1 13 . 1 1 154 154 SER CA C 154 59.379 59.379 61.231 -1.852 25757 10930 1 13 . 1 1 154 154 SER CB C 154 64.090 64.090 62.333 1.757 25757 10931 1 13 . 1 1 154 154 SER H H 154 7.962 7.962 8.126 -0.164 25757 10932 1 13 . 1 1 155 155 GLY N N 155 115.337 115.337 109.907 5.430 25757 10933 1 13 . 1 1 155 155 GLY C C 155 175.891 175.891 175.611 0.280 25757 10934 1 13 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.659 0.987 25757 10935 1 13 . 1 1 155 155 GLY H H 155 9.451 9.451 7.812 1.639 25757 10936 1 13 . 1 1 156 156 TRP N N 156 119.600 119.600 121.660 -2.060 25757 10937 1 13 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.276 -0.005 25757 10938 1 13 . 1 1 156 156 TRP C C 156 178.947 178.947 179.017 -0.070 25757 10939 1 13 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.476 -0.312 25757 10940 1 13 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.088 0.515 25757 10941 1 13 . 1 1 156 156 TRP H H 156 8.542 8.542 7.358 1.184 25757 10942 1 13 . 1 1 157 157 ARG N N 157 118.583 118.583 119.281 -0.698 25757 10943 1 13 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.059 -0.077 25757 10944 1 13 . 1 1 157 157 ARG C C 157 177.894 177.894 178.629 -0.735 25757 10945 1 13 . 1 1 157 157 ARG CA C 157 59.338 59.338 58.447 0.891 25757 10946 1 13 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.466 0.591 25757 10947 1 13 . 1 1 157 157 ARG H H 157 7.747 7.747 8.530 -0.783 25757 10948 1 13 . 1 1 158 158 LYS N N 158 117.033 117.033 120.354 -3.321 25757 10949 1 13 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.988 -0.045 25757 10950 1 13 . 1 1 158 158 LYS C C 158 176.973 176.973 179.041 -2.068 25757 10951 1 13 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.342 0.032 25757 10952 1 13 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.237 0.054 25757 10953 1 13 . 1 1 158 158 LYS H H 158 7.529 7.529 8.068 -0.539 25757 10954 1 13 . 1 1 159 159 ILE N N 159 116.553 116.553 120.104 -3.551 25757 10955 1 13 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.752 -0.208 25757 10956 1 13 . 1 1 159 159 ILE C C 159 176.894 176.894 177.150 -0.256 25757 10957 1 13 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.014 0.502 25757 10958 1 13 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.014 -0.210 25757 10959 1 13 . 1 1 159 159 ILE H H 159 7.348 7.348 8.230 -0.882 25757 10960 1 13 . 1 1 160 160 LYS N N 160 119.278 119.278 120.531 -1.253 25757 10961 1 13 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.262 -0.223 25757 10962 1 13 . 1 1 160 160 LYS C C 160 178.566 178.566 179.040 -0.474 25757 10963 1 13 . 1 1 160 160 LYS CA C 160 60.374 60.374 60.083 0.291 25757 10964 1 13 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.416 0.402 25757 10965 1 13 . 1 1 160 160 LYS H H 160 8.225 8.225 8.055 0.170 25757 10966 1 13 . 1 1 161 161 LEU N N 161 117.056 117.056 120.300 -3.244 25757 10967 1 13 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.127 -0.067 25757 10968 1 13 . 1 1 161 161 LEU C C 161 178.977 178.977 178.536 0.441 25757 10969 1 13 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.499 0.525 25757 10970 1 13 . 1 1 161 161 LEU CB C 161 41.982 41.982 40.934 1.048 25757 10971 1 13 . 1 1 161 161 LEU H H 161 8.057 8.057 8.508 -0.451 25757 10972 1 13 . 1 1 162 162 ALA N N 162 121.814 121.814 122.279 -0.465 25757 10973 1 13 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.153 -0.061 25757 10974 1 13 . 1 1 162 162 ALA C C 162 178.374 178.374 179.734 -1.360 25757 10975 1 13 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.453 0.337 25757 10976 1 13 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.692 -0.367 25757 10977 1 13 . 1 1 162 162 ALA H H 162 8.170 8.170 8.386 -0.216 25757 10978 1 13 . 1 1 163 163 VAL N N 163 115.449 115.449 115.655 -0.206 25757 10979 1 13 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.875 -0.257 25757 10980 1 13 . 1 1 163 163 VAL C C 163 178.362 178.362 177.775 0.587 25757 10981 1 13 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.000 1.272 25757 10982 1 13 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.650 1.387 25757 10983 1 13 . 1 1 163 163 VAL H H 163 8.499 8.499 8.126 0.373 25757 10984 1 13 . 1 1 164 164 ARG N N 164 115.775 115.775 120.851 -5.076 25757 10985 1 13 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.239 -0.042 25757 10986 1 13 . 1 1 164 164 ARG C C 164 178.938 178.938 179.388 -0.450 25757 10987 1 13 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.444 -1.761 25757 10988 1 13 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.381 -0.547 25757 10989 1 13 . 1 1 164 164 ARG H H 164 8.165 8.165 8.348 -0.183 25757 10990 1 13 . 1 1 165 165 GLY N N 165 105.570 105.570 106.691 -1.121 25757 10991 1 13 . 1 1 165 165 GLY C C 165 173.134 173.134 175.117 -1.983 25757 10992 1 13 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.401 0.341 25757 10993 1 13 . 1 1 165 165 GLY H H 165 8.455 8.455 8.515 -0.060 25757 10994 1 13 . 1 1 166 166 ALA N N 166 120.648 120.648 122.732 -2.084 25757 10995 1 13 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.155 0.187 25757 10996 1 13 . 1 1 166 166 ALA C C 166 176.155 176.155 177.105 -0.950 25757 10997 1 13 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.676 -1.903 25757 10998 1 13 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.070 0.408 25757 10999 1 13 . 1 1 166 166 ALA H H 166 7.826 7.826 7.846 -0.020 25757 11000 1 13 . 1 1 167 167 GLN N N 167 117.315 117.315 117.494 -0.179 25757 11001 1 13 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.418 -0.141 25757 11002 1 13 . 1 1 167 167 GLN C C 167 175.571 175.571 175.403 0.168 25757 11003 1 13 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.589 1.338 25757 11004 1 13 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.915 0.270 25757 11005 1 13 . 1 1 167 167 GLN H H 167 7.498 7.498 7.484 0.014 25757 11006 1 13 . 1 1 168 168 ALA N N 168 126.706 126.706 130.067 -3.361 25757 11007 1 13 . 1 1 168 168 ALA HA H 168 4.279 4.279 3.982 0.297 25757 11008 1 13 . 1 1 168 168 ALA C C 168 177.227 177.227 177.159 0.068 25757 11009 1 13 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.644 -2.578 25757 11010 1 13 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.170 0.536 25757 11011 1 13 . 1 1 168 168 ALA H H 168 8.534 8.534 8.623 -0.089 25757 11012 1 14 . 1 1 9 9 ILE N N 9 116.733 116.733 121.367 -4.634 25757 11013 1 14 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.140 -0.383 25757 11014 1 14 . 1 1 9 9 ILE C C 9 177.828 177.828 177.027 0.801 25757 11015 1 14 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.009 3.595 25757 11016 1 14 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.656 -0.058 25757 11017 1 14 . 1 1 9 9 ILE H H 9 7.366 7.366 8.097 -0.731 25757 11018 1 14 . 1 1 10 10 ALA N N 10 121.080 121.080 123.382 -2.302 25757 11019 1 14 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.002 0.073 25757 11020 1 14 . 1 1 10 10 ALA C C 10 180.921 180.921 179.541 1.380 25757 11021 1 14 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.316 0.287 25757 11022 1 14 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.889 0.095 25757 11023 1 14 . 1 1 10 10 ALA H H 10 8.039 8.039 8.207 -0.168 25757 11024 1 14 . 1 1 11 11 GLU N N 11 119.580 119.580 118.270 1.310 25757 11025 1 14 . 1 1 11 11 GLU HA H 11 4.089 4.089 4.200 -0.111 25757 11026 1 14 . 1 1 11 11 GLU C C 11 179.561 179.561 179.046 0.515 25757 11027 1 14 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.352 0.533 25757 11028 1 14 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.846 0.617 25757 11029 1 14 . 1 1 11 11 GLU H H 11 7.741 7.741 8.424 -0.683 25757 11030 1 14 . 1 1 12 12 PHE N N 12 118.509 118.509 117.347 1.162 25757 11031 1 14 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.499 0.327 25757 11032 1 14 . 1 1 12 12 PHE C C 12 179.000 179.000 178.506 0.494 25757 11033 1 14 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.768 0.396 25757 11034 1 14 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.828 0.282 25757 11035 1 14 . 1 1 12 12 PHE H H 12 8.470 8.470 6.900 1.570 25757 11036 1 14 . 1 1 13 13 LYS N N 13 123.523 123.523 120.532 2.991 25757 11037 1 14 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.078 -0.052 25757 11038 1 14 . 1 1 13 13 LYS C C 13 179.260 179.260 178.704 0.556 25757 11039 1 14 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.702 0.463 25757 11040 1 14 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.165 -0.332 25757 11041 1 14 . 1 1 13 13 LYS H H 13 9.171 9.171 8.315 0.856 25757 11042 1 14 . 1 1 14 14 GLU N N 14 120.415 120.415 118.622 1.793 25757 11043 1 14 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.087 0.008 25757 11044 1 14 . 1 1 14 14 GLU C C 14 179.851 179.851 178.938 0.913 25757 11045 1 14 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.394 0.192 25757 11046 1 14 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.284 0.277 25757 11047 1 14 . 1 1 14 14 GLU H H 14 7.822 7.822 8.305 -0.483 25757 11048 1 14 . 1 1 15 15 ALA N N 15 122.143 122.143 122.799 -0.656 25757 11049 1 14 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.189 -0.059 25757 11050 1 14 . 1 1 15 15 ALA C C 15 178.222 178.222 179.581 -1.359 25757 11051 1 14 . 1 1 15 15 ALA CA C 15 55.190 55.190 54.979 0.211 25757 11052 1 14 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.728 -0.226 25757 11053 1 14 . 1 1 15 15 ALA H H 15 8.244 8.244 8.236 0.008 25757 11054 1 14 . 1 1 16 16 PHE N N 16 119.809 119.809 118.333 1.476 25757 11055 1 14 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.317 -0.305 25757 11056 1 14 . 1 1 16 16 PHE C C 16 177.444 177.444 177.343 0.101 25757 11057 1 14 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.480 1.583 25757 11058 1 14 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.477 -0.045 25757 11059 1 14 . 1 1 16 16 PHE H H 16 8.891 8.891 8.370 0.521 25757 11060 1 14 . 1 1 17 17 SER N N 17 112.631 112.631 115.317 -2.686 25757 11061 1 14 . 1 1 17 17 SER HA H 17 4.034 4.034 4.161 -0.127 25757 11062 1 14 . 1 1 17 17 SER C C 17 174.675 174.675 176.208 -1.533 25757 11063 1 14 . 1 1 17 17 SER CA C 17 61.507 61.507 62.162 -0.655 25757 11064 1 14 . 1 1 17 17 SER CB C 17 63.414 63.414 63.427 -0.013 25757 11065 1 14 . 1 1 17 17 SER H H 17 7.910 7.910 8.315 -0.405 25757 11066 1 14 . 1 1 18 18 LEU N N 18 120.614 120.614 116.838 3.776 25757 11067 1 14 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.234 -0.222 25757 11068 1 14 . 1 1 18 18 LEU C C 18 177.366 177.366 177.983 -0.617 25757 11069 1 14 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.330 0.056 25757 11070 1 14 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.519 0.076 25757 11071 1 14 . 1 1 18 18 LEU H H 18 7.423 7.423 7.987 -0.564 25757 11072 1 14 . 1 1 19 19 PHE N N 19 114.602 114.602 119.831 -5.229 25757 11073 1 14 . 1 1 19 19 PHE C C 19 176.961 176.961 176.213 0.748 25757 11074 1 14 . 1 1 19 19 PHE CA C 19 59.484 59.484 59.675 -0.191 25757 11075 1 14 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.700 1.069 25757 11076 1 14 . 1 1 19 19 PHE H H 19 7.254 7.254 7.605 -0.351 25757 11077 1 14 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.605 -0.030 25757 11078 1 14 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.257 -1.609 25757 11079 1 14 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.792 -0.782 25757 11080 1 14 . 1 1 23 23 GLY N N 23 108.244 108.244 108.364 -0.120 25757 11081 1 14 . 1 1 23 23 GLY C C 23 175.188 175.188 174.920 0.268 25757 11082 1 14 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.181 1.222 25757 11083 1 14 . 1 1 23 23 GLY H H 23 7.555 7.555 8.287 -0.732 25757 11084 1 14 . 1 1 24 24 ASP N N 24 120.667 120.667 119.838 0.829 25757 11085 1 14 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.587 -0.118 25757 11086 1 14 . 1 1 24 24 ASP C C 24 177.457 177.457 177.817 -0.360 25757 11087 1 14 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.477 0.315 25757 11088 1 14 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.614 -1.097 25757 11089 1 14 . 1 1 24 24 ASP H H 24 8.397 8.397 8.385 0.012 25757 11090 1 14 . 1 1 25 25 GLY N N 25 112.989 112.989 108.525 4.464 25757 11091 1 14 . 1 1 25 25 GLY C C 25 173.639 173.639 173.180 0.459 25757 11092 1 14 . 1 1 25 25 GLY CA C 25 45.501 45.501 44.963 0.538 25757 11093 1 14 . 1 1 25 25 GLY H H 25 10.592 10.592 7.979 2.613 25757 11094 1 14 . 1 1 26 26 THR N N 26 112.948 112.948 112.788 0.160 25757 11095 1 14 . 1 1 26 26 THR HA H 26 5.282 5.282 4.927 0.355 25757 11096 1 14 . 1 1 26 26 THR C C 26 172.853 172.853 172.517 0.336 25757 11097 1 14 . 1 1 26 26 THR CA C 26 59.817 59.817 60.923 -1.106 25757 11098 1 14 . 1 1 26 26 THR CB C 26 72.465 72.465 71.198 1.267 25757 11099 1 14 . 1 1 26 26 THR H H 26 8.121 8.121 7.959 0.162 25757 11100 1 14 . 1 1 27 27 ILE N N 27 127.195 127.195 123.632 3.563 25757 11101 1 14 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.662 0.251 25757 11102 1 14 . 1 1 27 27 ILE C C 27 176.091 176.091 174.778 1.313 25757 11103 1 14 . 1 1 27 27 ILE CA C 27 60.765 60.765 59.819 0.946 25757 11104 1 14 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.285 -1.581 25757 11105 1 14 . 1 1 27 27 ILE H H 27 9.867 9.867 8.382 1.485 25757 11106 1 14 . 1 1 28 28 THR N N 28 116.655 116.655 120.193 -3.538 25757 11107 1 14 . 1 1 28 28 THR HA H 28 4.790 4.790 4.822 -0.032 25757 11108 1 14 . 1 1 28 28 THR C C 28 176.696 176.696 176.243 0.453 25757 11109 1 14 . 1 1 28 28 THR CA C 28 59.590 59.590 59.655 -0.065 25757 11110 1 14 . 1 1 28 28 THR CB C 28 72.457 72.457 70.623 1.834 25757 11111 1 14 . 1 1 28 28 THR H H 28 8.457 8.457 8.283 0.174 25757 11112 1 14 . 1 1 29 29 THR N N 29 111.878 111.878 117.075 -5.197 25757 11113 1 14 . 1 1 29 29 THR HA H 29 4.188 4.188 4.029 0.159 25757 11114 1 14 . 1 1 29 29 THR C C 29 177.399 177.399 176.328 1.071 25757 11115 1 14 . 1 1 29 29 THR CA C 29 66.386 66.386 65.982 0.404 25757 11116 1 14 . 1 1 29 29 THR CB C 29 67.726 67.726 68.231 -0.506 25757 11117 1 14 . 1 1 29 29 THR H H 29 9.211 9.211 8.937 0.274 25757 11118 1 14 . 1 1 30 30 LYS N N 30 121.140 121.140 120.375 0.765 25757 11119 1 14 . 1 1 30 30 LYS HA H 30 4.077 4.077 4.025 0.052 25757 11120 1 14 . 1 1 30 30 LYS C C 30 179.793 179.793 179.011 0.782 25757 11121 1 14 . 1 1 30 30 LYS CA C 30 59.292 59.292 58.922 0.370 25757 11122 1 14 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.416 1.031 25757 11123 1 14 . 1 1 30 30 LYS H H 30 7.580 7.580 7.639 -0.059 25757 11124 1 14 . 1 1 31 31 GLU N N 31 121.865 121.865 119.830 2.035 25757 11125 1 14 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.024 -0.030 25757 11126 1 14 . 1 1 31 31 GLU C C 31 179.355 179.355 179.061 0.294 25757 11127 1 14 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.896 -0.263 25757 11128 1 14 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.624 0.228 25757 11129 1 14 . 1 1 31 31 GLU H H 31 7.708 7.708 7.647 0.061 25757 11130 1 14 . 1 1 32 32 LEU N N 32 120.597 120.597 117.916 2.681 25757 11131 1 14 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.313 -0.197 25757 11132 1 14 . 1 1 32 32 LEU C C 32 178.885 178.885 179.099 -0.214 25757 11133 1 14 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.597 -0.236 25757 11134 1 14 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.966 2.070 25757 11135 1 14 . 1 1 32 32 LEU H H 32 8.688 8.688 7.788 0.900 25757 11136 1 14 . 1 1 33 33 GLY N N 33 104.837 104.837 107.838 -3.001 25757 11137 1 14 . 1 1 33 33 GLY C C 33 175.123 175.123 175.903 -0.780 25757 11138 1 14 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.550 0.698 25757 11139 1 14 . 1 1 33 33 GLY H H 33 8.694 8.694 8.504 0.190 25757 11140 1 14 . 1 1 34 34 THR N N 34 117.631 117.631 119.805 -2.174 25757 11141 1 14 . 1 1 34 34 THR HA H 34 3.899 3.899 3.896 0.003 25757 11142 1 14 . 1 1 34 34 THR C C 34 176.951 176.951 176.700 0.251 25757 11143 1 14 . 1 1 34 34 THR CA C 34 67.234 67.234 67.282 -0.048 25757 11144 1 14 . 1 1 34 34 THR CB C 34 68.863 68.863 68.749 0.115 25757 11145 1 14 . 1 1 34 34 THR H H 34 7.960 7.960 7.936 0.024 25757 11146 1 14 . 1 1 35 35 VAL N N 35 121.659 121.659 121.929 -0.270 25757 11147 1 14 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.573 -0.056 25757 11148 1 14 . 1 1 35 35 VAL C C 35 178.265 178.265 177.828 0.437 25757 11149 1 14 . 1 1 35 35 VAL CA C 35 66.675 66.675 67.002 -0.327 25757 11150 1 14 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.334 -0.041 25757 11151 1 14 . 1 1 35 35 VAL H H 35 7.358 7.358 8.276 -0.918 25757 11152 1 14 . 1 1 36 36 MET N N 36 117.456 117.456 115.315 2.141 25757 11153 1 14 . 1 1 36 36 MET C C 36 179.088 179.088 177.641 1.447 25757 11154 1 14 . 1 1 36 36 MET CA C 36 60.477 60.477 58.409 2.068 25757 11155 1 14 . 1 1 36 36 MET CB C 36 32.443 32.443 32.463 -0.020 25757 11156 1 14 . 1 1 36 36 MET H H 36 8.194 8.194 8.120 0.074 25757 11157 1 14 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.859 0.288 25757 11158 1 14 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.499 -0.149 25757 11159 1 14 . 1 1 38 38 SER HA H 38 4.085 4.085 4.386 -0.301 25757 11160 1 14 . 1 1 38 38 SER C C 38 173.788 173.788 174.434 -0.646 25757 11161 1 14 . 1 1 38 38 SER CA C 38 61.617 61.617 59.704 1.913 25757 11162 1 14 . 1 1 38 38 SER CB C 38 62.943 62.943 63.233 -0.290 25757 11163 1 14 . 1 1 39 39 LEU N N 39 119.003 119.003 120.290 -1.287 25757 11164 1 14 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.375 0.119 25757 11165 1 14 . 1 1 39 39 LEU C C 39 176.470 176.470 177.046 -0.576 25757 11166 1 14 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.452 0.228 25757 11167 1 14 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.222 1.292 25757 11168 1 14 . 1 1 39 39 LEU H H 39 7.230 7.230 7.071 0.159 25757 11169 1 14 . 1 1 40 40 GLY N N 40 105.026 105.026 106.097 -1.071 25757 11170 1 14 . 1 1 40 40 GLY C C 40 174.322 174.322 174.118 0.204 25757 11171 1 14 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.185 1.030 25757 11172 1 14 . 1 1 40 40 GLY H H 40 7.698 7.698 7.752 -0.054 25757 11173 1 14 . 1 1 41 41 GLN N N 41 117.929 117.929 118.500 -0.571 25757 11174 1 14 . 1 1 41 41 GLN C C 41 174.557 174.557 174.420 0.137 25757 11175 1 14 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.311 -0.466 25757 11176 1 14 . 1 1 41 41 GLN H H 41 7.866 7.866 7.483 0.383 25757 11177 1 14 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.505 0.231 25757 11178 1 14 . 1 1 43 43 PRO C C 43 177.805 177.805 176.507 1.298 25757 11179 1 14 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.681 -0.176 25757 11180 1 14 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.596 -0.435 25757 11181 1 14 . 1 1 44 44 THR N N 44 113.167 113.167 116.534 -3.367 25757 11182 1 14 . 1 1 44 44 THR HA H 44 4.684 4.684 4.580 0.104 25757 11183 1 14 . 1 1 44 44 THR C C 44 175.139 175.139 175.665 -0.526 25757 11184 1 14 . 1 1 44 44 THR CA C 44 60.556 60.556 59.076 1.480 25757 11185 1 14 . 1 1 44 44 THR CB C 44 71.064 71.064 70.997 0.067 25757 11186 1 14 . 1 1 44 44 THR H H 44 8.798 8.798 7.884 0.914 25757 11187 1 14 . 1 1 45 45 GLU N N 45 120.673 120.673 121.412 -0.739 25757 11188 1 14 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.972 0.019 25757 11189 1 14 . 1 1 45 45 GLU C C 45 178.940 178.940 177.999 0.941 25757 11190 1 14 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.767 0.134 25757 11191 1 14 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.245 -0.216 25757 11192 1 14 . 1 1 45 45 GLU H H 45 8.812 8.812 9.000 -0.188 25757 11193 1 14 . 1 1 46 46 ALA N N 46 120.576 120.576 122.190 -1.614 25757 11194 1 14 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.034 -0.067 25757 11195 1 14 . 1 1 46 46 ALA C C 46 180.290 180.290 180.042 0.248 25757 11196 1 14 . 1 1 46 46 ALA CA C 46 54.919 54.919 54.968 -0.049 25757 11197 1 14 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.038 0.123 25757 11198 1 14 . 1 1 46 46 ALA H H 46 8.276 8.276 8.447 -0.171 25757 11199 1 14 . 1 1 47 47 GLU N N 47 116.104 116.104 119.596 -3.492 25757 11200 1 14 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.043 -0.043 25757 11201 1 14 . 1 1 47 47 GLU C C 47 180.224 180.224 178.772 1.452 25757 11202 1 14 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.246 -0.315 25757 11203 1 14 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.212 0.777 25757 11204 1 14 . 1 1 47 47 GLU H H 47 7.425 7.425 7.537 -0.112 25757 11205 1 14 . 1 1 48 48 LEU N N 48 120.425 120.425 119.639 0.786 25757 11206 1 14 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.887 0.163 25757 11207 1 14 . 1 1 48 48 LEU C C 48 178.551 178.551 179.434 -0.883 25757 11208 1 14 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.132 -0.293 25757 11209 1 14 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.334 1.234 25757 11210 1 14 . 1 1 48 48 LEU H H 48 8.121 8.121 7.939 0.182 25757 11211 1 14 . 1 1 49 49 GLN N N 49 118.372 118.372 117.228 1.144 25757 11212 1 14 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.903 -0.141 25757 11213 1 14 . 1 1 49 49 GLN C C 49 178.567 178.567 178.648 -0.081 25757 11214 1 14 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.867 -0.004 25757 11215 1 14 . 1 1 49 49 GLN CB C 49 28.242 28.242 27.896 0.346 25757 11216 1 14 . 1 1 49 49 GLN H H 49 8.302 8.302 8.261 0.041 25757 11217 1 14 . 1 1 50 50 ASP N N 50 119.992 119.992 120.970 -0.978 25757 11218 1 14 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.364 -0.004 25757 11219 1 14 . 1 1 50 50 ASP C C 50 178.600 178.600 178.595 0.005 25757 11220 1 14 . 1 1 50 50 ASP CA C 50 57.703 57.703 56.973 0.730 25757 11221 1 14 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.757 -0.290 25757 11222 1 14 . 1 1 50 50 ASP H H 50 8.150 8.150 8.254 -0.104 25757 11223 1 14 . 1 1 51 51 MET N N 51 119.238 119.238 118.738 0.500 25757 11224 1 14 . 1 1 51 51 MET HA H 51 3.981 3.981 4.047 -0.066 25757 11225 1 14 . 1 1 51 51 MET C C 51 179.006 179.006 179.055 -0.049 25757 11226 1 14 . 1 1 51 51 MET CA C 51 59.443 59.443 58.346 1.097 25757 11227 1 14 . 1 1 51 51 MET CB C 51 33.380 33.380 31.866 1.514 25757 11228 1 14 . 1 1 51 51 MET H H 51 7.844 7.844 8.036 -0.192 25757 11229 1 14 . 1 1 52 52 ILE N N 52 118.161 118.161 118.879 -0.718 25757 11230 1 14 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.666 -0.188 25757 11231 1 14 . 1 1 52 52 ILE C C 52 177.847 177.847 179.048 -1.201 25757 11232 1 14 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.054 0.941 25757 11233 1 14 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.558 0.565 25757 11234 1 14 . 1 1 52 52 ILE H H 52 7.686 7.686 8.358 -0.672 25757 11235 1 14 . 1 1 53 53 ASN N N 53 117.884 117.884 117.884 0.000 25757 11236 1 14 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.457 -0.092 25757 11237 1 14 . 1 1 53 53 ASN C C 53 177.515 177.515 177.545 -0.030 25757 11238 1 14 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.787 0.420 25757 11239 1 14 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.680 -0.602 25757 11240 1 14 . 1 1 53 53 ASN H H 53 8.713 8.713 8.512 0.201 25757 11241 1 14 . 1 1 54 54 GLU N N 54 116.178 116.178 117.925 -1.747 25757 11242 1 14 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.301 -0.312 25757 11243 1 14 . 1 1 54 54 GLU C C 54 177.557 177.557 176.862 0.695 25757 11244 1 14 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.575 1.415 25757 11245 1 14 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.409 0.054 25757 11246 1 14 . 1 1 54 54 GLU H H 54 7.530 7.530 7.991 -0.461 25757 11247 1 14 . 1 1 55 55 VAL N N 55 107.164 107.164 110.189 -3.025 25757 11248 1 14 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.407 0.115 25757 11249 1 14 . 1 1 55 55 VAL C C 55 175.602 175.602 174.117 1.485 25757 11250 1 14 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.429 -0.077 25757 11251 1 14 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.035 0.568 25757 11252 1 14 . 1 1 55 55 VAL H H 55 7.175 7.175 7.399 -0.224 25757 11253 1 14 . 1 1 56 56 ASP N N 56 122.126 122.126 120.202 1.924 25757 11254 1 14 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.922 -0.323 25757 11255 1 14 . 1 1 56 56 ASP C C 56 176.182 176.182 175.540 0.642 25757 11256 1 14 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.293 0.513 25757 11257 1 14 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.786 -2.517 25757 11258 1 14 . 1 1 56 56 ASP H H 56 7.569 7.569 7.514 0.055 25757 11259 1 14 . 1 1 57 57 ALA N N 57 103.782 103.782 128.566 -24.784 25757 11260 1 14 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.353 -0.173 25757 11261 1 14 . 1 1 57 57 ALA C C 57 178.584 178.584 178.010 0.574 25757 11262 1 14 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.174 1.170 25757 11263 1 14 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.557 -0.033 25757 11264 1 14 . 1 1 57 57 ALA H H 57 8.515 8.515 8.701 -0.186 25757 11265 1 14 . 1 1 58 58 ASP N N 58 113.602 113.602 120.011 -6.409 25757 11266 1 14 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.548 0.038 25757 11267 1 14 . 1 1 58 58 ASP C C 58 177.756 177.756 177.237 0.519 25757 11268 1 14 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.832 -2.070 25757 11269 1 14 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.120 -1.442 25757 11270 1 14 . 1 1 58 58 ASP H H 58 8.130 8.130 8.015 0.115 25757 11271 1 14 . 1 1 59 59 GLY N N 59 109.195 109.195 107.738 1.457 25757 11272 1 14 . 1 1 59 59 GLY C C 59 175.139 175.139 174.511 0.628 25757 11273 1 14 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.113 2.151 25757 11274 1 14 . 1 1 59 59 GLY H H 59 7.694 7.694 8.678 -0.984 25757 11275 1 14 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.801 -0.196 25757 11276 1 14 . 1 1 61 61 GLY N N 61 113.316 113.316 109.772 3.544 25757 11277 1 14 . 1 1 61 61 GLY C C 61 173.234 173.234 173.145 0.089 25757 11278 1 14 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.350 -0.652 25757 11279 1 14 . 1 1 61 61 GLY H H 61 10.633 10.633 8.658 1.975 25757 11280 1 14 . 1 1 62 62 THR N N 62 108.892 108.892 109.767 -0.875 25757 11281 1 14 . 1 1 62 62 THR HA H 62 4.736 4.736 4.906 -0.170 25757 11282 1 14 . 1 1 62 62 THR C C 62 173.091 173.091 173.119 -0.028 25757 11283 1 14 . 1 1 62 62 THR CA C 62 59.617 59.617 59.533 0.084 25757 11284 1 14 . 1 1 62 62 THR CB C 62 72.004 72.004 72.233 -0.229 25757 11285 1 14 . 1 1 62 62 THR H H 62 7.673 7.673 7.816 -0.143 25757 11286 1 14 . 1 1 63 63 ILE N N 63 123.324 123.324 122.304 1.020 25757 11287 1 14 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.676 0.453 25757 11288 1 14 . 1 1 63 63 ILE C C 63 175.652 175.652 175.293 0.359 25757 11289 1 14 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.140 0.346 25757 11290 1 14 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.243 -1.286 25757 11291 1 14 . 1 1 63 63 ILE H H 63 8.907 8.907 8.435 0.472 25757 11292 1 14 . 1 1 64 64 ASP N N 64 128.253 128.253 127.221 1.032 25757 11293 1 14 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.933 0.388 25757 11294 1 14 . 1 1 64 64 ASP C C 64 176.431 176.431 177.638 -1.207 25757 11295 1 14 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.158 -0.827 25757 11296 1 14 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.120 -0.066 25757 11297 1 14 . 1 1 64 64 ASP H H 64 8.864 8.864 9.009 -0.145 25757 11298 1 14 . 1 1 65 65 PHE N N 65 118.583 118.583 120.263 -1.680 25757 11299 1 14 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.410 -0.550 25757 11300 1 14 . 1 1 65 65 PHE C C 65 173.458 173.458 175.187 -1.729 25757 11301 1 14 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.450 0.349 25757 11302 1 14 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.977 -1.097 25757 11303 1 14 . 1 1 65 65 PHE H H 65 8.962 8.962 9.037 -0.075 25757 11304 1 14 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.303 -0.185 25757 11305 1 14 . 1 1 66 66 PRO C C 66 180.038 180.038 178.580 1.458 25757 11306 1 14 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.492 1.198 25757 11307 1 14 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.288 -0.611 25757 11308 1 14 . 1 1 67 67 GLU N N 67 118.402 118.402 119.470 -1.068 25757 11309 1 14 . 1 1 67 67 GLU C C 67 178.737 178.737 178.786 -0.049 25757 11310 1 14 . 1 1 67 67 GLU CA C 67 59.008 59.008 60.078 -1.070 25757 11311 1 14 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.328 0.357 25757 11312 1 14 . 1 1 67 67 GLU H H 67 7.953 7.953 8.488 -0.535 25757 11313 1 14 . 1 1 68 68 PHE N N 68 123.421 123.421 120.003 3.418 25757 11314 1 14 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.158 -0.186 25757 11315 1 14 . 1 1 68 68 PHE C C 68 177.184 177.184 177.031 0.153 25757 11316 1 14 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.261 0.077 25757 11317 1 14 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.157 0.812 25757 11318 1 14 . 1 1 68 68 PHE H H 68 8.928 8.928 7.569 1.359 25757 11319 1 14 . 1 1 69 69 LEU N N 69 119.284 119.284 118.974 0.310 25757 11320 1 14 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.662 -0.327 25757 11321 1 14 . 1 1 69 69 LEU C C 69 178.987 178.987 178.907 0.080 25757 11322 1 14 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.020 -0.158 25757 11323 1 14 . 1 1 69 69 LEU CB C 69 40.832 40.832 40.460 0.372 25757 11324 1 14 . 1 1 69 69 LEU H H 69 8.374 8.374 7.710 0.664 25757 11325 1 14 . 1 1 70 70 THR N N 70 116.017 116.017 112.933 3.084 25757 11326 1 14 . 1 1 70 70 THR HA H 70 4.338 4.338 3.840 0.498 25757 11327 1 14 . 1 1 70 70 THR C C 70 176.169 176.169 176.726 -0.557 25757 11328 1 14 . 1 1 70 70 THR CA C 70 66.700 66.700 65.587 1.113 25757 11329 1 14 . 1 1 70 70 THR CB C 70 68.379 68.379 68.511 -0.132 25757 11330 1 14 . 1 1 70 70 THR H H 70 7.493 7.493 7.958 -0.465 25757 11331 1 14 . 1 1 71 71 MET N N 71 121.915 121.915 122.401 -0.486 25757 11332 1 14 . 1 1 71 71 MET HA H 71 3.718 3.718 3.871 -0.153 25757 11333 1 14 . 1 1 71 71 MET C C 71 178.190 178.190 177.879 0.311 25757 11334 1 14 . 1 1 71 71 MET CA C 71 59.335 59.335 59.268 0.067 25757 11335 1 14 . 1 1 71 71 MET CB C 71 33.894 33.894 32.373 1.520 25757 11336 1 14 . 1 1 71 71 MET H H 71 7.924 7.924 7.862 0.062 25757 11337 1 14 . 1 1 72 72 MET N N 72 116.973 116.973 117.484 -0.511 25757 11338 1 14 . 1 1 72 72 MET HA H 72 3.968 3.968 3.942 0.026 25757 11339 1 14 . 1 1 72 72 MET C C 72 178.211 178.211 178.374 -0.163 25757 11340 1 14 . 1 1 72 72 MET CA C 72 56.059 56.059 58.645 -2.586 25757 11341 1 14 . 1 1 72 72 MET CB C 72 31.639 31.639 32.587 -0.948 25757 11342 1 14 . 1 1 72 72 MET H H 72 8.276 8.276 7.685 0.591 25757 11343 1 14 . 1 1 73 73 ALA N N 73 122.499 122.499 121.724 0.775 25757 11344 1 14 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.833 0.117 25757 11345 1 14 . 1 1 73 73 ALA C C 73 180.231 180.231 179.008 1.223 25757 11346 1 14 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.892 0.061 25757 11347 1 14 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.641 0.391 25757 11348 1 14 . 1 1 73 73 ALA H H 73 8.240 8.240 8.073 0.167 25757 11349 1 14 . 1 1 74 74 ARG N N 74 116.098 116.098 117.853 -1.755 25757 11350 1 14 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.982 0.010 25757 11351 1 14 . 1 1 74 74 ARG C C 74 178.567 178.567 177.891 0.676 25757 11352 1 14 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.926 -0.101 25757 11353 1 14 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.247 -0.172 25757 11354 1 14 . 1 1 74 74 ARG H H 74 7.420 7.420 7.922 -0.502 25757 11355 1 14 . 1 1 75 75 LYS N N 75 119.046 119.046 117.605 1.441 25757 11356 1 14 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.283 -0.240 25757 11357 1 14 . 1 1 75 75 LYS C C 75 179.045 179.045 178.912 0.133 25757 11358 1 14 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.896 -0.007 25757 11359 1 14 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.606 -0.840 25757 11360 1 14 . 1 1 75 75 LYS H H 75 7.862 7.862 7.910 -0.048 25757 11361 1 14 . 1 1 76 76 MET N N 76 116.772 116.772 117.935 -1.163 25757 11362 1 14 . 1 1 76 76 MET H H 76 8.099 8.099 7.387 0.712 25757 11363 1 14 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.673 -0.039 25757 11364 1 14 . 1 1 78 78 ASP C C 78 176.395 176.395 176.145 0.250 25757 11365 1 14 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.479 0.165 25757 11366 1 14 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.824 -0.350 25757 11367 1 14 . 1 1 79 79 THR N N 79 113.904 113.904 113.384 0.520 25757 11368 1 14 . 1 1 79 79 THR HA H 79 4.215 4.215 4.349 -0.134 25757 11369 1 14 . 1 1 79 79 THR C C 79 174.204 174.204 174.126 0.078 25757 11370 1 14 . 1 1 79 79 THR CA C 79 62.264 62.264 61.870 0.394 25757 11371 1 14 . 1 1 79 79 THR CB C 79 69.884 69.884 69.074 0.810 25757 11372 1 14 . 1 1 79 79 THR H H 79 8.039 8.039 8.274 -0.235 25757 11373 1 14 . 1 1 80 80 ASP N N 80 123.572 123.572 123.128 0.444 25757 11374 1 14 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.899 -0.179 25757 11375 1 14 . 1 1 80 80 ASP C C 80 176.221 176.221 176.059 0.162 25757 11376 1 14 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.090 0.224 25757 11377 1 14 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.688 0.739 25757 11378 1 14 . 1 1 80 80 ASP H H 80 8.441 8.441 8.089 0.352 25757 11379 1 14 . 1 1 81 81 SER N N 81 117.879 117.879 120.403 -2.524 25757 11380 1 14 . 1 1 81 81 SER HA H 81 3.925 3.925 4.338 -0.413 25757 11381 1 14 . 1 1 81 81 SER C C 81 175.264 175.264 175.944 -0.680 25757 11382 1 14 . 1 1 81 81 SER CA C 81 58.860 58.860 60.215 -1.355 25757 11383 1 14 . 1 1 81 81 SER CB C 81 63.790 63.790 63.920 -0.130 25757 11384 1 14 . 1 1 81 81 SER H H 81 8.503 8.503 8.303 0.200 25757 11385 1 14 . 1 1 82 82 GLU N N 82 123.206 123.206 122.458 0.748 25757 11386 1 14 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.947 0.111 25757 11387 1 14 . 1 1 82 82 GLU C C 82 178.378 178.378 178.433 -0.055 25757 11388 1 14 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.291 0.295 25757 11389 1 14 . 1 1 82 82 GLU CB C 82 29.603 29.603 28.428 1.175 25757 11390 1 14 . 1 1 82 82 GLU H H 82 8.563 8.563 8.783 -0.220 25757 11391 1 14 . 1 1 83 83 GLU N N 83 119.262 119.262 120.040 -0.778 25757 11392 1 14 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.983 -0.026 25757 11393 1 14 . 1 1 83 83 GLU C C 83 178.606 178.606 178.674 -0.068 25757 11394 1 14 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.745 -0.076 25757 11395 1 14 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.118 0.237 25757 11396 1 14 . 1 1 83 83 GLU H H 83 7.728 7.728 8.084 -0.356 25757 11397 1 14 . 1 1 84 84 GLU N N 84 118.432 118.432 119.730 -1.298 25757 11398 1 14 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.097 0.010 25757 11399 1 14 . 1 1 84 84 GLU C C 84 179.436 179.436 179.007 0.429 25757 11400 1 14 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.847 0.656 25757 11401 1 14 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.180 -0.073 25757 11402 1 14 . 1 1 84 84 GLU H H 84 8.346 8.346 8.227 0.119 25757 11403 1 14 . 1 1 85 85 ILE N N 85 120.925 120.925 119.724 1.201 25757 11404 1 14 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.834 -0.086 25757 11405 1 14 . 1 1 85 85 ILE C C 85 177.661 177.661 178.428 -0.767 25757 11406 1 14 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.632 0.858 25757 11407 1 14 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.839 0.592 25757 11408 1 14 . 1 1 85 85 ILE H H 85 7.821 7.821 8.327 -0.506 25757 11409 1 14 . 1 1 86 86 ARG N N 86 121.916 121.916 118.848 3.068 25757 11410 1 14 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.892 0.244 25757 11411 1 14 . 1 1 86 86 ARG C C 86 179.208 179.208 178.669 0.539 25757 11412 1 14 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.708 0.663 25757 11413 1 14 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.831 0.267 25757 11414 1 14 . 1 1 86 86 ARG H H 86 8.432 8.432 8.263 0.169 25757 11415 1 14 . 1 1 87 87 GLU N N 87 118.261 118.261 119.289 -1.028 25757 11416 1 14 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.945 0.167 25757 11417 1 14 . 1 1 87 87 GLU C C 87 178.516 178.516 178.532 -0.016 25757 11418 1 14 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.359 -0.334 25757 11419 1 14 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.421 -0.251 25757 11420 1 14 . 1 1 87 87 GLU H H 87 8.225 8.225 8.147 0.078 25757 11421 1 14 . 1 1 88 88 ALA N N 88 121.009 121.009 122.486 -1.477 25757 11422 1 14 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.515 0.312 25757 11423 1 14 . 1 1 88 88 ALA C C 88 177.947 177.947 178.514 -0.567 25757 11424 1 14 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.990 -0.129 25757 11425 1 14 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.322 -0.367 25757 11426 1 14 . 1 1 88 88 ALA H H 88 7.789 7.789 7.947 -0.158 25757 11427 1 14 . 1 1 89 89 PHE N N 89 117.164 117.164 118.679 -1.515 25757 11428 1 14 . 1 1 89 89 PHE C C 89 176.134 176.134 177.405 -1.271 25757 11429 1 14 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.672 1.978 25757 11430 1 14 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.999 -0.106 25757 11431 1 14 . 1 1 89 89 PHE H H 89 8.337 8.337 7.698 0.639 25757 11432 1 14 . 1 1 90 90 ARG N N 90 114.900 114.900 117.724 -2.824 25757 11433 1 14 . 1 1 90 90 ARG HA H 90 3.914 3.914 4.027 -0.113 25757 11434 1 14 . 1 1 90 90 ARG C C 90 178.296 178.296 177.483 0.813 25757 11435 1 14 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.929 1.149 25757 11436 1 14 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.213 -0.120 25757 11437 1 14 . 1 1 90 90 ARG H H 90 7.681 7.681 7.843 -0.162 25757 11438 1 14 . 1 1 91 91 VAL N N 91 116.927 116.927 114.615 2.312 25757 11439 1 14 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.887 -0.280 25757 11440 1 14 . 1 1 91 91 VAL C C 91 177.964 177.964 177.135 0.829 25757 11441 1 14 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.568 0.392 25757 11442 1 14 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.740 -0.121 25757 11443 1 14 . 1 1 91 91 VAL H H 91 7.405 7.405 7.596 -0.191 25757 11444 1 14 . 1 1 92 92 PHE N N 92 119.026 119.026 118.050 0.976 25757 11445 1 14 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.334 0.028 25757 11446 1 14 . 1 1 92 92 PHE C C 92 177.639 177.639 176.395 1.244 25757 11447 1 14 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.255 -0.534 25757 11448 1 14 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.734 -0.308 25757 11449 1 14 . 1 1 92 92 PHE H H 92 7.886 7.886 7.572 0.314 25757 11450 1 14 . 1 1 93 93 ASP N N 93 118.238 118.238 118.788 -0.550 25757 11451 1 14 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.811 -0.349 25757 11452 1 14 . 1 1 93 93 ASP C C 93 176.979 176.979 176.764 0.215 25757 11453 1 14 . 1 1 93 93 ASP CA C 93 52.148 52.148 54.068 -1.920 25757 11454 1 14 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.111 -1.962 25757 11455 1 14 . 1 1 93 93 ASP H H 93 8.009 8.009 7.383 0.626 25757 11456 1 14 . 1 1 94 94 LYS N N 94 125.792 125.792 126.929 -1.137 25757 11457 1 14 . 1 1 94 94 LYS C C 94 178.213 178.213 177.725 0.488 25757 11458 1 14 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.843 0.475 25757 11459 1 14 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.766 -1.738 25757 11460 1 14 . 1 1 94 94 LYS H H 94 7.428 7.428 7.855 -0.427 25757 11461 1 14 . 1 1 95 95 ASP N N 95 113.833 113.833 115.062 -1.229 25757 11462 1 14 . 1 1 95 95 ASP C C 95 177.718 177.718 176.961 0.757 25757 11463 1 14 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.096 -1.151 25757 11464 1 14 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.592 -0.849 25757 11465 1 14 . 1 1 95 95 ASP H H 95 8.159 8.159 7.974 0.185 25757 11466 1 14 . 1 1 96 96 GLY N N 96 109.414 109.414 108.188 1.226 25757 11467 1 14 . 1 1 96 96 GLY C C 96 175.093 175.093 175.293 -0.200 25757 11468 1 14 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.719 1.535 25757 11469 1 14 . 1 1 96 96 GLY H H 96 7.848 7.848 7.635 0.213 25757 11470 1 14 . 1 1 97 97 ASN N N 97 119.590 119.590 118.149 1.441 25757 11471 1 14 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.533 0.079 25757 11472 1 14 . 1 1 97 97 ASN C C 97 175.937 175.937 176.053 -0.116 25757 11473 1 14 . 1 1 97 97 ASN CA C 97 52.888 52.888 54.066 -1.178 25757 11474 1 14 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.106 -0.786 25757 11475 1 14 . 1 1 97 97 ASN H H 97 8.338 8.338 8.851 -0.513 25757 11476 1 14 . 1 1 98 98 GLY N N 98 112.940 112.940 107.537 5.403 25757 11477 1 14 . 1 1 98 98 GLY C C 98 172.429 172.429 172.530 -0.101 25757 11478 1 14 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.986 0.106 25757 11479 1 14 . 1 1 98 98 GLY H H 98 10.695 10.695 8.741 1.954 25757 11480 1 14 . 1 1 99 99 TYR N N 99 115.544 115.544 117.788 -2.244 25757 11481 1 14 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.223 -0.136 25757 11482 1 14 . 1 1 99 99 TYR C C 99 174.859 174.859 174.636 0.223 25757 11483 1 14 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.021 -1.003 25757 11484 1 14 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.171 1.182 25757 11485 1 14 . 1 1 99 99 TYR H H 99 7.597 7.597 8.479 -0.882 25757 11486 1 14 . 1 1 100 100 ILE N N 100 127.078 127.078 124.089 2.989 25757 11487 1 14 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.724 0.065 25757 11488 1 14 . 1 1 100 100 ILE C C 100 175.387 175.387 175.855 -0.468 25757 11489 1 14 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.769 0.237 25757 11490 1 14 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.806 -1.016 25757 11491 1 14 . 1 1 100 100 ILE H H 100 10.267 10.267 8.889 1.377 25757 11492 1 14 . 1 1 101 101 SER N N 101 124.102 124.102 122.762 1.340 25757 11493 1 14 . 1 1 101 101 SER HA H 101 4.417 4.417 5.340 -0.923 25757 11494 1 14 . 1 1 101 101 SER C C 101 175.360 175.360 175.333 0.027 25757 11495 1 14 . 1 1 101 101 SER CA C 101 56.036 56.036 56.258 -0.222 25757 11496 1 14 . 1 1 101 101 SER CB C 101 66.896 66.896 65.215 1.681 25757 11497 1 14 . 1 1 101 101 SER H H 101 8.985 8.985 8.323 0.662 25757 11498 1 14 . 1 1 102 102 ALA N N 102 122.780 122.780 123.232 -0.452 25757 11499 1 14 . 1 1 102 102 ALA HA H 102 3.744 3.744 4.016 -0.272 25757 11500 1 14 . 1 1 102 102 ALA C C 102 179.175 179.175 178.478 0.697 25757 11501 1 14 . 1 1 102 102 ALA CA C 102 56.290 56.290 54.989 1.300 25757 11502 1 14 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.262 -0.235 25757 11503 1 14 . 1 1 102 102 ALA H H 102 9.269 9.269 9.075 0.194 25757 11504 1 14 . 1 1 103 103 ALA N N 103 118.513 118.513 121.401 -2.888 25757 11505 1 14 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.741 0.270 25757 11506 1 14 . 1 1 103 103 ALA C C 103 181.521 181.521 179.258 2.263 25757 11507 1 14 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.052 0.302 25757 11508 1 14 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.304 -0.013 25757 11509 1 14 . 1 1 103 103 ALA H H 103 8.321 8.321 8.295 0.026 25757 11510 1 14 . 1 1 104 104 GLU N N 104 119.550 119.550 118.719 0.831 25757 11511 1 14 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.098 -0.092 25757 11512 1 14 . 1 1 104 104 GLU C C 104 179.750 179.750 179.135 0.615 25757 11513 1 14 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.634 -0.465 25757 11514 1 14 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.304 -0.089 25757 11515 1 14 . 1 1 104 104 GLU H H 104 7.867 7.867 8.477 -0.610 25757 11516 1 14 . 1 1 105 105 LEU N N 105 122.688 122.688 120.280 2.408 25757 11517 1 14 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.895 0.023 25757 11518 1 14 . 1 1 105 105 LEU C C 105 178.233 178.233 178.054 0.179 25757 11519 1 14 . 1 1 105 105 LEU CA C 105 57.734 57.734 57.947 -0.212 25757 11520 1 14 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.762 0.258 25757 11521 1 14 . 1 1 105 105 LEU H H 105 8.746 8.746 7.755 0.991 25757 11522 1 14 . 1 1 106 106 ARG N N 106 118.835 118.835 118.029 0.806 25757 11523 1 14 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.777 -0.127 25757 11524 1 14 . 1 1 106 106 ARG C C 106 178.742 178.742 178.543 0.199 25757 11525 1 14 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.243 0.720 25757 11526 1 14 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.271 0.775 25757 11527 1 14 . 1 1 106 106 ARG H H 106 8.684 8.684 8.222 0.462 25757 11528 1 14 . 1 1 107 107 HIS N N 107 119.258 119.258 118.725 0.533 25757 11529 1 14 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.475 -0.208 25757 11530 1 14 . 1 1 107 107 HIS C C 107 177.244 177.244 178.121 -0.877 25757 11531 1 14 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.257 1.895 25757 11532 1 14 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.627 0.949 25757 11533 1 14 . 1 1 107 107 HIS H H 107 7.691 7.691 8.120 -0.429 25757 11534 1 14 . 1 1 108 108 VAL N N 108 118.996 118.996 121.478 -2.482 25757 11535 1 14 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.685 -0.247 25757 11536 1 14 . 1 1 108 108 VAL C C 108 177.998 177.998 178.208 -0.210 25757 11537 1 14 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.950 -0.519 25757 11538 1 14 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.876 -0.452 25757 11539 1 14 . 1 1 108 108 VAL H H 108 7.599 7.599 8.098 -0.499 25757 11540 1 14 . 1 1 109 109 MET N N 109 114.880 114.880 118.066 -3.186 25757 11541 1 14 . 1 1 109 109 MET C C 109 179.119 179.119 178.622 0.497 25757 11542 1 14 . 1 1 109 109 MET CA C 109 56.979 56.979 59.455 -2.476 25757 11543 1 14 . 1 1 109 109 MET CB C 109 29.253 29.253 32.832 -3.579 25757 11544 1 14 . 1 1 109 109 MET H H 109 7.911 7.911 8.202 -0.291 25757 11545 1 14 . 1 1 110 110 THR N N 110 116.943 116.943 116.170 0.773 25757 11546 1 14 . 1 1 110 110 THR HA H 110 4.229 4.229 4.071 0.158 25757 11547 1 14 . 1 1 110 110 THR C C 110 178.506 178.506 176.225 2.281 25757 11548 1 14 . 1 1 110 110 THR CA C 110 66.573 66.573 66.086 0.487 25757 11549 1 14 . 1 1 110 110 THR CB C 110 68.575 68.575 68.560 0.015 25757 11550 1 14 . 1 1 110 110 THR H H 110 8.353 8.353 8.049 0.304 25757 11551 1 14 . 1 1 111 111 ASN N N 111 123.829 123.829 119.744 4.085 25757 11552 1 14 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.425 -0.063 25757 11553 1 14 . 1 1 111 111 ASN C C 111 177.197 177.197 177.765 -0.568 25757 11554 1 14 . 1 1 111 111 ASN CA C 111 55.959 55.959 56.043 -0.084 25757 11555 1 14 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.465 -1.242 25757 11556 1 14 . 1 1 111 111 ASN H H 111 8.053 8.053 7.922 0.131 25757 11557 1 14 . 1 1 112 112 LEU N N 112 119.036 119.036 116.596 2.440 25757 11558 1 14 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.085 0.085 25757 11559 1 14 . 1 1 112 112 LEU C C 112 176.377 176.377 177.018 -0.641 25757 11560 1 14 . 1 1 112 112 LEU CA C 112 55.505 55.505 55.848 -0.343 25757 11561 1 14 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.317 0.043 25757 11562 1 14 . 1 1 112 112 LEU H H 112 7.794 7.794 7.685 0.109 25757 11563 1 14 . 1 1 113 113 GLY N N 113 106.045 106.045 103.466 2.579 25757 11564 1 14 . 1 1 113 113 GLY C C 113 174.248 174.248 174.438 -0.190 25757 11565 1 14 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.340 0.967 25757 11566 1 14 . 1 1 113 113 GLY H H 113 7.741 7.741 7.594 0.147 25757 11567 1 14 . 1 1 114 114 GLU N N 114 120.556 120.556 120.397 0.159 25757 11568 1 14 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.388 -0.078 25757 11569 1 14 . 1 1 114 114 GLU C C 114 174.993 174.993 176.201 -1.208 25757 11570 1 14 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.690 -1.053 25757 11571 1 14 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.770 0.447 25757 11572 1 14 . 1 1 114 114 GLU H H 114 7.980 7.980 7.706 0.274 25757 11573 1 14 . 1 1 115 115 LYS N N 115 124.986 124.986 123.782 1.204 25757 11574 1 14 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.446 -0.112 25757 11575 1 14 . 1 1 115 115 LYS C C 115 175.285 175.285 175.371 -0.086 25757 11576 1 14 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.102 -0.521 25757 11577 1 14 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.914 -0.941 25757 11578 1 14 . 1 1 115 115 LYS H H 115 8.613 8.613 8.361 0.252 25757 11579 1 14 . 1 1 116 116 LEU N N 116 125.243 125.243 122.216 3.027 25757 11580 1 14 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.844 -0.156 25757 11581 1 14 . 1 1 116 116 LEU C C 116 178.365 178.365 175.499 2.866 25757 11582 1 14 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.303 0.044 25757 11583 1 14 . 1 1 116 116 LEU CB C 116 44.289 44.289 42.911 1.378 25757 11584 1 14 . 1 1 116 116 LEU H H 116 8.066 8.066 8.286 -0.220 25757 11585 1 14 . 1 1 117 117 THR N N 117 114.324 114.324 111.417 2.907 25757 11586 1 14 . 1 1 117 117 THR HA H 117 4.713 4.713 4.569 0.144 25757 11587 1 14 . 1 1 117 117 THR C C 117 175.539 175.539 174.952 0.587 25757 11588 1 14 . 1 1 117 117 THR CA C 117 60.756 60.756 60.623 0.133 25757 11589 1 14 . 1 1 117 117 THR CB C 117 71.144 71.144 71.666 -0.522 25757 11590 1 14 . 1 1 117 117 THR H H 117 9.228 9.228 7.987 1.241 25757 11591 1 14 . 1 1 118 118 ASP N N 118 121.016 121.016 120.362 0.654 25757 11592 1 14 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.242 -0.087 25757 11593 1 14 . 1 1 118 118 ASP H H 118 8.919 8.919 8.728 0.191 25757 11594 1 14 . 1 1 119 119 GLU N N 119 121.016 121.016 119.409 1.607 25757 11595 1 14 . 1 1 119 119 GLU C C 119 179.204 179.204 178.120 1.084 25757 11596 1 14 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.061 -0.991 25757 11597 1 14 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.626 -0.582 25757 11598 1 14 . 1 1 119 119 GLU H H 119 8.919 8.919 8.184 0.735 25757 11599 1 14 . 1 1 120 120 GLU N N 120 120.566 120.566 119.954 0.612 25757 11600 1 14 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.001 -0.000 25757 11601 1 14 . 1 1 120 120 GLU C C 120 180.329 180.329 178.814 1.515 25757 11602 1 14 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.328 -0.237 25757 11603 1 14 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.326 1.312 25757 11604 1 14 . 1 1 120 120 GLU H H 120 7.732 7.732 7.345 0.387 25757 11605 1 14 . 1 1 121 121 VAL N N 121 121.875 121.875 119.484 2.391 25757 11606 1 14 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.585 -0.120 25757 11607 1 14 . 1 1 121 121 VAL C C 121 177.477 177.477 178.525 -1.048 25757 11608 1 14 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.373 0.798 25757 11609 1 14 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.210 0.224 25757 11610 1 14 . 1 1 121 121 VAL H H 121 8.104 8.104 7.548 0.556 25757 11611 1 14 . 1 1 122 122 ASP N N 122 120.566 120.566 118.637 1.929 25757 11612 1 14 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.319 0.016 25757 11613 1 14 . 1 1 122 122 ASP C C 122 179.298 179.298 178.684 0.614 25757 11614 1 14 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.388 0.451 25757 11615 1 14 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.834 -0.521 25757 11616 1 14 . 1 1 122 122 ASP H H 122 8.089 8.089 8.122 -0.033 25757 11617 1 14 . 1 1 123 123 GLU N N 123 119.821 119.821 120.920 -1.099 25757 11618 1 14 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.102 -0.053 25757 11619 1 14 . 1 1 123 123 GLU C C 123 178.749 178.749 178.765 -0.016 25757 11620 1 14 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.919 0.399 25757 11621 1 14 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.427 -0.042 25757 11622 1 14 . 1 1 123 123 GLU H H 123 8.105 8.105 7.837 0.268 25757 11623 1 14 . 1 1 124 124 MET N N 124 119.288 119.288 118.077 1.211 25757 11624 1 14 . 1 1 124 124 MET C C 124 180.865 180.865 178.958 1.907 25757 11625 1 14 . 1 1 124 124 MET CA C 124 60.684 60.684 59.216 1.468 25757 11626 1 14 . 1 1 124 124 MET CB C 124 33.141 33.141 31.991 1.149 25757 11627 1 14 . 1 1 124 124 MET H H 124 7.726 7.726 8.079 -0.353 25757 11628 1 14 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.053 -0.324 25757 11629 1 14 . 1 1 125 125 ILE C C 125 177.341 177.341 178.276 -0.935 25757 11630 1 14 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.555 0.246 25757 11631 1 14 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.921 -1.356 25757 11632 1 14 . 1 1 126 126 ARG N N 126 118.555 118.555 119.612 -1.057 25757 11633 1 14 . 1 1 126 126 ARG C C 126 179.164 179.164 178.476 0.688 25757 11634 1 14 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.785 0.139 25757 11635 1 14 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.172 -0.307 25757 11636 1 14 . 1 1 126 126 ARG H H 126 8.380 8.380 7.910 0.470 25757 11637 1 14 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.310 -0.385 25757 11638 1 14 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.453 1.604 25757 11639 1 14 . 1 1 127 127 GLU CB C 127 30.828 30.828 29.844 0.984 25757 11640 1 14 . 1 1 128 128 ALA N N 128 116.764 116.764 120.379 -3.615 25757 11641 1 14 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.036 0.381 25757 11642 1 14 . 1 1 128 128 ALA C C 128 177.885 177.885 177.157 0.728 25757 11643 1 14 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.441 -1.486 25757 11644 1 14 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.472 3.095 25757 11645 1 14 . 1 1 128 128 ALA H H 128 7.152 7.152 8.097 -0.945 25757 11646 1 14 . 1 1 129 129 ASP N N 129 117.762 117.762 117.773 -0.011 25757 11647 1 14 . 1 1 129 129 ASP HA H 129 4.477 4.477 4.965 -0.488 25757 11648 1 14 . 1 1 129 129 ASP C C 129 175.935 175.935 177.190 -1.255 25757 11649 1 14 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.356 2.159 25757 11650 1 14 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.907 -1.162 25757 11651 1 14 . 1 1 129 129 ASP H H 129 8.007 8.007 8.063 -0.056 25757 11652 1 14 . 1 1 130 130 ILE N N 130 128.249 128.249 121.803 6.446 25757 11653 1 14 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.159 -0.295 25757 11654 1 14 . 1 1 130 130 ILE C C 130 177.764 177.764 175.846 1.918 25757 11655 1 14 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.687 0.861 25757 11656 1 14 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.325 1.323 25757 11657 1 14 . 1 1 130 130 ILE H H 130 8.412 8.412 8.465 -0.053 25757 11658 1 14 . 1 1 131 131 ASP N N 131 116.430 116.430 119.681 -3.251 25757 11659 1 14 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.716 -0.182 25757 11660 1 14 . 1 1 131 131 ASP C C 131 178.313 178.313 177.109 1.204 25757 11661 1 14 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.845 -0.961 25757 11662 1 14 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.089 -1.127 25757 11663 1 14 . 1 1 131 131 ASP H H 131 8.254 8.254 8.521 -0.267 25757 11664 1 14 . 1 1 132 132 GLY N N 132 108.460 108.460 108.912 -0.452 25757 11665 1 14 . 1 1 132 132 GLY C C 132 175.211 175.211 175.188 0.023 25757 11666 1 14 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.270 1.333 25757 11667 1 14 . 1 1 132 132 GLY H H 132 7.547 7.547 7.693 -0.146 25757 11668 1 14 . 1 1 133 133 ASP N N 133 120.909 120.909 119.387 1.522 25757 11669 1 14 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.594 -0.131 25757 11670 1 14 . 1 1 133 133 ASP C C 133 177.691 177.691 177.734 -0.043 25757 11671 1 14 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.984 0.830 25757 11672 1 14 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.978 -0.680 25757 11673 1 14 . 1 1 133 133 ASP H H 133 8.339 8.339 8.647 -0.308 25757 11674 1 14 . 1 1 134 134 GLY N N 134 112.704 112.704 108.158 4.546 25757 11675 1 14 . 1 1 134 134 GLY C C 134 172.722 172.722 173.478 -0.756 25757 11676 1 14 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.148 0.889 25757 11677 1 14 . 1 1 134 134 GLY H H 134 10.396 10.396 8.011 2.385 25757 11678 1 14 . 1 1 135 135 GLN N N 135 114.799 114.799 118.786 -3.987 25757 11679 1 14 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.088 -0.224 25757 11680 1 14 . 1 1 135 135 GLN C C 135 174.760 174.760 175.035 -0.275 25757 11681 1 14 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.515 -1.194 25757 11682 1 14 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.383 -1.318 25757 11683 1 14 . 1 1 135 135 GLN H H 135 7.975 7.975 8.469 -0.494 25757 11684 1 14 . 1 1 136 136 VAL N N 136 125.364 125.364 126.362 -0.998 25757 11685 1 14 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.710 0.498 25757 11686 1 14 . 1 1 136 136 VAL C C 136 175.831 175.831 175.670 0.161 25757 11687 1 14 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.362 0.455 25757 11688 1 14 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.662 1.012 25757 11689 1 14 . 1 1 136 136 VAL H H 136 9.169 9.169 9.119 0.050 25757 11690 1 14 . 1 1 137 137 ASN N N 137 129.155 129.155 126.228 2.927 25757 11691 1 14 . 1 1 137 137 ASN C C 137 174.737 174.737 175.788 -1.051 25757 11692 1 14 . 1 1 137 137 ASN CA C 137 51.351 51.351 52.090 -0.739 25757 11693 1 14 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.333 -3.010 25757 11694 1 14 . 1 1 137 137 ASN H H 137 9.652 9.652 8.829 0.823 25757 11695 1 14 . 1 1 138 138 TYR N N 138 118.504 118.504 122.401 -3.897 25757 11696 1 14 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.697 -0.418 25757 11697 1 14 . 1 1 138 138 TYR C C 138 176.174 176.174 176.999 -0.825 25757 11698 1 14 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.815 0.760 25757 11699 1 14 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.383 -0.653 25757 11700 1 14 . 1 1 138 138 TYR H H 138 8.460 8.460 8.893 -0.433 25757 11701 1 14 . 1 1 139 139 GLU N N 139 118.644 118.644 118.750 -0.106 25757 11702 1 14 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.777 -0.229 25757 11703 1 14 . 1 1 139 139 GLU C C 139 180.265 180.265 178.303 1.962 25757 11704 1 14 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.931 0.555 25757 11705 1 14 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.147 -0.156 25757 11706 1 14 . 1 1 139 139 GLU H H 139 8.136 8.136 7.900 0.236 25757 11707 1 14 . 1 1 140 140 GLU N N 140 120.030 120.030 117.386 2.644 25757 11708 1 14 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.055 -0.167 25757 11709 1 14 . 1 1 140 140 GLU C C 140 179.627 179.627 178.324 1.303 25757 11710 1 14 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.739 0.938 25757 11711 1 14 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.113 0.614 25757 11712 1 14 . 1 1 140 140 GLU H H 140 8.798 8.798 7.979 0.819 25757 11713 1 14 . 1 1 141 141 PHE N N 141 123.154 123.154 122.638 0.516 25757 11714 1 14 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.863 -0.166 25757 11715 1 14 . 1 1 141 141 PHE C C 141 176.952 176.952 177.770 -0.818 25757 11716 1 14 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.192 0.860 25757 11717 1 14 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.131 1.000 25757 11718 1 14 . 1 1 141 141 PHE H H 141 8.633 8.633 8.142 0.491 25757 11719 1 14 . 1 1 142 142 VAL N N 142 120.046 120.046 116.842 3.204 25757 11720 1 14 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.573 -0.617 25757 11721 1 14 . 1 1 142 142 VAL C C 142 179.627 179.627 177.628 1.999 25757 11722 1 14 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.413 1.830 25757 11723 1 14 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.291 0.849 25757 11724 1 14 . 1 1 142 142 VAL H H 142 8.894 8.894 7.931 0.963 25757 11725 1 14 . 1 1 143 143 GLN N N 143 118.996 118.996 119.161 -0.165 25757 11726 1 14 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.040 -0.264 25757 11727 1 14 . 1 1 143 143 GLN C C 143 178.443 178.443 177.781 0.662 25757 11728 1 14 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.296 0.833 25757 11729 1 14 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.191 -0.448 25757 11730 1 14 . 1 1 143 143 GLN H H 143 7.627 7.627 7.328 0.299 25757 11731 1 14 . 1 1 144 144 MET N N 144 116.361 116.361 118.261 -1.900 25757 11732 1 14 . 1 1 144 144 MET HA H 144 4.169 4.169 4.144 0.025 25757 11733 1 14 . 1 1 144 144 MET C C 144 178.418 178.418 175.869 2.549 25757 11734 1 14 . 1 1 144 144 MET CA C 144 56.137 56.137 57.222 -1.085 25757 11735 1 14 . 1 1 144 144 MET CB C 144 31.095 31.095 32.058 -0.963 25757 11736 1 14 . 1 1 144 144 MET H H 144 7.179 7.179 7.433 -0.254 25757 11737 1 14 . 1 1 145 145 MET N N 145 115.373 115.373 116.163 -0.790 25757 11738 1 14 . 1 1 145 145 MET HA H 145 4.334 4.334 4.521 -0.187 25757 11739 1 14 . 1 1 145 145 MET C C 145 177.217 177.217 176.226 0.991 25757 11740 1 14 . 1 1 145 145 MET CA C 145 55.296 55.296 55.331 -0.035 25757 11741 1 14 . 1 1 145 145 MET CB C 145 34.458 34.458 33.592 0.866 25757 11742 1 14 . 1 1 145 145 MET H H 145 7.776 7.776 7.309 0.467 25757 11743 1 14 . 1 1 146 146 THR N N 146 107.988 107.988 112.605 -4.617 25757 11744 1 14 . 1 1 146 146 THR HA H 146 4.239 4.239 4.401 -0.162 25757 11745 1 14 . 1 1 146 146 THR C C 146 175.378 175.378 174.894 0.484 25757 11746 1 14 . 1 1 146 146 THR CA C 146 61.625 61.625 61.862 -0.237 25757 11747 1 14 . 1 1 146 146 THR CB C 146 70.817 70.817 68.700 2.117 25757 11748 1 14 . 1 1 146 146 THR H H 146 7.736 7.736 7.613 0.123 25757 11749 1 14 . 1 1 147 147 GLY N N 147 110.157 110.157 109.712 0.445 25757 11750 1 14 . 1 1 147 147 GLY C C 147 174.046 174.046 173.861 0.185 25757 11751 1 14 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.794 0.750 25757 11752 1 14 . 1 1 147 147 GLY H H 147 7.793 7.793 7.923 -0.130 25757 11753 1 14 . 1 1 150 150 THR HA H 150 4.239 4.239 4.278 -0.039 25757 11754 1 14 . 1 1 150 150 THR C C 150 174.397 174.397 174.590 -0.193 25757 11755 1 14 . 1 1 150 150 THR CA C 150 61.260 61.260 62.676 -1.416 25757 11756 1 14 . 1 1 150 150 THR CB C 150 70.358 70.358 69.183 1.175 25757 11757 1 14 . 1 1 151 151 ALA N N 151 126.304 126.304 122.604 3.700 25757 11758 1 14 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.301 -0.013 25757 11759 1 14 . 1 1 151 151 ALA C C 151 177.678 177.678 177.519 0.159 25757 11760 1 14 . 1 1 151 151 ALA CA C 151 52.148 52.148 52.186 -0.038 25757 11761 1 14 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.556 -0.137 25757 11762 1 14 . 1 1 151 151 ALA H H 151 8.618 8.618 7.379 1.239 25757 11763 1 14 . 1 1 152 152 ALA N N 152 123.861 123.861 121.505 2.356 25757 11764 1 14 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.308 -0.190 25757 11765 1 14 . 1 1 152 152 ALA C C 152 178.823 178.823 178.293 0.530 25757 11766 1 14 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.550 1.944 25757 11767 1 14 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.123 0.634 25757 11768 1 14 . 1 1 152 152 ALA H H 152 8.354 8.354 8.694 -0.340 25757 11769 1 14 . 1 1 153 153 GLY N N 153 109.984 109.984 107.699 2.285 25757 11770 1 14 . 1 1 153 153 GLY C C 153 174.389 174.389 175.703 -1.314 25757 11771 1 14 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.013 -1.882 25757 11772 1 14 . 1 1 153 153 GLY H H 153 9.028 9.028 8.073 0.955 25757 11773 1 14 . 1 1 154 154 SER N N 154 113.934 113.934 118.646 -4.712 25757 11774 1 14 . 1 1 154 154 SER HA H 154 4.255 4.255 4.001 0.254 25757 11775 1 14 . 1 1 154 154 SER C C 154 177.929 177.929 176.635 1.294 25757 11776 1 14 . 1 1 154 154 SER CA C 154 59.379 59.379 62.491 -3.112 25757 11777 1 14 . 1 1 154 154 SER CB C 154 64.090 64.090 62.693 1.397 25757 11778 1 14 . 1 1 154 154 SER H H 154 7.962 7.962 8.184 -0.222 25757 11779 1 14 . 1 1 155 155 GLY N N 155 115.337 115.337 109.026 6.311 25757 11780 1 14 . 1 1 155 155 GLY C C 155 175.891 175.891 175.468 0.423 25757 11781 1 14 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.742 0.904 25757 11782 1 14 . 1 1 155 155 GLY H H 155 9.451 9.451 7.766 1.685 25757 11783 1 14 . 1 1 156 156 TRP N N 156 119.600 119.600 122.269 -2.669 25757 11784 1 14 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.248 0.023 25757 11785 1 14 . 1 1 156 156 TRP C C 156 178.947 178.947 179.059 -0.112 25757 11786 1 14 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.449 -0.285 25757 11787 1 14 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.077 0.526 25757 11788 1 14 . 1 1 156 156 TRP H H 156 8.542 8.542 7.386 1.156 25757 11789 1 14 . 1 1 157 157 ARG N N 157 118.583 118.583 119.177 -0.594 25757 11790 1 14 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.015 -0.033 25757 11791 1 14 . 1 1 157 157 ARG C C 157 177.894 177.894 178.301 -0.407 25757 11792 1 14 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.970 -0.632 25757 11793 1 14 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.934 0.123 25757 11794 1 14 . 1 1 157 157 ARG H H 157 7.747 7.747 8.603 -0.856 25757 11795 1 14 . 1 1 158 158 LYS N N 158 117.033 117.033 121.016 -3.983 25757 11796 1 14 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.044 -0.101 25757 11797 1 14 . 1 1 158 158 LYS C C 158 176.973 176.973 178.910 -1.937 25757 11798 1 14 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.981 0.393 25757 11799 1 14 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.187 0.104 25757 11800 1 14 . 1 1 158 158 LYS H H 158 7.529 7.529 7.957 -0.428 25757 11801 1 14 . 1 1 159 159 ILE N N 159 116.553 116.553 119.796 -3.243 25757 11802 1 14 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.753 -0.209 25757 11803 1 14 . 1 1 159 159 ILE C C 159 176.894 176.894 177.300 -0.406 25757 11804 1 14 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.985 0.531 25757 11805 1 14 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.095 -0.291 25757 11806 1 14 . 1 1 159 159 ILE H H 159 7.348 7.348 8.169 -0.821 25757 11807 1 14 . 1 1 160 160 LYS N N 160 119.278 119.278 119.820 -0.542 25757 11808 1 14 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.352 -0.313 25757 11809 1 14 . 1 1 160 160 LYS C C 160 178.566 178.566 179.701 -1.135 25757 11810 1 14 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.239 1.135 25757 11811 1 14 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.295 0.523 25757 11812 1 14 . 1 1 160 160 LYS H H 160 8.225 8.225 8.179 0.046 25757 11813 1 14 . 1 1 161 161 LEU N N 161 117.056 117.056 120.461 -3.405 25757 11814 1 14 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.131 -0.071 25757 11815 1 14 . 1 1 161 161 LEU C C 161 178.977 178.977 178.987 -0.010 25757 11816 1 14 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.444 -0.420 25757 11817 1 14 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.907 0.075 25757 11818 1 14 . 1 1 161 161 LEU H H 161 8.057 8.057 8.589 -0.532 25757 11819 1 14 . 1 1 162 162 ALA N N 162 121.814 121.814 121.990 -0.176 25757 11820 1 14 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.031 0.061 25757 11821 1 14 . 1 1 162 162 ALA C C 162 178.374 178.374 179.654 -1.280 25757 11822 1 14 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.276 0.514 25757 11823 1 14 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.528 -0.203 25757 11824 1 14 . 1 1 162 162 ALA H H 162 8.170 8.170 8.222 -0.052 25757 11825 1 14 . 1 1 163 163 VAL N N 163 115.449 115.449 115.150 0.299 25757 11826 1 14 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.757 -0.139 25757 11827 1 14 . 1 1 163 163 VAL C C 163 178.362 178.362 177.610 0.752 25757 11828 1 14 . 1 1 163 163 VAL CA C 163 66.272 66.272 66.043 0.229 25757 11829 1 14 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.688 0.349 25757 11830 1 14 . 1 1 163 163 VAL H H 163 8.499 8.499 8.095 0.404 25757 11831 1 14 . 1 1 164 164 ARG N N 164 115.775 115.775 120.795 -5.020 25757 11832 1 14 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.314 -0.117 25757 11833 1 14 . 1 1 164 164 ARG C C 164 178.938 178.938 177.828 1.110 25757 11834 1 14 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.811 -1.128 25757 11835 1 14 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.578 -0.744 25757 11836 1 14 . 1 1 164 164 ARG H H 164 8.165 8.165 8.131 0.034 25757 11837 1 14 . 1 1 165 165 GLY N N 165 105.570 105.570 106.188 -0.618 25757 11838 1 14 . 1 1 165 165 GLY C C 165 173.134 173.134 175.487 -2.353 25757 11839 1 14 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.074 0.668 25757 11840 1 14 . 1 1 165 165 GLY H H 165 8.455 8.455 8.173 0.282 25757 11841 1 14 . 1 1 166 166 ALA N N 166 120.648 120.648 122.577 -1.929 25757 11842 1 14 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.289 0.053 25757 11843 1 14 . 1 1 166 166 ALA C C 166 176.155 176.155 177.335 -1.180 25757 11844 1 14 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.988 -2.215 25757 11845 1 14 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.072 0.406 25757 11846 1 14 . 1 1 166 166 ALA H H 166 7.826 7.826 7.919 -0.093 25757 11847 1 14 . 1 1 167 167 GLN N N 167 117.315 117.315 117.569 -0.254 25757 11848 1 14 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.535 -0.258 25757 11849 1 14 . 1 1 167 167 GLN C C 167 175.571 175.571 175.127 0.444 25757 11850 1 14 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.322 1.605 25757 11851 1 14 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.379 0.806 25757 11852 1 14 . 1 1 167 167 GLN H H 167 7.498 7.498 7.607 -0.109 25757 11853 1 14 . 1 1 168 168 ALA N N 168 126.706 126.706 130.268 -3.562 25757 11854 1 14 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.004 0.275 25757 11855 1 14 . 1 1 168 168 ALA C C 168 177.227 177.227 177.444 -0.217 25757 11856 1 14 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.614 -2.548 25757 11857 1 14 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.087 0.619 25757 11858 1 14 . 1 1 168 168 ALA H H 168 8.534 8.534 8.544 -0.010 25757 11859 1 15 . 1 1 9 9 ILE N N 9 116.733 116.733 120.890 -4.157 25757 11860 1 15 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.125 -0.368 25757 11861 1 15 . 1 1 9 9 ILE C C 9 177.828 177.828 177.283 0.545 25757 11862 1 15 . 1 1 9 9 ILE CA C 9 65.604 65.604 61.956 3.648 25757 11863 1 15 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.320 0.278 25757 11864 1 15 . 1 1 9 9 ILE H H 9 7.366 7.366 8.085 -0.719 25757 11865 1 15 . 1 1 10 10 ALA N N 10 121.080 121.080 124.317 -3.237 25757 11866 1 15 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.110 -0.035 25757 11867 1 15 . 1 1 10 10 ALA C C 10 180.921 180.921 178.750 2.171 25757 11868 1 15 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.277 0.326 25757 11869 1 15 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.362 0.622 25757 11870 1 15 . 1 1 10 10 ALA H H 10 8.039 8.039 8.228 -0.189 25757 11871 1 15 . 1 1 11 11 GLU N N 11 119.580 119.580 117.657 1.923 25757 11872 1 15 . 1 1 11 11 GLU HA H 11 4.089 4.089 4.018 0.071 25757 11873 1 15 . 1 1 11 11 GLU C C 11 179.561 179.561 178.780 0.781 25757 11874 1 15 . 1 1 11 11 GLU CA C 11 59.885 59.885 58.821 1.064 25757 11875 1 15 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.704 0.759 25757 11876 1 15 . 1 1 11 11 GLU H H 11 7.741 7.741 8.588 -0.847 25757 11877 1 15 . 1 1 12 12 PHE N N 12 118.509 118.509 119.607 -1.098 25757 11878 1 15 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.497 0.329 25757 11879 1 15 . 1 1 12 12 PHE C C 12 179.000 179.000 178.330 0.670 25757 11880 1 15 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.359 0.805 25757 11881 1 15 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.916 0.194 25757 11882 1 15 . 1 1 12 12 PHE H H 12 8.470 8.470 7.180 1.290 25757 11883 1 15 . 1 1 13 13 LYS N N 13 123.523 123.523 120.302 3.221 25757 11884 1 15 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.143 -0.117 25757 11885 1 15 . 1 1 13 13 LYS C C 13 179.260 179.260 179.282 -0.022 25757 11886 1 15 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.790 0.374 25757 11887 1 15 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.208 -0.375 25757 11888 1 15 . 1 1 13 13 LYS H H 13 9.171 9.171 8.400 0.771 25757 11889 1 15 . 1 1 14 14 GLU N N 14 120.415 120.415 119.091 1.324 25757 11890 1 15 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.183 -0.088 25757 11891 1 15 . 1 1 14 14 GLU C C 14 179.851 179.851 179.022 0.829 25757 11892 1 15 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.256 0.330 25757 11893 1 15 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.651 -0.090 25757 11894 1 15 . 1 1 14 14 GLU H H 14 7.822 7.822 8.347 -0.525 25757 11895 1 15 . 1 1 15 15 ALA N N 15 122.143 122.143 123.216 -1.073 25757 11896 1 15 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.244 -0.114 25757 11897 1 15 . 1 1 15 15 ALA C C 15 178.222 178.222 178.879 -0.657 25757 11898 1 15 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.206 -0.017 25757 11899 1 15 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.991 -0.489 25757 11900 1 15 . 1 1 15 15 ALA H H 15 8.244 8.244 8.213 0.031 25757 11901 1 15 . 1 1 16 16 PHE N N 16 119.809 119.809 117.612 2.197 25757 11902 1 15 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.513 -0.501 25757 11903 1 15 . 1 1 16 16 PHE C C 16 177.444 177.444 176.752 0.692 25757 11904 1 15 . 1 1 16 16 PHE CA C 16 62.064 62.064 59.691 2.373 25757 11905 1 15 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.607 -1.175 25757 11906 1 15 . 1 1 16 16 PHE H H 16 8.891 8.891 8.399 0.492 25757 11907 1 15 . 1 1 17 17 SER N N 17 112.631 112.631 117.193 -4.562 25757 11908 1 15 . 1 1 17 17 SER HA H 17 4.034 4.034 3.971 0.063 25757 11909 1 15 . 1 1 17 17 SER C C 17 174.675 174.675 176.172 -1.497 25757 11910 1 15 . 1 1 17 17 SER CA C 17 61.507 61.507 62.045 -0.538 25757 11911 1 15 . 1 1 17 17 SER CB C 17 63.414 63.414 63.590 -0.176 25757 11912 1 15 . 1 1 17 17 SER H H 17 7.910 7.910 8.489 -0.579 25757 11913 1 15 . 1 1 18 18 LEU N N 18 120.614 120.614 117.258 3.356 25757 11914 1 15 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.267 -0.255 25757 11915 1 15 . 1 1 18 18 LEU C C 18 177.366 177.366 178.341 -0.975 25757 11916 1 15 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.354 0.032 25757 11917 1 15 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.552 0.043 25757 11918 1 15 . 1 1 18 18 LEU H H 18 7.423 7.423 7.952 -0.528 25757 11919 1 15 . 1 1 19 19 PHE N N 19 114.602 114.602 119.953 -5.351 25757 11920 1 15 . 1 1 19 19 PHE C C 19 176.961 176.961 176.337 0.624 25757 11921 1 15 . 1 1 19 19 PHE CA C 19 59.484 59.484 60.231 -0.747 25757 11922 1 15 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.406 1.363 25757 11923 1 15 . 1 1 19 19 PHE H H 19 7.254 7.254 7.225 0.029 25757 11924 1 15 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.554 0.021 25757 11925 1 15 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.533 -1.885 25757 11926 1 15 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.581 -0.571 25757 11927 1 15 . 1 1 23 23 GLY N N 23 108.244 108.244 107.821 0.423 25757 11928 1 15 . 1 1 23 23 GLY C C 23 175.188 175.188 174.841 0.347 25757 11929 1 15 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.018 1.385 25757 11930 1 15 . 1 1 23 23 GLY H H 23 7.555 7.555 8.235 -0.680 25757 11931 1 15 . 1 1 24 24 ASP N N 24 120.667 120.667 120.055 0.612 25757 11932 1 15 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.596 -0.127 25757 11933 1 15 . 1 1 24 24 ASP C C 24 177.457 177.457 177.840 -0.383 25757 11934 1 15 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.397 0.395 25757 11935 1 15 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.643 -1.127 25757 11936 1 15 . 1 1 24 24 ASP H H 24 8.397 8.397 8.546 -0.149 25757 11937 1 15 . 1 1 25 25 GLY N N 25 112.989 112.989 109.059 3.930 25757 11938 1 15 . 1 1 25 25 GLY C C 25 173.639 173.639 173.493 0.146 25757 11939 1 15 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.235 0.266 25757 11940 1 15 . 1 1 25 25 GLY H H 25 10.592 10.592 8.367 2.225 25757 11941 1 15 . 1 1 26 26 THR N N 26 112.948 112.948 112.888 0.060 25757 11942 1 15 . 1 1 26 26 THR HA H 26 5.282 5.282 5.172 0.110 25757 11943 1 15 . 1 1 26 26 THR C C 26 172.853 172.853 172.765 0.088 25757 11944 1 15 . 1 1 26 26 THR CA C 26 59.817 59.817 61.408 -1.591 25757 11945 1 15 . 1 1 26 26 THR CB C 26 72.465 72.465 71.401 1.064 25757 11946 1 15 . 1 1 26 26 THR H H 26 8.121 8.121 8.342 -0.221 25757 11947 1 15 . 1 1 27 27 ILE N N 27 127.195 127.195 123.158 4.037 25757 11948 1 15 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.730 0.183 25757 11949 1 15 . 1 1 27 27 ILE C C 27 176.091 176.091 174.796 1.295 25757 11950 1 15 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.332 0.433 25757 11951 1 15 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.454 -1.749 25757 11952 1 15 . 1 1 27 27 ILE H H 27 9.867 9.867 8.576 1.291 25757 11953 1 15 . 1 1 28 28 THR N N 28 116.655 116.655 120.410 -3.755 25757 11954 1 15 . 1 1 28 28 THR HA H 28 4.790 4.790 4.833 -0.043 25757 11955 1 15 . 1 1 28 28 THR C C 28 176.696 176.696 176.486 0.210 25757 11956 1 15 . 1 1 28 28 THR CA C 28 59.590 59.590 59.907 -0.317 25757 11957 1 15 . 1 1 28 28 THR CB C 28 72.457 72.457 70.852 1.605 25757 11958 1 15 . 1 1 28 28 THR H H 28 8.457 8.457 8.298 0.159 25757 11959 1 15 . 1 1 29 29 THR N N 29 111.878 111.878 117.274 -5.396 25757 11960 1 15 . 1 1 29 29 THR HA H 29 4.188 4.188 4.040 0.148 25757 11961 1 15 . 1 1 29 29 THR C C 29 177.399 177.399 176.273 1.126 25757 11962 1 15 . 1 1 29 29 THR CA C 29 66.386 66.386 66.264 0.122 25757 11963 1 15 . 1 1 29 29 THR CB C 29 67.726 67.726 68.126 -0.400 25757 11964 1 15 . 1 1 29 29 THR H H 29 9.211 9.211 8.975 0.236 25757 11965 1 15 . 1 1 30 30 LYS N N 30 121.140 121.140 121.912 -0.772 25757 11966 1 15 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.967 0.110 25757 11967 1 15 . 1 1 30 30 LYS C C 30 179.793 179.793 178.622 1.171 25757 11968 1 15 . 1 1 30 30 LYS CA C 30 59.292 59.292 60.062 -0.770 25757 11969 1 15 . 1 1 30 30 LYS CB C 30 32.447 32.447 32.253 0.194 25757 11970 1 15 . 1 1 30 30 LYS H H 30 7.580 7.580 7.712 -0.132 25757 11971 1 15 . 1 1 31 31 GLU N N 31 121.865 121.865 119.846 2.019 25757 11972 1 15 . 1 1 31 31 GLU HA H 31 3.994 3.994 4.039 -0.045 25757 11973 1 15 . 1 1 31 31 GLU C C 31 179.355 179.355 179.046 0.309 25757 11974 1 15 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.990 -0.357 25757 11975 1 15 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.742 0.110 25757 11976 1 15 . 1 1 31 31 GLU H H 31 7.708 7.708 7.712 -0.004 25757 11977 1 15 . 1 1 32 32 LEU N N 32 120.597 120.597 117.959 2.638 25757 11978 1 15 . 1 1 32 32 LEU HA H 32 4.116 4.116 4.325 -0.209 25757 11979 1 15 . 1 1 32 32 LEU C C 32 178.885 178.885 179.187 -0.302 25757 11980 1 15 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.578 -0.217 25757 11981 1 15 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.133 1.903 25757 11982 1 15 . 1 1 32 32 LEU H H 32 8.688 8.688 7.818 0.870 25757 11983 1 15 . 1 1 33 33 GLY N N 33 104.837 104.837 107.698 -2.861 25757 11984 1 15 . 1 1 33 33 GLY C C 33 175.123 175.123 175.922 -0.799 25757 11985 1 15 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.623 0.624 25757 11986 1 15 . 1 1 33 33 GLY H H 33 8.694 8.694 8.675 0.019 25757 11987 1 15 . 1 1 34 34 THR N N 34 117.631 117.631 118.728 -1.097 25757 11988 1 15 . 1 1 34 34 THR HA H 34 3.899 3.899 4.030 -0.131 25757 11989 1 15 . 1 1 34 34 THR C C 34 176.951 176.951 176.738 0.213 25757 11990 1 15 . 1 1 34 34 THR CA C 34 67.234 67.234 66.319 0.915 25757 11991 1 15 . 1 1 34 34 THR CB C 34 68.863 68.863 68.176 0.687 25757 11992 1 15 . 1 1 34 34 THR H H 34 7.960 7.960 8.023 -0.063 25757 11993 1 15 . 1 1 35 35 VAL N N 35 121.659 121.659 122.264 -0.605 25757 11994 1 15 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.513 0.004 25757 11995 1 15 . 1 1 35 35 VAL C C 35 178.265 178.265 177.534 0.731 25757 11996 1 15 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.548 0.127 25757 11997 1 15 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.052 0.241 25757 11998 1 15 . 1 1 35 35 VAL H H 35 7.358 7.358 8.100 -0.742 25757 11999 1 15 . 1 1 36 36 MET N N 36 117.456 117.456 118.032 -0.576 25757 12000 1 15 . 1 1 36 36 MET C C 36 179.088 179.088 178.389 0.699 25757 12001 1 15 . 1 1 36 36 MET CA C 36 60.477 60.477 58.898 1.579 25757 12002 1 15 . 1 1 36 36 MET CB C 36 32.443 32.443 32.637 -0.194 25757 12003 1 15 . 1 1 36 36 MET H H 36 8.194 8.194 8.112 0.082 25757 12004 1 15 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.853 0.293 25757 12005 1 15 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.279 0.072 25757 12006 1 15 . 1 1 38 38 SER HA H 38 4.085 4.085 4.292 -0.207 25757 12007 1 15 . 1 1 38 38 SER C C 38 173.788 173.788 174.467 -0.679 25757 12008 1 15 . 1 1 38 38 SER CA C 38 61.617 61.617 59.772 1.845 25757 12009 1 15 . 1 1 38 38 SER CB C 38 62.943 62.943 63.201 -0.258 25757 12010 1 15 . 1 1 39 39 LEU N N 39 119.003 119.003 120.308 -1.305 25757 12011 1 15 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.422 0.072 25757 12012 1 15 . 1 1 39 39 LEU C C 39 176.470 176.470 176.874 -0.404 25757 12013 1 15 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.516 0.163 25757 12014 1 15 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.283 0.231 25757 12015 1 15 . 1 1 39 39 LEU H H 39 7.230 7.230 7.204 0.026 25757 12016 1 15 . 1 1 40 40 GLY N N 40 105.026 105.026 106.206 -1.180 25757 12017 1 15 . 1 1 40 40 GLY C C 40 174.322 174.322 174.405 -0.083 25757 12018 1 15 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.374 0.841 25757 12019 1 15 . 1 1 40 40 GLY H H 40 7.698 7.698 7.635 0.063 25757 12020 1 15 . 1 1 41 41 GLN N N 41 117.929 117.929 118.285 -0.356 25757 12021 1 15 . 1 1 41 41 GLN C C 41 174.557 174.557 174.910 -0.353 25757 12022 1 15 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.672 0.172 25757 12023 1 15 . 1 1 41 41 GLN H H 41 7.866 7.866 7.745 0.121 25757 12024 1 15 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.697 0.039 25757 12025 1 15 . 1 1 43 43 PRO C C 43 177.805 177.805 176.350 1.455 25757 12026 1 15 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.150 -0.645 25757 12027 1 15 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.755 -0.593 25757 12028 1 15 . 1 1 44 44 THR N N 44 113.167 113.167 114.471 -1.304 25757 12029 1 15 . 1 1 44 44 THR HA H 44 4.684 4.684 4.676 0.008 25757 12030 1 15 . 1 1 44 44 THR C C 44 175.139 175.139 175.594 -0.455 25757 12031 1 15 . 1 1 44 44 THR CA C 44 60.556 60.556 59.647 0.909 25757 12032 1 15 . 1 1 44 44 THR CB C 44 71.064 71.064 71.098 -0.034 25757 12033 1 15 . 1 1 44 44 THR H H 44 8.798 8.798 7.975 0.823 25757 12034 1 15 . 1 1 45 45 GLU N N 45 120.673 120.673 121.032 -0.359 25757 12035 1 15 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.981 0.010 25757 12036 1 15 . 1 1 45 45 GLU C C 45 178.940 178.940 178.745 0.195 25757 12037 1 15 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.660 0.241 25757 12038 1 15 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.053 -0.024 25757 12039 1 15 . 1 1 45 45 GLU H H 45 8.812 8.812 8.958 -0.146 25757 12040 1 15 . 1 1 46 46 ALA N N 46 120.576 120.576 121.404 -0.828 25757 12041 1 15 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.067 -0.100 25757 12042 1 15 . 1 1 46 46 ALA C C 46 180.290 180.290 179.695 0.595 25757 12043 1 15 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.299 -0.380 25757 12044 1 15 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.299 -0.139 25757 12045 1 15 . 1 1 46 46 ALA H H 46 8.276 8.276 8.239 0.037 25757 12046 1 15 . 1 1 47 47 GLU N N 47 116.104 116.104 119.048 -2.944 25757 12047 1 15 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.042 -0.042 25757 12048 1 15 . 1 1 47 47 GLU C C 47 180.224 180.224 179.086 1.138 25757 12049 1 15 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.398 -0.467 25757 12050 1 15 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.066 0.923 25757 12051 1 15 . 1 1 47 47 GLU H H 47 7.425 7.425 7.921 -0.496 25757 12052 1 15 . 1 1 48 48 LEU N N 48 120.425 120.425 119.820 0.605 25757 12053 1 15 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.824 0.226 25757 12054 1 15 . 1 1 48 48 LEU C C 48 178.551 178.551 179.049 -0.498 25757 12055 1 15 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.376 -0.537 25757 12056 1 15 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.281 1.288 25757 12057 1 15 . 1 1 48 48 LEU H H 48 8.121 8.121 7.656 0.465 25757 12058 1 15 . 1 1 49 49 GLN N N 49 118.372 118.372 117.975 0.397 25757 12059 1 15 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.873 -0.111 25757 12060 1 15 . 1 1 49 49 GLN C C 49 178.567 178.567 178.622 -0.055 25757 12061 1 15 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.061 -0.198 25757 12062 1 15 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.381 -0.139 25757 12063 1 15 . 1 1 49 49 GLN H H 49 8.302 8.302 8.232 0.070 25757 12064 1 15 . 1 1 50 50 ASP N N 50 119.992 119.992 120.679 -0.687 25757 12065 1 15 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.355 0.005 25757 12066 1 15 . 1 1 50 50 ASP C C 50 178.600 178.600 178.400 0.200 25757 12067 1 15 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.101 0.602 25757 12068 1 15 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.757 -0.290 25757 12069 1 15 . 1 1 50 50 ASP H H 50 8.150 8.150 8.340 -0.190 25757 12070 1 15 . 1 1 51 51 MET N N 51 119.238 119.238 118.838 0.400 25757 12071 1 15 . 1 1 51 51 MET HA H 51 3.981 3.981 3.985 -0.004 25757 12072 1 15 . 1 1 51 51 MET C C 51 179.006 179.006 178.804 0.202 25757 12073 1 15 . 1 1 51 51 MET CA C 51 59.443 59.443 58.854 0.589 25757 12074 1 15 . 1 1 51 51 MET CB C 51 33.380 33.380 32.475 0.905 25757 12075 1 15 . 1 1 51 51 MET H H 51 7.844 7.844 7.971 -0.127 25757 12076 1 15 . 1 1 52 52 ILE N N 52 118.161 118.161 118.432 -0.271 25757 12077 1 15 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.629 -0.151 25757 12078 1 15 . 1 1 52 52 ILE C C 52 177.847 177.847 178.753 -0.906 25757 12079 1 15 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.510 0.485 25757 12080 1 15 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.712 0.411 25757 12081 1 15 . 1 1 52 52 ILE H H 52 7.686 7.686 8.293 -0.607 25757 12082 1 15 . 1 1 53 53 ASN N N 53 117.884 117.884 118.118 -0.234 25757 12083 1 15 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.460 -0.095 25757 12084 1 15 . 1 1 53 53 ASN C C 53 177.515 177.515 177.444 0.071 25757 12085 1 15 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.579 0.628 25757 12086 1 15 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.613 -0.535 25757 12087 1 15 . 1 1 53 53 ASN H H 53 8.713 8.713 8.458 0.255 25757 12088 1 15 . 1 1 54 54 GLU N N 54 116.178 116.178 117.660 -1.482 25757 12089 1 15 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.244 -0.255 25757 12090 1 15 . 1 1 54 54 GLU C C 54 177.557 177.557 176.605 0.952 25757 12091 1 15 . 1 1 54 54 GLU CA C 54 58.990 58.990 58.304 0.686 25757 12092 1 15 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.508 -0.045 25757 12093 1 15 . 1 1 54 54 GLU H H 54 7.530 7.530 8.032 -0.502 25757 12094 1 15 . 1 1 55 55 VAL N N 55 107.164 107.164 110.814 -3.650 25757 12095 1 15 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.348 0.174 25757 12096 1 15 . 1 1 55 55 VAL C C 55 175.602 175.602 173.943 1.659 25757 12097 1 15 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.021 0.331 25757 12098 1 15 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.003 0.600 25757 12099 1 15 . 1 1 55 55 VAL H H 55 7.175 7.175 7.409 -0.234 25757 12100 1 15 . 1 1 56 56 ASP N N 56 122.126 122.126 120.266 1.860 25757 12101 1 15 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.119 -0.520 25757 12102 1 15 . 1 1 56 56 ASP C C 56 176.182 176.182 175.855 0.327 25757 12103 1 15 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.152 0.654 25757 12104 1 15 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.522 -2.252 25757 12105 1 15 . 1 1 56 56 ASP H H 56 7.569 7.569 7.378 0.191 25757 12106 1 15 . 1 1 57 57 ALA N N 57 103.782 103.782 128.518 -24.736 25757 12107 1 15 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.355 -0.175 25757 12108 1 15 . 1 1 57 57 ALA C C 57 178.584 178.584 178.003 0.581 25757 12109 1 15 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.067 1.277 25757 12110 1 15 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.585 -0.061 25757 12111 1 15 . 1 1 57 57 ALA H H 57 8.515 8.515 8.686 -0.171 25757 12112 1 15 . 1 1 58 58 ASP N N 58 113.602 113.602 120.116 -6.514 25757 12113 1 15 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.533 0.053 25757 12114 1 15 . 1 1 58 58 ASP C C 58 177.756 177.756 177.180 0.576 25757 12115 1 15 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.882 -2.120 25757 12116 1 15 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.161 -1.483 25757 12117 1 15 . 1 1 58 58 ASP H H 58 8.130 8.130 8.027 0.103 25757 12118 1 15 . 1 1 59 59 GLY N N 59 109.195 109.195 107.736 1.459 25757 12119 1 15 . 1 1 59 59 GLY C C 59 175.139 175.139 174.405 0.734 25757 12120 1 15 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.101 2.163 25757 12121 1 15 . 1 1 59 59 GLY H H 59 7.694 7.694 8.683 -0.989 25757 12122 1 15 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.815 -0.210 25757 12123 1 15 . 1 1 61 61 GLY N N 61 113.316 113.316 110.406 2.910 25757 12124 1 15 . 1 1 61 61 GLY C C 61 173.234 173.234 173.164 0.070 25757 12125 1 15 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.208 -0.510 25757 12126 1 15 . 1 1 61 61 GLY H H 61 10.633 10.633 8.730 1.903 25757 12127 1 15 . 1 1 62 62 THR N N 62 108.892 108.892 109.344 -0.452 25757 12128 1 15 . 1 1 62 62 THR HA H 62 4.736 4.736 4.953 -0.217 25757 12129 1 15 . 1 1 62 62 THR C C 62 173.091 173.091 173.134 -0.043 25757 12130 1 15 . 1 1 62 62 THR CA C 62 59.617 59.617 59.450 0.168 25757 12131 1 15 . 1 1 62 62 THR CB C 62 72.004 72.004 72.273 -0.270 25757 12132 1 15 . 1 1 62 62 THR H H 62 7.673 7.673 7.729 -0.056 25757 12133 1 15 . 1 1 63 63 ILE N N 63 123.324 123.324 122.443 0.881 25757 12134 1 15 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.839 0.290 25757 12135 1 15 . 1 1 63 63 ILE C C 63 175.652 175.652 175.324 0.328 25757 12136 1 15 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.193 0.293 25757 12137 1 15 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.505 -1.548 25757 12138 1 15 . 1 1 63 63 ILE H H 63 8.907 8.907 8.702 0.205 25757 12139 1 15 . 1 1 64 64 ASP N N 64 128.253 128.253 126.193 2.060 25757 12140 1 15 . 1 1 64 64 ASP HA H 64 5.321 5.321 5.062 0.259 25757 12141 1 15 . 1 1 64 64 ASP C C 64 176.431 176.431 177.470 -1.039 25757 12142 1 15 . 1 1 64 64 ASP CA C 64 52.331 52.331 52.849 -0.518 25757 12143 1 15 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.315 -0.261 25757 12144 1 15 . 1 1 64 64 ASP H H 64 8.864 8.864 9.093 -0.229 25757 12145 1 15 . 1 1 65 65 PHE N N 65 118.583 118.583 121.089 -2.506 25757 12146 1 15 . 1 1 65 65 PHE HA H 65 3.860 3.860 3.994 -0.134 25757 12147 1 15 . 1 1 65 65 PHE C C 65 173.458 173.458 174.214 -0.756 25757 12148 1 15 . 1 1 65 65 PHE CA C 65 63.799 63.799 61.584 2.216 25757 12149 1 15 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.566 -0.687 25757 12150 1 15 . 1 1 65 65 PHE H H 65 8.962 8.962 8.955 0.007 25757 12151 1 15 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.625 0.493 25757 12152 1 15 . 1 1 66 66 PRO C C 66 180.038 180.038 178.533 1.505 25757 12153 1 15 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.011 1.679 25757 12154 1 15 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.839 -0.162 25757 12155 1 15 . 1 1 67 67 GLU N N 67 118.402 118.402 119.286 -0.884 25757 12156 1 15 . 1 1 67 67 GLU C C 67 178.737 178.737 178.887 -0.150 25757 12157 1 15 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.912 -0.904 25757 12158 1 15 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.229 0.456 25757 12159 1 15 . 1 1 67 67 GLU H H 67 7.953 7.953 8.336 -0.383 25757 12160 1 15 . 1 1 68 68 PHE N N 68 123.421 123.421 119.417 4.004 25757 12161 1 15 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.072 -0.100 25757 12162 1 15 . 1 1 68 68 PHE C C 68 177.184 177.184 177.383 -0.199 25757 12163 1 15 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.485 -0.147 25757 12164 1 15 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.050 0.920 25757 12165 1 15 . 1 1 68 68 PHE H H 68 8.928 8.928 7.481 1.447 25757 12166 1 15 . 1 1 69 69 LEU N N 69 119.284 119.284 119.295 -0.011 25757 12167 1 15 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.730 -0.395 25757 12168 1 15 . 1 1 69 69 LEU C C 69 178.987 178.987 178.181 0.806 25757 12169 1 15 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.820 -0.958 25757 12170 1 15 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.556 -0.723 25757 12171 1 15 . 1 1 69 69 LEU H H 69 8.374 8.374 7.429 0.945 25757 12172 1 15 . 1 1 70 70 THR N N 70 116.017 116.017 113.862 2.155 25757 12173 1 15 . 1 1 70 70 THR HA H 70 4.338 4.338 3.762 0.576 25757 12174 1 15 . 1 1 70 70 THR C C 70 176.169 176.169 176.739 -0.570 25757 12175 1 15 . 1 1 70 70 THR CA C 70 66.700 66.700 65.634 1.066 25757 12176 1 15 . 1 1 70 70 THR CB C 70 68.379 68.379 68.338 0.041 25757 12177 1 15 . 1 1 70 70 THR H H 70 7.493 7.493 8.155 -0.662 25757 12178 1 15 . 1 1 71 71 MET N N 71 121.915 121.915 122.111 -0.196 25757 12179 1 15 . 1 1 71 71 MET HA H 71 3.718 3.718 3.942 -0.224 25757 12180 1 15 . 1 1 71 71 MET C C 71 178.190 178.190 177.553 0.637 25757 12181 1 15 . 1 1 71 71 MET CA C 71 59.335 59.335 58.347 0.988 25757 12182 1 15 . 1 1 71 71 MET CB C 71 33.894 33.894 31.916 1.978 25757 12183 1 15 . 1 1 71 71 MET H H 71 7.924 7.924 7.929 -0.005 25757 12184 1 15 . 1 1 72 72 MET N N 72 116.973 116.973 116.930 0.043 25757 12185 1 15 . 1 1 72 72 MET HA H 72 3.968 3.968 4.068 -0.100 25757 12186 1 15 . 1 1 72 72 MET C C 72 178.211 178.211 178.510 -0.299 25757 12187 1 15 . 1 1 72 72 MET CA C 72 56.059 56.059 58.574 -2.515 25757 12188 1 15 . 1 1 72 72 MET CB C 72 31.639 31.639 32.860 -1.221 25757 12189 1 15 . 1 1 72 72 MET H H 72 8.276 8.276 7.752 0.524 25757 12190 1 15 . 1 1 73 73 ALA N N 73 122.499 122.499 121.691 0.808 25757 12191 1 15 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.828 0.122 25757 12192 1 15 . 1 1 73 73 ALA C C 73 180.231 180.231 179.489 0.742 25757 12193 1 15 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.921 0.032 25757 12194 1 15 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.589 0.443 25757 12195 1 15 . 1 1 73 73 ALA H H 73 8.240 8.240 8.373 -0.133 25757 12196 1 15 . 1 1 74 74 ARG N N 74 116.098 116.098 119.304 -3.206 25757 12197 1 15 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.982 0.010 25757 12198 1 15 . 1 1 74 74 ARG C C 74 178.567 178.567 178.407 0.160 25757 12199 1 15 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.010 -0.185 25757 12200 1 15 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.110 -0.035 25757 12201 1 15 . 1 1 74 74 ARG H H 74 7.420 7.420 8.154 -0.734 25757 12202 1 15 . 1 1 75 75 LYS N N 75 119.046 119.046 119.402 -0.356 25757 12203 1 15 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.097 -0.054 25757 12204 1 15 . 1 1 75 75 LYS C C 75 179.045 179.045 178.611 0.434 25757 12205 1 15 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.610 -0.721 25757 12206 1 15 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.621 0.145 25757 12207 1 15 . 1 1 75 75 LYS H H 75 7.862 7.862 8.228 -0.366 25757 12208 1 15 . 1 1 76 76 MET N N 76 116.772 116.772 120.313 -3.541 25757 12209 1 15 . 1 1 76 76 MET H H 76 8.099 8.099 8.211 -0.112 25757 12210 1 15 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.774 -0.140 25757 12211 1 15 . 1 1 78 78 ASP C C 78 176.395 176.395 176.336 0.059 25757 12212 1 15 . 1 1 78 78 ASP CA C 78 54.644 54.644 53.284 1.360 25757 12213 1 15 . 1 1 78 78 ASP CB C 78 41.474 41.474 42.173 -0.699 25757 12214 1 15 . 1 1 79 79 THR N N 79 113.904 113.904 110.500 3.404 25757 12215 1 15 . 1 1 79 79 THR HA H 79 4.215 4.215 4.278 -0.063 25757 12216 1 15 . 1 1 79 79 THR C C 79 174.204 174.204 174.429 -0.225 25757 12217 1 15 . 1 1 79 79 THR CA C 79 62.264 62.264 62.289 -0.025 25757 12218 1 15 . 1 1 79 79 THR CB C 79 69.884 69.884 69.124 0.761 25757 12219 1 15 . 1 1 79 79 THR H H 79 8.039 8.039 8.468 -0.429 25757 12220 1 15 . 1 1 80 80 ASP N N 80 123.572 123.572 123.564 0.008 25757 12221 1 15 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.713 0.007 25757 12222 1 15 . 1 1 80 80 ASP C C 80 176.221 176.221 176.668 -0.447 25757 12223 1 15 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.782 -0.467 25757 12224 1 15 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.008 1.419 25757 12225 1 15 . 1 1 80 80 ASP H H 80 8.441 8.441 8.069 0.372 25757 12226 1 15 . 1 1 81 81 SER N N 81 117.879 117.879 119.285 -1.406 25757 12227 1 15 . 1 1 81 81 SER HA H 81 3.925 3.925 4.318 -0.393 25757 12228 1 15 . 1 1 81 81 SER C C 81 175.264 175.264 176.148 -0.884 25757 12229 1 15 . 1 1 81 81 SER CA C 81 58.860 58.860 60.045 -1.185 25757 12230 1 15 . 1 1 81 81 SER CB C 81 63.790 63.790 64.106 -0.316 25757 12231 1 15 . 1 1 81 81 SER H H 81 8.503 8.503 8.106 0.397 25757 12232 1 15 . 1 1 82 82 GLU N N 82 123.206 123.206 123.321 -0.115 25757 12233 1 15 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.022 0.036 25757 12234 1 15 . 1 1 82 82 GLU C C 82 178.378 178.378 178.539 -0.161 25757 12235 1 15 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.018 -0.432 25757 12236 1 15 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.140 0.463 25757 12237 1 15 . 1 1 82 82 GLU H H 82 8.563 8.563 8.863 -0.300 25757 12238 1 15 . 1 1 83 83 GLU N N 83 119.262 119.262 119.073 0.189 25757 12239 1 15 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.984 -0.027 25757 12240 1 15 . 1 1 83 83 GLU C C 83 178.606 178.606 178.512 0.094 25757 12241 1 15 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.535 0.134 25757 12242 1 15 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.226 0.129 25757 12243 1 15 . 1 1 83 83 GLU H H 83 7.728 7.728 8.657 -0.929 25757 12244 1 15 . 1 1 84 84 GLU N N 84 118.432 118.432 118.984 -0.552 25757 12245 1 15 . 1 1 84 84 GLU HA H 84 4.107 4.107 3.995 0.112 25757 12246 1 15 . 1 1 84 84 GLU C C 84 179.436 179.436 179.076 0.360 25757 12247 1 15 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.017 0.486 25757 12248 1 15 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.211 -0.104 25757 12249 1 15 . 1 1 84 84 GLU H H 84 8.346 8.346 8.082 0.264 25757 12250 1 15 . 1 1 85 85 ILE N N 85 120.925 120.925 121.464 -0.539 25757 12251 1 15 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.871 -0.123 25757 12252 1 15 . 1 1 85 85 ILE C C 85 177.661 177.661 178.419 -0.758 25757 12253 1 15 . 1 1 85 85 ILE CA C 85 65.490 65.490 63.930 1.560 25757 12254 1 15 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.812 0.619 25757 12255 1 15 . 1 1 85 85 ILE H H 85 7.821 7.821 8.371 -0.550 25757 12256 1 15 . 1 1 86 86 ARG N N 86 121.916 121.916 119.348 2.568 25757 12257 1 15 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.848 0.288 25757 12258 1 15 . 1 1 86 86 ARG C C 86 179.208 179.208 178.672 0.536 25757 12259 1 15 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.827 0.544 25757 12260 1 15 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.912 0.186 25757 12261 1 15 . 1 1 86 86 ARG H H 86 8.432 8.432 8.178 0.254 25757 12262 1 15 . 1 1 87 87 GLU N N 87 118.261 118.261 118.649 -0.388 25757 12263 1 15 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.922 0.190 25757 12264 1 15 . 1 1 87 87 GLU C C 87 178.516 178.516 178.269 0.247 25757 12265 1 15 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.013 0.012 25757 12266 1 15 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.068 0.102 25757 12267 1 15 . 1 1 87 87 GLU H H 87 8.225 8.225 8.065 0.160 25757 12268 1 15 . 1 1 88 88 ALA N N 88 121.009 121.009 122.381 -1.372 25757 12269 1 15 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.507 0.320 25757 12270 1 15 . 1 1 88 88 ALA C C 88 177.947 177.947 178.170 -0.223 25757 12271 1 15 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.966 -0.105 25757 12272 1 15 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.261 -0.306 25757 12273 1 15 . 1 1 88 88 ALA H H 88 7.789 7.789 7.876 -0.087 25757 12274 1 15 . 1 1 89 89 PHE N N 89 117.164 117.164 118.596 -1.432 25757 12275 1 15 . 1 1 89 89 PHE C C 89 176.134 176.134 177.450 -1.316 25757 12276 1 15 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.616 2.034 25757 12277 1 15 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.808 0.085 25757 12278 1 15 . 1 1 89 89 PHE H H 89 8.337 8.337 7.650 0.687 25757 12279 1 15 . 1 1 90 90 ARG N N 90 114.900 114.900 117.753 -2.853 25757 12280 1 15 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.956 -0.042 25757 12281 1 15 . 1 1 90 90 ARG C C 90 178.296 178.296 177.396 0.900 25757 12282 1 15 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.822 0.257 25757 12283 1 15 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.632 -0.539 25757 12284 1 15 . 1 1 90 90 ARG H H 90 7.681 7.681 7.723 -0.042 25757 12285 1 15 . 1 1 91 91 VAL N N 91 116.927 116.927 115.601 1.326 25757 12286 1 15 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.904 -0.297 25757 12287 1 15 . 1 1 91 91 VAL C C 91 177.964 177.964 177.137 0.827 25757 12288 1 15 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.835 1.125 25757 12289 1 15 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.345 0.274 25757 12290 1 15 . 1 1 91 91 VAL H H 91 7.405 7.405 7.545 -0.140 25757 12291 1 15 . 1 1 92 92 PHE N N 92 119.026 119.026 117.359 1.667 25757 12292 1 15 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.312 0.050 25757 12293 1 15 . 1 1 92 92 PHE C C 92 177.639 177.639 176.280 1.359 25757 12294 1 15 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.529 -0.808 25757 12295 1 15 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.618 -0.191 25757 12296 1 15 . 1 1 92 92 PHE H H 92 7.886 7.886 7.491 0.395 25757 12297 1 15 . 1 1 93 93 ASP N N 93 118.238 118.238 118.740 -0.502 25757 12298 1 15 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.962 -0.500 25757 12299 1 15 . 1 1 93 93 ASP C C 93 176.979 176.979 176.787 0.192 25757 12300 1 15 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.136 -0.988 25757 12301 1 15 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.608 -1.459 25757 12302 1 15 . 1 1 93 93 ASP H H 93 8.009 8.009 7.435 0.574 25757 12303 1 15 . 1 1 94 94 LYS N N 94 125.792 125.792 125.477 0.315 25757 12304 1 15 . 1 1 94 94 LYS C C 94 178.213 178.213 177.654 0.559 25757 12305 1 15 . 1 1 94 94 LYS CA C 94 59.318 59.318 59.039 0.279 25757 12306 1 15 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.592 -1.564 25757 12307 1 15 . 1 1 94 94 LYS H H 94 7.428 7.428 8.148 -0.720 25757 12308 1 15 . 1 1 95 95 ASP N N 95 113.833 113.833 115.349 -1.516 25757 12309 1 15 . 1 1 95 95 ASP C C 95 177.718 177.718 176.998 0.720 25757 12310 1 15 . 1 1 95 95 ASP CA C 95 52.945 52.945 53.950 -1.005 25757 12311 1 15 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.559 -0.816 25757 12312 1 15 . 1 1 95 95 ASP H H 95 8.159 8.159 7.903 0.256 25757 12313 1 15 . 1 1 96 96 GLY N N 96 109.414 109.414 107.594 1.820 25757 12314 1 15 . 1 1 96 96 GLY C C 96 175.093 175.093 175.372 -0.279 25757 12315 1 15 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.961 1.294 25757 12316 1 15 . 1 1 96 96 GLY H H 96 7.848 7.848 7.514 0.334 25757 12317 1 15 . 1 1 97 97 ASN N N 97 119.590 119.590 117.927 1.663 25757 12318 1 15 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.493 0.119 25757 12319 1 15 . 1 1 97 97 ASN C C 97 175.937 175.937 176.505 -0.568 25757 12320 1 15 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.690 -0.802 25757 12321 1 15 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.491 -1.171 25757 12322 1 15 . 1 1 97 97 ASN H H 97 8.338 8.338 8.922 -0.584 25757 12323 1 15 . 1 1 98 98 GLY N N 98 112.940 112.940 107.821 5.119 25757 12324 1 15 . 1 1 98 98 GLY C C 98 172.429 172.429 172.670 -0.241 25757 12325 1 15 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.987 0.105 25757 12326 1 15 . 1 1 98 98 GLY H H 98 10.695 10.695 8.246 2.449 25757 12327 1 15 . 1 1 99 99 TYR N N 99 115.544 115.544 117.867 -2.323 25757 12328 1 15 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.495 -0.408 25757 12329 1 15 . 1 1 99 99 TYR C C 99 174.859 174.859 174.708 0.151 25757 12330 1 15 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.138 -1.120 25757 12331 1 15 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.390 0.963 25757 12332 1 15 . 1 1 99 99 TYR H H 99 7.597 7.597 8.187 -0.590 25757 12333 1 15 . 1 1 100 100 ILE N N 100 127.078 127.078 124.061 3.017 25757 12334 1 15 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.742 0.047 25757 12335 1 15 . 1 1 100 100 ILE C C 100 175.387 175.387 175.988 -0.601 25757 12336 1 15 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.762 0.244 25757 12337 1 15 . 1 1 100 100 ILE CB C 100 38.790 38.790 40.209 -1.419 25757 12338 1 15 . 1 1 100 100 ILE H H 100 10.267 10.267 9.430 0.837 25757 12339 1 15 . 1 1 101 101 SER N N 101 124.102 124.102 122.198 1.904 25757 12340 1 15 . 1 1 101 101 SER HA H 101 4.417 4.417 5.048 -0.631 25757 12341 1 15 . 1 1 101 101 SER C C 101 175.360 175.360 175.143 0.217 25757 12342 1 15 . 1 1 101 101 SER CA C 101 56.036 56.036 56.843 -0.807 25757 12343 1 15 . 1 1 101 101 SER CB C 101 66.896 66.896 65.569 1.328 25757 12344 1 15 . 1 1 101 101 SER H H 101 8.985 8.985 8.771 0.214 25757 12345 1 15 . 1 1 102 102 ALA N N 102 122.780 122.780 124.777 -1.997 25757 12346 1 15 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.919 -0.175 25757 12347 1 15 . 1 1 102 102 ALA C C 102 179.175 179.175 178.399 0.776 25757 12348 1 15 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.681 0.609 25757 12349 1 15 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.341 -0.314 25757 12350 1 15 . 1 1 102 102 ALA H H 102 9.269 9.269 9.158 0.111 25757 12351 1 15 . 1 1 103 103 ALA N N 103 118.513 118.513 120.629 -2.116 25757 12352 1 15 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.736 0.275 25757 12353 1 15 . 1 1 103 103 ALA C C 103 181.521 181.521 179.474 2.047 25757 12354 1 15 . 1 1 103 103 ALA CA C 103 55.354 55.354 54.997 0.357 25757 12355 1 15 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.282 0.010 25757 12356 1 15 . 1 1 103 103 ALA H H 103 8.321 8.321 8.305 0.016 25757 12357 1 15 . 1 1 104 104 GLU N N 104 119.550 119.550 118.963 0.587 25757 12358 1 15 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.094 -0.088 25757 12359 1 15 . 1 1 104 104 GLU C C 104 179.750 179.750 179.074 0.676 25757 12360 1 15 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.973 -0.804 25757 12361 1 15 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.354 -0.139 25757 12362 1 15 . 1 1 104 104 GLU H H 104 7.867 7.867 8.391 -0.524 25757 12363 1 15 . 1 1 105 105 LEU N N 105 122.688 122.688 120.332 2.356 25757 12364 1 15 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.866 0.052 25757 12365 1 15 . 1 1 105 105 LEU C C 105 178.233 178.233 178.225 0.008 25757 12366 1 15 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.094 -0.360 25757 12367 1 15 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.834 0.186 25757 12368 1 15 . 1 1 105 105 LEU H H 105 8.746 8.746 8.029 0.717 25757 12369 1 15 . 1 1 106 106 ARG N N 106 118.835 118.835 117.999 0.836 25757 12370 1 15 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.742 -0.092 25757 12371 1 15 . 1 1 106 106 ARG C C 106 178.742 178.742 178.529 0.213 25757 12372 1 15 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.310 0.652 25757 12373 1 15 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.249 0.797 25757 12374 1 15 . 1 1 106 106 ARG H H 106 8.684 8.684 8.310 0.374 25757 12375 1 15 . 1 1 107 107 HIS N N 107 119.258 119.258 119.190 0.068 25757 12376 1 15 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.463 -0.196 25757 12377 1 15 . 1 1 107 107 HIS C C 107 177.244 177.244 177.969 -0.725 25757 12378 1 15 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.558 1.594 25757 12379 1 15 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.639 0.936 25757 12380 1 15 . 1 1 107 107 HIS H H 107 7.691 7.691 8.062 -0.371 25757 12381 1 15 . 1 1 108 108 VAL N N 108 118.996 118.996 121.006 -2.010 25757 12382 1 15 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.874 -0.436 25757 12383 1 15 . 1 1 108 108 VAL C C 108 177.998 177.998 178.329 -0.331 25757 12384 1 15 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.197 0.234 25757 12385 1 15 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.572 -0.148 25757 12386 1 15 . 1 1 108 108 VAL H H 108 7.599 7.599 8.176 -0.577 25757 12387 1 15 . 1 1 109 109 MET N N 109 114.880 114.880 119.030 -4.150 25757 12388 1 15 . 1 1 109 109 MET C C 109 179.119 179.119 177.307 1.812 25757 12389 1 15 . 1 1 109 109 MET CA C 109 56.979 56.979 57.795 -0.816 25757 12390 1 15 . 1 1 109 109 MET CB C 109 29.253 29.253 32.732 -3.479 25757 12391 1 15 . 1 1 109 109 MET H H 109 7.911 7.911 8.306 -0.395 25757 12392 1 15 . 1 1 110 110 THR N N 110 116.943 116.943 116.682 0.261 25757 12393 1 15 . 1 1 110 110 THR HA H 110 4.229 4.229 3.949 0.280 25757 12394 1 15 . 1 1 110 110 THR C C 110 178.506 178.506 177.333 1.173 25757 12395 1 15 . 1 1 110 110 THR CA C 110 66.573 66.573 66.426 0.147 25757 12396 1 15 . 1 1 110 110 THR CB C 110 68.575 68.575 68.776 -0.201 25757 12397 1 15 . 1 1 110 110 THR H H 110 8.353 8.353 8.155 0.198 25757 12398 1 15 . 1 1 111 111 ASN N N 111 123.829 123.829 120.223 3.606 25757 12399 1 15 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.443 -0.081 25757 12400 1 15 . 1 1 111 111 ASN C C 111 177.197 177.197 177.184 0.013 25757 12401 1 15 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.996 -0.037 25757 12402 1 15 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.414 -1.191 25757 12403 1 15 . 1 1 111 111 ASN H H 111 8.053 8.053 8.404 -0.351 25757 12404 1 15 . 1 1 112 112 LEU N N 112 119.036 119.036 118.290 0.746 25757 12405 1 15 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.114 0.056 25757 12406 1 15 . 1 1 112 112 LEU C C 112 176.377 176.377 177.720 -1.343 25757 12407 1 15 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.359 -0.854 25757 12408 1 15 . 1 1 112 112 LEU CB C 112 42.360 42.360 41.464 0.896 25757 12409 1 15 . 1 1 112 112 LEU H H 112 7.794 7.794 7.687 0.107 25757 12410 1 15 . 1 1 113 113 GLY N N 113 106.045 106.045 106.103 -0.058 25757 12411 1 15 . 1 1 113 113 GLY C C 113 174.248 174.248 174.247 0.001 25757 12412 1 15 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.651 0.656 25757 12413 1 15 . 1 1 113 113 GLY H H 113 7.741 7.741 7.615 0.126 25757 12414 1 15 . 1 1 114 114 GLU N N 114 120.556 120.556 122.964 -2.408 25757 12415 1 15 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.078 0.232 25757 12416 1 15 . 1 1 114 114 GLU C C 114 174.993 174.993 176.161 -1.168 25757 12417 1 15 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.302 -1.665 25757 12418 1 15 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.365 1.852 25757 12419 1 15 . 1 1 114 114 GLU H H 114 7.980 7.980 7.948 0.032 25757 12420 1 15 . 1 1 115 115 LYS N N 115 124.986 124.986 126.239 -1.253 25757 12421 1 15 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.196 0.138 25757 12422 1 15 . 1 1 115 115 LYS C C 115 175.285 175.285 175.867 -0.582 25757 12423 1 15 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.951 -1.370 25757 12424 1 15 . 1 1 115 115 LYS CB C 115 31.973 31.973 33.025 -1.052 25757 12425 1 15 . 1 1 115 115 LYS H H 115 8.613 8.613 8.337 0.276 25757 12426 1 15 . 1 1 116 116 LEU N N 116 125.243 125.243 121.226 4.017 25757 12427 1 15 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.751 -0.063 25757 12428 1 15 . 1 1 116 116 LEU C C 116 178.365 178.365 174.581 3.784 25757 12429 1 15 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.764 0.584 25757 12430 1 15 . 1 1 116 116 LEU CB C 116 44.289 44.289 43.345 0.944 25757 12431 1 15 . 1 1 116 116 LEU H H 116 8.066 8.066 8.270 -0.204 25757 12432 1 15 . 1 1 117 117 THR N N 117 114.324 114.324 111.755 2.569 25757 12433 1 15 . 1 1 117 117 THR HA H 117 4.713 4.713 4.537 0.176 25757 12434 1 15 . 1 1 117 117 THR C C 117 175.539 175.539 175.007 0.532 25757 12435 1 15 . 1 1 117 117 THR CA C 117 60.756 60.756 60.398 0.358 25757 12436 1 15 . 1 1 117 117 THR CB C 117 71.144 71.144 71.322 -0.178 25757 12437 1 15 . 1 1 117 117 THR H H 117 9.228 9.228 7.936 1.292 25757 12438 1 15 . 1 1 118 118 ASP N N 118 121.016 121.016 121.582 -0.566 25757 12439 1 15 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.268 -0.113 25757 12440 1 15 . 1 1 118 118 ASP H H 118 8.919 8.919 8.655 0.264 25757 12441 1 15 . 1 1 119 119 GLU N N 119 121.016 121.016 118.993 2.023 25757 12442 1 15 . 1 1 119 119 GLU C C 119 179.204 179.204 178.443 0.761 25757 12443 1 15 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.410 -1.340 25757 12444 1 15 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.487 -0.443 25757 12445 1 15 . 1 1 119 119 GLU H H 119 8.919 8.919 8.634 0.285 25757 12446 1 15 . 1 1 120 120 GLU N N 120 120.566 120.566 120.308 0.258 25757 12447 1 15 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.966 0.035 25757 12448 1 15 . 1 1 120 120 GLU C C 120 180.329 180.329 178.777 1.552 25757 12449 1 15 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.162 -0.071 25757 12450 1 15 . 1 1 120 120 GLU CB C 120 30.638 30.638 28.954 1.684 25757 12451 1 15 . 1 1 120 120 GLU H H 120 7.732 7.732 7.513 0.219 25757 12452 1 15 . 1 1 121 121 VAL N N 121 121.875 121.875 119.021 2.854 25757 12453 1 15 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.535 -0.070 25757 12454 1 15 . 1 1 121 121 VAL C C 121 177.477 177.477 177.951 -0.474 25757 12455 1 15 . 1 1 121 121 VAL CA C 121 67.171 67.171 67.016 0.155 25757 12456 1 15 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.047 0.387 25757 12457 1 15 . 1 1 121 121 VAL H H 121 8.104 8.104 7.402 0.702 25757 12458 1 15 . 1 1 122 122 ASP N N 122 120.566 120.566 119.692 0.874 25757 12459 1 15 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.223 0.112 25757 12460 1 15 . 1 1 122 122 ASP C C 122 179.298 179.298 178.307 0.991 25757 12461 1 15 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.887 -0.048 25757 12462 1 15 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.891 -0.578 25757 12463 1 15 . 1 1 122 122 ASP H H 122 8.089 8.089 8.173 -0.084 25757 12464 1 15 . 1 1 123 123 GLU N N 123 119.821 119.821 119.318 0.503 25757 12465 1 15 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.050 -0.001 25757 12466 1 15 . 1 1 123 123 GLU C C 123 178.749 178.749 179.106 -0.357 25757 12467 1 15 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.111 0.207 25757 12468 1 15 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.712 -0.326 25757 12469 1 15 . 1 1 123 123 GLU H H 123 8.105 8.105 8.241 -0.136 25757 12470 1 15 . 1 1 124 124 MET N N 124 119.288 119.288 119.449 -0.161 25757 12471 1 15 . 1 1 124 124 MET C C 124 180.865 180.865 179.225 1.640 25757 12472 1 15 . 1 1 124 124 MET CA C 124 60.684 60.684 59.672 1.012 25757 12473 1 15 . 1 1 124 124 MET CB C 124 33.141 33.141 32.553 0.588 25757 12474 1 15 . 1 1 124 124 MET H H 124 7.726 7.726 8.045 -0.319 25757 12475 1 15 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.060 -0.331 25757 12476 1 15 . 1 1 125 125 ILE C C 125 177.341 177.341 178.085 -0.744 25757 12477 1 15 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.565 0.236 25757 12478 1 15 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.869 -1.304 25757 12479 1 15 . 1 1 126 126 ARG N N 126 118.555 118.555 119.976 -1.421 25757 12480 1 15 . 1 1 126 126 ARG C C 126 179.164 179.164 177.869 1.295 25757 12481 1 15 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.418 0.506 25757 12482 1 15 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.948 -0.083 25757 12483 1 15 . 1 1 126 126 ARG H H 126 8.380 8.380 8.423 -0.043 25757 12484 1 15 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.370 -0.445 25757 12485 1 15 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.784 1.273 25757 12486 1 15 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.145 0.683 25757 12487 1 15 . 1 1 128 128 ALA N N 128 116.764 116.764 120.647 -3.883 25757 12488 1 15 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.075 0.342 25757 12489 1 15 . 1 1 128 128 ALA C C 128 177.885 177.885 177.352 0.533 25757 12490 1 15 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.524 -1.569 25757 12491 1 15 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.475 3.092 25757 12492 1 15 . 1 1 128 128 ALA H H 128 7.152 7.152 7.819 -0.667 25757 12493 1 15 . 1 1 129 129 ASP N N 129 117.762 117.762 118.490 -0.728 25757 12494 1 15 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.057 -0.580 25757 12495 1 15 . 1 1 129 129 ASP C C 129 175.935 175.935 176.816 -0.881 25757 12496 1 15 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.564 1.951 25757 12497 1 15 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.651 -0.906 25757 12498 1 15 . 1 1 129 129 ASP H H 129 8.007 8.007 8.018 -0.011 25757 12499 1 15 . 1 1 130 130 ILE N N 130 128.249 128.249 120.691 7.558 25757 12500 1 15 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.148 -0.284 25757 12501 1 15 . 1 1 130 130 ILE C C 130 177.764 177.764 176.130 1.634 25757 12502 1 15 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.344 1.204 25757 12503 1 15 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.696 0.952 25757 12504 1 15 . 1 1 130 130 ILE H H 130 8.412 8.412 8.260 0.152 25757 12505 1 15 . 1 1 131 131 ASP N N 131 116.430 116.430 120.150 -3.720 25757 12506 1 15 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.688 -0.154 25757 12507 1 15 . 1 1 131 131 ASP C C 131 178.313 178.313 176.836 1.477 25757 12508 1 15 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.528 -0.644 25757 12509 1 15 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.482 -1.520 25757 12510 1 15 . 1 1 131 131 ASP H H 131 8.254 8.254 7.932 0.322 25757 12511 1 15 . 1 1 132 132 GLY N N 132 108.460 108.460 109.566 -1.106 25757 12512 1 15 . 1 1 132 132 GLY C C 132 175.211 175.211 174.893 0.318 25757 12513 1 15 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.128 1.475 25757 12514 1 15 . 1 1 132 132 GLY H H 132 7.547 7.547 7.717 -0.170 25757 12515 1 15 . 1 1 133 133 ASP N N 133 120.909 120.909 119.717 1.192 25757 12516 1 15 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.558 -0.095 25757 12517 1 15 . 1 1 133 133 ASP C C 133 177.691 177.691 177.782 -0.091 25757 12518 1 15 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.517 0.297 25757 12519 1 15 . 1 1 133 133 ASP CB C 133 40.298 40.298 41.520 -1.222 25757 12520 1 15 . 1 1 133 133 ASP H H 133 8.339 8.339 8.710 -0.371 25757 12521 1 15 . 1 1 134 134 GLY N N 134 112.704 112.704 108.203 4.501 25757 12522 1 15 . 1 1 134 134 GLY C C 134 172.722 172.722 173.300 -0.578 25757 12523 1 15 . 1 1 134 134 GLY CA C 134 46.037 46.037 44.877 1.159 25757 12524 1 15 . 1 1 134 134 GLY H H 134 10.396 10.396 7.969 2.427 25757 12525 1 15 . 1 1 135 135 GLN N N 135 114.799 114.799 118.574 -3.775 25757 12526 1 15 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.258 -0.394 25757 12527 1 15 . 1 1 135 135 GLN C C 135 174.760 174.760 174.857 -0.097 25757 12528 1 15 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.791 -1.470 25757 12529 1 15 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.381 -1.316 25757 12530 1 15 . 1 1 135 135 GLN H H 135 7.975 7.975 8.613 -0.638 25757 12531 1 15 . 1 1 136 136 VAL N N 136 125.364 125.364 125.212 0.152 25757 12532 1 15 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.742 0.466 25757 12533 1 15 . 1 1 136 136 VAL C C 136 175.831 175.831 175.505 0.326 25757 12534 1 15 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.478 0.339 25757 12535 1 15 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.800 0.874 25757 12536 1 15 . 1 1 136 136 VAL H H 136 9.169 9.169 9.104 0.065 25757 12537 1 15 . 1 1 137 137 ASN N N 137 129.155 129.155 125.135 4.020 25757 12538 1 15 . 1 1 137 137 ASN C C 137 174.737 174.737 175.468 -0.731 25757 12539 1 15 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.856 0.495 25757 12540 1 15 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.609 -3.286 25757 12541 1 15 . 1 1 137 137 ASN H H 137 9.652 9.652 8.813 0.839 25757 12542 1 15 . 1 1 138 138 TYR N N 138 118.504 118.504 123.708 -5.204 25757 12543 1 15 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.581 -0.302 25757 12544 1 15 . 1 1 138 138 TYR C C 138 176.174 176.174 176.635 -0.461 25757 12545 1 15 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.970 0.604 25757 12546 1 15 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.307 -0.577 25757 12547 1 15 . 1 1 138 138 TYR H H 138 8.460 8.460 8.759 -0.299 25757 12548 1 15 . 1 1 139 139 GLU N N 139 118.644 118.644 118.990 -0.346 25757 12549 1 15 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.780 -0.232 25757 12550 1 15 . 1 1 139 139 GLU C C 139 180.265 180.265 178.141 2.124 25757 12551 1 15 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.953 0.533 25757 12552 1 15 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.920 0.071 25757 12553 1 15 . 1 1 139 139 GLU H H 139 8.136 8.136 8.833 -0.697 25757 12554 1 15 . 1 1 140 140 GLU N N 140 120.030 120.030 116.774 3.256 25757 12555 1 15 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.087 -0.199 25757 12556 1 15 . 1 1 140 140 GLU C C 140 179.627 179.627 178.139 1.488 25757 12557 1 15 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.834 0.842 25757 12558 1 15 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.099 0.628 25757 12559 1 15 . 1 1 140 140 GLU H H 140 8.798 8.798 8.060 0.738 25757 12560 1 15 . 1 1 141 141 PHE N N 141 123.154 123.154 122.457 0.697 25757 12561 1 15 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.801 -0.104 25757 12562 1 15 . 1 1 141 141 PHE C C 141 176.952 176.952 177.101 -0.149 25757 12563 1 15 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.446 0.606 25757 12564 1 15 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.067 1.064 25757 12565 1 15 . 1 1 141 141 PHE H H 141 8.633 8.633 8.033 0.600 25757 12566 1 15 . 1 1 142 142 VAL N N 142 120.046 120.046 113.917 6.129 25757 12567 1 15 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.635 -0.679 25757 12568 1 15 . 1 1 142 142 VAL C C 142 179.627 179.627 177.437 2.190 25757 12569 1 15 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.653 1.590 25757 12570 1 15 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.458 -0.318 25757 12571 1 15 . 1 1 142 142 VAL H H 142 8.894 8.894 7.655 1.239 25757 12572 1 15 . 1 1 143 143 GLN N N 143 118.996 118.996 118.950 0.046 25757 12573 1 15 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.124 -0.348 25757 12574 1 15 . 1 1 143 143 GLN C C 143 178.443 178.443 177.871 0.572 25757 12575 1 15 . 1 1 143 143 GLN CA C 143 59.129 59.129 57.459 1.670 25757 12576 1 15 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.962 -1.219 25757 12577 1 15 . 1 1 143 143 GLN H H 143 7.627 7.627 7.258 0.369 25757 12578 1 15 . 1 1 144 144 MET N N 144 116.361 116.361 119.489 -3.128 25757 12579 1 15 . 1 1 144 144 MET HA H 144 4.169 4.169 4.116 0.053 25757 12580 1 15 . 1 1 144 144 MET C C 144 178.418 178.418 175.522 2.896 25757 12581 1 15 . 1 1 144 144 MET CA C 144 56.137 56.137 57.829 -1.692 25757 12582 1 15 . 1 1 144 144 MET CB C 144 31.095 31.095 32.224 -1.129 25757 12583 1 15 . 1 1 144 144 MET H H 144 7.179 7.179 7.689 -0.510 25757 12584 1 15 . 1 1 145 145 MET N N 145 115.373 115.373 110.437 4.936 25757 12585 1 15 . 1 1 145 145 MET HA H 145 4.334 4.334 4.657 -0.323 25757 12586 1 15 . 1 1 145 145 MET C C 145 177.217 177.217 176.026 1.191 25757 12587 1 15 . 1 1 145 145 MET CA C 145 55.296 55.296 54.181 1.115 25757 12588 1 15 . 1 1 145 145 MET CB C 145 34.458 34.458 32.881 1.577 25757 12589 1 15 . 1 1 145 145 MET H H 145 7.776 7.776 7.153 0.623 25757 12590 1 15 . 1 1 146 146 THR N N 146 107.988 107.988 112.667 -4.679 25757 12591 1 15 . 1 1 146 146 THR HA H 146 4.239 4.239 4.451 -0.212 25757 12592 1 15 . 1 1 146 146 THR C C 146 175.378 175.378 175.157 0.221 25757 12593 1 15 . 1 1 146 146 THR CA C 146 61.625 61.625 61.650 -0.025 25757 12594 1 15 . 1 1 146 146 THR CB C 146 70.817 70.817 68.523 2.294 25757 12595 1 15 . 1 1 146 146 THR H H 146 7.736 7.736 7.492 0.243 25757 12596 1 15 . 1 1 147 147 GLY N N 147 110.157 110.157 109.609 0.548 25757 12597 1 15 . 1 1 147 147 GLY C C 147 174.046 174.046 174.321 -0.275 25757 12598 1 15 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.694 0.850 25757 12599 1 15 . 1 1 147 147 GLY H H 147 7.793 7.793 8.081 -0.288 25757 12600 1 15 . 1 1 150 150 THR HA H 150 4.239 4.239 4.443 -0.204 25757 12601 1 15 . 1 1 150 150 THR C C 150 174.397 174.397 173.904 0.493 25757 12602 1 15 . 1 1 150 150 THR CA C 150 61.260 61.260 62.226 -0.966 25757 12603 1 15 . 1 1 150 150 THR CB C 150 70.358 70.358 69.728 0.630 25757 12604 1 15 . 1 1 151 151 ALA N N 151 126.304 126.304 123.947 2.357 25757 12605 1 15 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.268 0.020 25757 12606 1 15 . 1 1 151 151 ALA C C 151 177.678 177.678 177.687 -0.009 25757 12607 1 15 . 1 1 151 151 ALA CA C 151 52.148 52.148 52.241 -0.093 25757 12608 1 15 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.529 -0.110 25757 12609 1 15 . 1 1 151 151 ALA H H 151 8.618 8.618 7.586 1.032 25757 12610 1 15 . 1 1 152 152 ALA N N 152 123.861 123.861 121.291 2.570 25757 12611 1 15 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.349 -0.231 25757 12612 1 15 . 1 1 152 152 ALA C C 152 178.823 178.823 178.271 0.552 25757 12613 1 15 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.519 1.975 25757 12614 1 15 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.110 0.647 25757 12615 1 15 . 1 1 152 152 ALA H H 152 8.354 8.354 8.742 -0.388 25757 12616 1 15 . 1 1 153 153 GLY N N 153 109.984 109.984 107.500 2.484 25757 12617 1 15 . 1 1 153 153 GLY C C 153 174.389 174.389 175.689 -1.300 25757 12618 1 15 . 1 1 153 153 GLY CA C 153 45.131 45.131 46.999 -1.868 25757 12619 1 15 . 1 1 153 153 GLY H H 153 9.028 9.028 8.296 0.732 25757 12620 1 15 . 1 1 154 154 SER N N 154 113.934 113.934 118.800 -4.866 25757 12621 1 15 . 1 1 154 154 SER HA H 154 4.255 4.255 3.986 0.269 25757 12622 1 15 . 1 1 154 154 SER C C 154 177.929 177.929 176.638 1.291 25757 12623 1 15 . 1 1 154 154 SER CA C 154 59.379 59.379 62.017 -2.638 25757 12624 1 15 . 1 1 154 154 SER CB C 154 64.090 64.090 62.715 1.375 25757 12625 1 15 . 1 1 154 154 SER H H 154 7.962 7.962 8.188 -0.226 25757 12626 1 15 . 1 1 155 155 GLY N N 155 115.337 115.337 109.027 6.310 25757 12627 1 15 . 1 1 155 155 GLY C C 155 175.891 175.891 175.397 0.494 25757 12628 1 15 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.708 0.938 25757 12629 1 15 . 1 1 155 155 GLY H H 155 9.451 9.451 7.725 1.726 25757 12630 1 15 . 1 1 156 156 TRP N N 156 119.600 119.600 121.975 -2.375 25757 12631 1 15 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.290 -0.019 25757 12632 1 15 . 1 1 156 156 TRP C C 156 178.947 178.947 179.045 -0.098 25757 12633 1 15 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.397 -0.233 25757 12634 1 15 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.017 0.586 25757 12635 1 15 . 1 1 156 156 TRP H H 156 8.542 8.542 7.346 1.196 25757 12636 1 15 . 1 1 157 157 ARG N N 157 118.583 118.583 118.412 0.171 25757 12637 1 15 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.009 -0.027 25757 12638 1 15 . 1 1 157 157 ARG C C 157 177.894 177.894 178.798 -0.904 25757 12639 1 15 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.283 0.055 25757 12640 1 15 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.730 0.327 25757 12641 1 15 . 1 1 157 157 ARG H H 157 7.747 7.747 8.557 -0.810 25757 12642 1 15 . 1 1 158 158 LYS N N 158 117.033 117.033 120.446 -3.413 25757 12643 1 15 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.100 -0.157 25757 12644 1 15 . 1 1 158 158 LYS C C 158 176.973 176.973 179.052 -2.079 25757 12645 1 15 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.556 0.818 25757 12646 1 15 . 1 1 158 158 LYS CB C 158 32.291 32.291 31.929 0.362 25757 12647 1 15 . 1 1 158 158 LYS H H 158 7.529 7.529 8.118 -0.589 25757 12648 1 15 . 1 1 159 159 ILE N N 159 116.553 116.553 121.003 -4.450 25757 12649 1 15 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.673 -0.129 25757 12650 1 15 . 1 1 159 159 ILE C C 159 176.894 176.894 177.442 -0.548 25757 12651 1 15 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.147 0.369 25757 12652 1 15 . 1 1 159 159 ILE CB C 159 37.804 37.804 37.866 -0.062 25757 12653 1 15 . 1 1 159 159 ILE H H 159 7.348 7.348 8.175 -0.827 25757 12654 1 15 . 1 1 160 160 LYS N N 160 119.278 119.278 120.360 -1.082 25757 12655 1 15 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.317 -0.278 25757 12656 1 15 . 1 1 160 160 LYS C C 160 178.566 178.566 179.202 -0.636 25757 12657 1 15 . 1 1 160 160 LYS CA C 160 60.374 60.374 60.127 0.247 25757 12658 1 15 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.557 0.261 25757 12659 1 15 . 1 1 160 160 LYS H H 160 8.225 8.225 8.141 0.084 25757 12660 1 15 . 1 1 161 161 LEU N N 161 117.056 117.056 119.333 -2.277 25757 12661 1 15 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.176 -0.116 25757 12662 1 15 . 1 1 161 161 LEU C C 161 178.977 178.977 178.901 0.076 25757 12663 1 15 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.016 0.008 25757 12664 1 15 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.931 0.051 25757 12665 1 15 . 1 1 161 161 LEU H H 161 8.057 8.057 8.405 -0.348 25757 12666 1 15 . 1 1 162 162 ALA N N 162 121.814 121.814 122.880 -1.066 25757 12667 1 15 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.088 0.004 25757 12668 1 15 . 1 1 162 162 ALA C C 162 178.374 178.374 179.579 -1.205 25757 12669 1 15 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.100 0.690 25757 12670 1 15 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.416 -0.091 25757 12671 1 15 . 1 1 162 162 ALA H H 162 8.170 8.170 8.232 -0.062 25757 12672 1 15 . 1 1 163 163 VAL N N 163 115.449 115.449 119.443 -3.994 25757 12673 1 15 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.859 -0.241 25757 12674 1 15 . 1 1 163 163 VAL C C 163 178.362 178.362 178.123 0.239 25757 12675 1 15 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.594 0.678 25757 12676 1 15 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.459 0.578 25757 12677 1 15 . 1 1 163 163 VAL H H 163 8.499 8.499 8.179 0.320 25757 12678 1 15 . 1 1 164 164 ARG N N 164 115.775 115.775 119.760 -3.985 25757 12679 1 15 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.159 0.038 25757 12680 1 15 . 1 1 164 164 ARG C C 164 178.938 178.938 178.151 0.787 25757 12681 1 15 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.168 -1.485 25757 12682 1 15 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.154 -0.320 25757 12683 1 15 . 1 1 164 164 ARG H H 164 8.165 8.165 8.427 -0.262 25757 12684 1 15 . 1 1 165 165 GLY N N 165 105.570 105.570 104.711 0.859 25757 12685 1 15 . 1 1 165 165 GLY C C 165 173.134 173.134 175.627 -2.493 25757 12686 1 15 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.500 0.242 25757 12687 1 15 . 1 1 165 165 GLY H H 165 8.455 8.455 8.141 0.314 25757 12688 1 15 . 1 1 166 166 ALA N N 166 120.648 120.648 123.647 -2.999 25757 12689 1 15 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.475 -0.133 25757 12690 1 15 . 1 1 166 166 ALA C C 166 176.155 176.155 178.532 -2.377 25757 12691 1 15 . 1 1 166 166 ALA CA C 166 51.773 51.773 54.058 -2.285 25757 12692 1 15 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.074 0.404 25757 12693 1 15 . 1 1 166 166 ALA H H 166 7.826 7.826 8.080 -0.254 25757 12694 1 15 . 1 1 167 167 GLN N N 167 117.315 117.315 117.810 -0.495 25757 12695 1 15 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.401 -0.124 25757 12696 1 15 . 1 1 167 167 GLN C C 167 175.571 175.571 175.093 0.478 25757 12697 1 15 . 1 1 167 167 GLN CA C 167 55.927 55.927 55.219 0.708 25757 12698 1 15 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.178 1.007 25757 12699 1 15 . 1 1 167 167 GLN H H 167 7.498 7.498 7.602 -0.104 25757 12700 1 15 . 1 1 168 168 ALA N N 168 126.706 126.706 128.319 -1.613 25757 12701 1 15 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.111 0.168 25757 12702 1 15 . 1 1 168 168 ALA C C 168 177.227 177.227 177.641 -0.414 25757 12703 1 15 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.985 -1.919 25757 12704 1 15 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.307 0.399 25757 12705 1 15 . 1 1 168 168 ALA H H 168 8.534 8.534 8.597 -0.063 25757 12706 1 16 . 1 1 9 9 ILE N N 9 116.733 116.733 122.006 -5.273 25757 12707 1 16 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.364 -0.607 25757 12708 1 16 . 1 1 9 9 ILE C C 9 177.828 177.828 177.566 0.262 25757 12709 1 16 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.303 3.300 25757 12710 1 16 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.307 0.291 25757 12711 1 16 . 1 1 9 9 ILE H H 9 7.366 7.366 8.299 -0.933 25757 12712 1 16 . 1 1 10 10 ALA N N 10 121.080 121.080 122.844 -1.764 25757 12713 1 16 . 1 1 10 10 ALA HA H 10 4.075 4.075 4.030 0.045 25757 12714 1 16 . 1 1 10 10 ALA C C 10 180.921 180.921 179.365 1.556 25757 12715 1 16 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.298 0.305 25757 12716 1 16 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.890 0.094 25757 12717 1 16 . 1 1 10 10 ALA H H 10 8.039 8.039 8.468 -0.429 25757 12718 1 16 . 1 1 11 11 GLU N N 11 119.580 119.580 119.108 0.472 25757 12719 1 16 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.878 0.211 25757 12720 1 16 . 1 1 11 11 GLU C C 11 179.561 179.561 179.032 0.529 25757 12721 1 16 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.134 0.751 25757 12722 1 16 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.142 0.321 25757 12723 1 16 . 1 1 11 11 GLU H H 11 7.741 7.741 7.749 -0.008 25757 12724 1 16 . 1 1 12 12 PHE N N 12 118.509 118.509 118.110 0.399 25757 12725 1 16 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.167 0.659 25757 12726 1 16 . 1 1 12 12 PHE C C 12 179.000 179.000 178.233 0.767 25757 12727 1 16 . 1 1 12 12 PHE CA C 12 60.164 60.164 61.515 -1.351 25757 12728 1 16 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.219 -0.109 25757 12729 1 16 . 1 1 12 12 PHE H H 12 8.470 8.470 7.445 1.025 25757 12730 1 16 . 1 1 13 13 LYS N N 13 123.523 123.523 118.969 4.554 25757 12731 1 16 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.126 -0.100 25757 12732 1 16 . 1 1 13 13 LYS C C 13 179.260 179.260 179.295 -0.035 25757 12733 1 16 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.760 0.404 25757 12734 1 16 . 1 1 13 13 LYS CB C 13 31.833 31.833 31.767 0.066 25757 12735 1 16 . 1 1 13 13 LYS H H 13 9.171 9.171 8.503 0.668 25757 12736 1 16 . 1 1 14 14 GLU N N 14 120.415 120.415 118.983 1.432 25757 12737 1 16 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.016 0.079 25757 12738 1 16 . 1 1 14 14 GLU C C 14 179.851 179.851 179.119 0.732 25757 12739 1 16 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.111 0.475 25757 12740 1 16 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.428 0.133 25757 12741 1 16 . 1 1 14 14 GLU H H 14 7.822 7.822 8.230 -0.408 25757 12742 1 16 . 1 1 15 15 ALA N N 15 122.143 122.143 122.270 -0.127 25757 12743 1 16 . 1 1 15 15 ALA HA H 15 4.130 4.130 3.938 0.192 25757 12744 1 16 . 1 1 15 15 ALA C C 15 178.222 178.222 179.082 -0.860 25757 12745 1 16 . 1 1 15 15 ALA CA C 15 55.190 55.190 54.785 0.404 25757 12746 1 16 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.378 0.124 25757 12747 1 16 . 1 1 15 15 ALA H H 15 8.244 8.244 8.007 0.237 25757 12748 1 16 . 1 1 16 16 PHE N N 16 119.809 119.809 117.895 1.914 25757 12749 1 16 . 1 1 16 16 PHE HA H 16 4.012 4.012 3.743 0.269 25757 12750 1 16 . 1 1 16 16 PHE C C 16 177.444 177.444 177.564 -0.120 25757 12751 1 16 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.968 1.097 25757 12752 1 16 . 1 1 16 16 PHE CB C 16 39.432 39.432 38.861 0.571 25757 12753 1 16 . 1 1 16 16 PHE H H 16 8.891 8.891 8.269 0.622 25757 12754 1 16 . 1 1 17 17 SER N N 17 112.631 112.631 115.040 -2.409 25757 12755 1 16 . 1 1 17 17 SER HA H 17 4.034 4.034 4.335 -0.301 25757 12756 1 16 . 1 1 17 17 SER C C 17 174.675 174.675 176.535 -1.860 25757 12757 1 16 . 1 1 17 17 SER CA C 17 61.507 61.507 60.995 0.513 25757 12758 1 16 . 1 1 17 17 SER CB C 17 63.414 63.414 62.935 0.479 25757 12759 1 16 . 1 1 17 17 SER H H 17 7.910 7.910 8.073 -0.163 25757 12760 1 16 . 1 1 18 18 LEU N N 18 120.614 120.614 121.819 -1.205 25757 12761 1 16 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.068 -0.056 25757 12762 1 16 . 1 1 18 18 LEU C C 18 177.366 177.366 177.773 -0.407 25757 12763 1 16 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.755 -0.369 25757 12764 1 16 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.947 -0.352 25757 12765 1 16 . 1 1 18 18 LEU H H 18 7.423 7.423 7.384 0.039 25757 12766 1 16 . 1 1 19 19 PHE N N 19 114.602 114.602 109.246 5.356 25757 12767 1 16 . 1 1 19 19 PHE C C 19 176.961 176.961 176.029 0.932 25757 12768 1 16 . 1 1 19 19 PHE CA C 19 59.484 59.484 56.383 3.101 25757 12769 1 16 . 1 1 19 19 PHE CB C 19 40.769 40.769 38.974 1.795 25757 12770 1 16 . 1 1 19 19 PHE H H 19 7.254 7.254 6.633 0.621 25757 12771 1 16 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.503 0.072 25757 12772 1 16 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.266 -1.618 25757 12773 1 16 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.573 -0.563 25757 12774 1 16 . 1 1 23 23 GLY N N 23 108.244 108.244 110.408 -2.164 25757 12775 1 16 . 1 1 23 23 GLY C C 23 175.188 175.188 174.880 0.308 25757 12776 1 16 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.098 1.305 25757 12777 1 16 . 1 1 23 23 GLY H H 23 7.555 7.555 8.084 -0.529 25757 12778 1 16 . 1 1 24 24 ASP N N 24 120.667 120.667 120.009 0.658 25757 12779 1 16 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.460 0.009 25757 12780 1 16 . 1 1 24 24 ASP C C 24 177.457 177.457 177.948 -0.491 25757 12781 1 16 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.722 0.070 25757 12782 1 16 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.312 -0.797 25757 12783 1 16 . 1 1 24 24 ASP H H 24 8.397 8.397 8.203 0.194 25757 12784 1 16 . 1 1 25 25 GLY N N 25 112.989 112.989 108.415 4.574 25757 12785 1 16 . 1 1 25 25 GLY C C 25 173.639 173.639 173.382 0.257 25757 12786 1 16 . 1 1 25 25 GLY CA C 25 45.501 45.501 44.840 0.661 25757 12787 1 16 . 1 1 25 25 GLY H H 25 10.592 10.592 8.554 2.038 25757 12788 1 16 . 1 1 26 26 THR N N 26 112.948 112.948 113.367 -0.419 25757 12789 1 16 . 1 1 26 26 THR HA H 26 5.282 5.282 4.645 0.637 25757 12790 1 16 . 1 1 26 26 THR C C 26 172.853 172.853 172.681 0.172 25757 12791 1 16 . 1 1 26 26 THR CA C 26 59.817 59.817 62.060 -2.244 25757 12792 1 16 . 1 1 26 26 THR CB C 26 72.465 72.465 71.408 1.057 25757 12793 1 16 . 1 1 26 26 THR H H 26 8.121 8.121 8.241 -0.120 25757 12794 1 16 . 1 1 27 27 ILE N N 27 127.195 127.195 122.088 5.107 25757 12795 1 16 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.766 0.147 25757 12796 1 16 . 1 1 27 27 ILE C C 27 176.091 176.091 174.277 1.814 25757 12797 1 16 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.476 0.289 25757 12798 1 16 . 1 1 27 27 ILE CB C 27 39.705 39.705 42.407 -2.702 25757 12799 1 16 . 1 1 27 27 ILE H H 27 9.867 9.867 8.898 0.969 25757 12800 1 16 . 1 1 28 28 THR N N 28 116.655 116.655 119.023 -2.368 25757 12801 1 16 . 1 1 28 28 THR HA H 28 4.790 4.790 4.849 -0.059 25757 12802 1 16 . 1 1 28 28 THR C C 28 176.696 176.696 176.061 0.635 25757 12803 1 16 . 1 1 28 28 THR CA C 28 59.590 59.590 59.762 -0.172 25757 12804 1 16 . 1 1 28 28 THR CB C 28 72.457 72.457 70.806 1.651 25757 12805 1 16 . 1 1 28 28 THR H H 28 8.457 8.457 8.457 0.000 25757 12806 1 16 . 1 1 29 29 THR N N 29 111.878 111.878 114.849 -2.971 25757 12807 1 16 . 1 1 29 29 THR HA H 29 4.188 4.188 4.002 0.186 25757 12808 1 16 . 1 1 29 29 THR C C 29 177.399 177.399 176.502 0.897 25757 12809 1 16 . 1 1 29 29 THR CA C 29 66.386 66.386 66.059 0.327 25757 12810 1 16 . 1 1 29 29 THR CB C 29 67.726 67.726 68.632 -0.906 25757 12811 1 16 . 1 1 29 29 THR H H 29 9.211 9.211 8.897 0.314 25757 12812 1 16 . 1 1 30 30 LYS N N 30 121.140 121.140 121.023 0.117 25757 12813 1 16 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.955 0.122 25757 12814 1 16 . 1 1 30 30 LYS C C 30 179.793 179.793 178.915 0.878 25757 12815 1 16 . 1 1 30 30 LYS CA C 30 59.292 59.292 60.013 -0.721 25757 12816 1 16 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.961 0.486 25757 12817 1 16 . 1 1 30 30 LYS H H 30 7.580 7.580 7.919 -0.339 25757 12818 1 16 . 1 1 31 31 GLU N N 31 121.865 121.865 119.483 2.382 25757 12819 1 16 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.977 0.017 25757 12820 1 16 . 1 1 31 31 GLU C C 31 179.355 179.355 179.005 0.350 25757 12821 1 16 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.727 -0.094 25757 12822 1 16 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.488 0.364 25757 12823 1 16 . 1 1 31 31 GLU H H 31 7.708 7.708 7.727 -0.019 25757 12824 1 16 . 1 1 32 32 LEU N N 32 120.597 120.597 117.230 3.367 25757 12825 1 16 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.723 0.393 25757 12826 1 16 . 1 1 32 32 LEU C C 32 178.885 178.885 178.912 -0.027 25757 12827 1 16 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.265 0.096 25757 12828 1 16 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.589 2.447 25757 12829 1 16 . 1 1 32 32 LEU H H 32 8.688 8.688 7.555 1.133 25757 12830 1 16 . 1 1 33 33 GLY N N 33 104.837 104.837 107.480 -2.643 25757 12831 1 16 . 1 1 33 33 GLY C C 33 175.123 175.123 175.994 -0.871 25757 12832 1 16 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.639 0.608 25757 12833 1 16 . 1 1 33 33 GLY H H 33 8.694 8.694 8.303 0.391 25757 12834 1 16 . 1 1 34 34 THR N N 34 117.631 117.631 119.118 -1.487 25757 12835 1 16 . 1 1 34 34 THR HA H 34 3.899 3.899 3.953 -0.054 25757 12836 1 16 . 1 1 34 34 THR C C 34 176.951 176.951 176.607 0.344 25757 12837 1 16 . 1 1 34 34 THR CA C 34 67.234 67.234 66.983 0.251 25757 12838 1 16 . 1 1 34 34 THR CB C 34 68.863 68.863 68.785 0.078 25757 12839 1 16 . 1 1 34 34 THR H H 34 7.960 7.960 7.963 -0.003 25757 12840 1 16 . 1 1 35 35 VAL N N 35 121.659 121.659 122.068 -0.409 25757 12841 1 16 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.882 -0.365 25757 12842 1 16 . 1 1 35 35 VAL C C 35 178.265 178.265 177.425 0.840 25757 12843 1 16 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.490 0.185 25757 12844 1 16 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.867 -0.574 25757 12845 1 16 . 1 1 35 35 VAL H H 35 7.358 7.358 7.893 -0.535 25757 12846 1 16 . 1 1 36 36 MET N N 36 117.456 117.456 115.462 1.994 25757 12847 1 16 . 1 1 36 36 MET C C 36 179.088 179.088 177.920 1.168 25757 12848 1 16 . 1 1 36 36 MET CA C 36 60.477 60.477 58.553 1.924 25757 12849 1 16 . 1 1 36 36 MET CB C 36 32.443 32.443 32.605 -0.162 25757 12850 1 16 . 1 1 36 36 MET H H 36 8.194 8.194 8.187 0.007 25757 12851 1 16 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.446 0.701 25757 12852 1 16 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.320 0.030 25757 12853 1 16 . 1 1 38 38 SER HA H 38 4.085 4.085 4.353 -0.268 25757 12854 1 16 . 1 1 38 38 SER C C 38 173.788 173.788 175.408 -1.620 25757 12855 1 16 . 1 1 38 38 SER CA C 38 61.617 61.617 60.260 1.357 25757 12856 1 16 . 1 1 38 38 SER CB C 38 62.943 62.943 63.039 -0.096 25757 12857 1 16 . 1 1 39 39 LEU N N 39 119.003 119.003 120.362 -1.359 25757 12858 1 16 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.416 0.078 25757 12859 1 16 . 1 1 39 39 LEU C C 39 176.470 176.470 177.038 -0.568 25757 12860 1 16 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.999 -0.320 25757 12861 1 16 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.598 0.916 25757 12862 1 16 . 1 1 39 39 LEU H H 39 7.230 7.230 7.143 0.087 25757 12863 1 16 . 1 1 40 40 GLY N N 40 105.026 105.026 106.053 -1.027 25757 12864 1 16 . 1 1 40 40 GLY C C 40 174.322 174.322 174.285 0.037 25757 12865 1 16 . 1 1 40 40 GLY CA C 40 46.215 46.215 44.961 1.254 25757 12866 1 16 . 1 1 40 40 GLY H H 40 7.698 7.698 7.732 -0.034 25757 12867 1 16 . 1 1 41 41 GLN N N 41 117.929 117.929 119.539 -1.610 25757 12868 1 16 . 1 1 41 41 GLN C C 41 174.557 174.557 174.750 -0.193 25757 12869 1 16 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.074 -0.230 25757 12870 1 16 . 1 1 41 41 GLN H H 41 7.866 7.866 7.562 0.304 25757 12871 1 16 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.432 0.304 25757 12872 1 16 . 1 1 43 43 PRO C C 43 177.805 177.805 176.343 1.462 25757 12873 1 16 . 1 1 43 43 PRO CA C 43 62.505 62.505 63.145 -0.640 25757 12874 1 16 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.587 -0.425 25757 12875 1 16 . 1 1 44 44 THR N N 44 113.167 113.167 112.716 0.451 25757 12876 1 16 . 1 1 44 44 THR HA H 44 4.684 4.684 4.606 0.078 25757 12877 1 16 . 1 1 44 44 THR C C 44 175.139 175.139 175.771 -0.632 25757 12878 1 16 . 1 1 44 44 THR CA C 44 60.556 60.556 59.234 1.322 25757 12879 1 16 . 1 1 44 44 THR CB C 44 71.064 71.064 71.210 -0.146 25757 12880 1 16 . 1 1 44 44 THR H H 44 8.798 8.798 8.003 0.795 25757 12881 1 16 . 1 1 45 45 GLU N N 45 120.673 120.673 121.221 -0.548 25757 12882 1 16 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.951 0.040 25757 12883 1 16 . 1 1 45 45 GLU C C 45 178.940 178.940 178.113 0.827 25757 12884 1 16 . 1 1 45 45 GLU CA C 45 59.901 59.901 59.604 0.297 25757 12885 1 16 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.213 -0.184 25757 12886 1 16 . 1 1 45 45 GLU H H 45 8.812 8.812 8.973 -0.161 25757 12887 1 16 . 1 1 46 46 ALA N N 46 120.576 120.576 122.391 -1.815 25757 12888 1 16 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.151 -0.184 25757 12889 1 16 . 1 1 46 46 ALA C C 46 180.290 180.290 180.022 0.268 25757 12890 1 16 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.095 -0.176 25757 12891 1 16 . 1 1 46 46 ALA CB C 46 18.161 18.161 17.916 0.245 25757 12892 1 16 . 1 1 46 46 ALA H H 46 8.276 8.276 8.379 -0.103 25757 12893 1 16 . 1 1 47 47 GLU N N 47 116.104 116.104 118.500 -2.396 25757 12894 1 16 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.021 -0.021 25757 12895 1 16 . 1 1 47 47 GLU C C 47 180.224 180.224 179.086 1.138 25757 12896 1 16 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.193 -0.262 25757 12897 1 16 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.159 0.830 25757 12898 1 16 . 1 1 47 47 GLU H H 47 7.425 7.425 7.735 -0.310 25757 12899 1 16 . 1 1 48 48 LEU N N 48 120.425 120.425 119.396 1.029 25757 12900 1 16 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.899 0.151 25757 12901 1 16 . 1 1 48 48 LEU C C 48 178.551 178.551 179.013 -0.462 25757 12902 1 16 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.108 -0.269 25757 12903 1 16 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.175 1.394 25757 12904 1 16 . 1 1 48 48 LEU H H 48 8.121 8.121 7.417 0.704 25757 12905 1 16 . 1 1 49 49 GLN N N 49 118.372 118.372 117.616 0.756 25757 12906 1 16 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.828 -0.066 25757 12907 1 16 . 1 1 49 49 GLN C C 49 178.567 178.567 178.136 0.431 25757 12908 1 16 . 1 1 49 49 GLN CA C 49 58.863 58.863 58.898 -0.035 25757 12909 1 16 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.000 0.242 25757 12910 1 16 . 1 1 49 49 GLN H H 49 8.302 8.302 8.602 -0.300 25757 12911 1 16 . 1 1 50 50 ASP N N 50 119.992 119.992 121.449 -1.457 25757 12912 1 16 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.353 0.007 25757 12913 1 16 . 1 1 50 50 ASP C C 50 178.600 178.600 178.525 0.075 25757 12914 1 16 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.147 0.556 25757 12915 1 16 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.986 -0.519 25757 12916 1 16 . 1 1 50 50 ASP H H 50 8.150 8.150 8.206 -0.056 25757 12917 1 16 . 1 1 51 51 MET N N 51 119.238 119.238 118.885 0.353 25757 12918 1 16 . 1 1 51 51 MET HA H 51 3.981 3.981 4.022 -0.041 25757 12919 1 16 . 1 1 51 51 MET C C 51 179.006 179.006 178.932 0.074 25757 12920 1 16 . 1 1 51 51 MET CA C 51 59.443 59.443 58.701 0.742 25757 12921 1 16 . 1 1 51 51 MET CB C 51 33.380 33.380 32.242 1.138 25757 12922 1 16 . 1 1 51 51 MET H H 51 7.844 7.844 7.944 -0.100 25757 12923 1 16 . 1 1 52 52 ILE N N 52 118.161 118.161 118.725 -0.564 25757 12924 1 16 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.643 -0.165 25757 12925 1 16 . 1 1 52 52 ILE C C 52 177.847 177.847 178.871 -1.024 25757 12926 1 16 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.437 0.558 25757 12927 1 16 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.510 0.613 25757 12928 1 16 . 1 1 52 52 ILE H H 52 7.686 7.686 8.314 -0.628 25757 12929 1 16 . 1 1 53 53 ASN N N 53 117.884 117.884 117.894 -0.010 25757 12930 1 16 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.460 -0.095 25757 12931 1 16 . 1 1 53 53 ASN C C 53 177.515 177.515 177.924 -0.409 25757 12932 1 16 . 1 1 53 53 ASN CA C 53 56.207 56.207 56.049 0.158 25757 12933 1 16 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.530 -0.452 25757 12934 1 16 . 1 1 53 53 ASN H H 53 8.713 8.713 8.386 0.327 25757 12935 1 16 . 1 1 54 54 GLU N N 54 116.178 116.178 117.862 -1.684 25757 12936 1 16 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.247 -0.258 25757 12937 1 16 . 1 1 54 54 GLU C C 54 177.557 177.557 177.073 0.484 25757 12938 1 16 . 1 1 54 54 GLU CA C 54 58.990 58.990 58.261 0.729 25757 12939 1 16 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.733 -0.270 25757 12940 1 16 . 1 1 54 54 GLU H H 54 7.530 7.530 8.029 -0.499 25757 12941 1 16 . 1 1 55 55 VAL N N 55 107.164 107.164 110.053 -2.889 25757 12942 1 16 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.320 0.202 25757 12943 1 16 . 1 1 55 55 VAL C C 55 175.602 175.602 174.532 1.070 25757 12944 1 16 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.257 0.095 25757 12945 1 16 . 1 1 55 55 VAL CB C 55 32.603 32.603 31.575 1.028 25757 12946 1 16 . 1 1 55 55 VAL H H 55 7.175 7.175 7.524 -0.349 25757 12947 1 16 . 1 1 56 56 ASP N N 56 122.126 122.126 122.010 0.116 25757 12948 1 16 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.071 -0.472 25757 12949 1 16 . 1 1 56 56 ASP C C 56 176.182 176.182 176.258 -0.076 25757 12950 1 16 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.574 0.232 25757 12951 1 16 . 1 1 56 56 ASP CB C 56 40.270 40.270 40.610 -0.340 25757 12952 1 16 . 1 1 56 56 ASP H H 56 7.569 7.569 7.438 0.131 25757 12953 1 16 . 1 1 57 57 ALA N N 57 103.782 103.782 128.931 -25.149 25757 12954 1 16 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.091 0.089 25757 12955 1 16 . 1 1 57 57 ALA C C 57 178.584 178.584 177.886 0.698 25757 12956 1 16 . 1 1 57 57 ALA CA C 57 54.344 54.344 54.107 0.237 25757 12957 1 16 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.559 -0.035 25757 12958 1 16 . 1 1 57 57 ALA H H 57 8.515 8.515 8.960 -0.445 25757 12959 1 16 . 1 1 58 58 ASP N N 58 113.602 113.602 115.588 -1.986 25757 12960 1 16 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.661 -0.075 25757 12961 1 16 . 1 1 58 58 ASP C C 58 177.756 177.756 176.946 0.810 25757 12962 1 16 . 1 1 58 58 ASP CA C 58 52.762 52.762 53.717 -0.955 25757 12963 1 16 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.514 -1.836 25757 12964 1 16 . 1 1 58 58 ASP H H 58 8.130 8.130 8.041 0.089 25757 12965 1 16 . 1 1 59 59 GLY N N 59 109.195 109.195 109.896 -0.701 25757 12966 1 16 . 1 1 59 59 GLY C C 59 175.139 175.139 174.653 0.486 25757 12967 1 16 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.295 1.969 25757 12968 1 16 . 1 1 59 59 GLY H H 59 7.694 7.694 8.071 -0.377 25757 12969 1 16 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.739 -0.134 25757 12970 1 16 . 1 1 61 61 GLY N N 61 113.316 113.316 109.555 3.761 25757 12971 1 16 . 1 1 61 61 GLY C C 61 173.234 173.234 173.039 0.195 25757 12972 1 16 . 1 1 61 61 GLY CA C 61 45.698 45.698 44.944 0.754 25757 12973 1 16 . 1 1 61 61 GLY H H 61 10.633 10.633 8.319 2.314 25757 12974 1 16 . 1 1 62 62 THR N N 62 108.892 108.892 109.397 -0.505 25757 12975 1 16 . 1 1 62 62 THR HA H 62 4.736 4.736 4.743 -0.007 25757 12976 1 16 . 1 1 62 62 THR C C 62 173.091 173.091 171.821 1.270 25757 12977 1 16 . 1 1 62 62 THR CA C 62 59.617 59.617 60.223 -0.606 25757 12978 1 16 . 1 1 62 62 THR CB C 62 72.004 72.004 72.050 -0.046 25757 12979 1 16 . 1 1 62 62 THR H H 62 7.673 7.673 8.275 -0.602 25757 12980 1 16 . 1 1 63 63 ILE N N 63 123.324 123.324 121.526 1.798 25757 12981 1 16 . 1 1 63 63 ILE HA H 63 5.129 5.129 5.265 -0.136 25757 12982 1 16 . 1 1 63 63 ILE C C 63 175.652 175.652 173.963 1.689 25757 12983 1 16 . 1 1 63 63 ILE CA C 63 60.486 60.486 58.359 2.127 25757 12984 1 16 . 1 1 63 63 ILE CB C 63 39.957 39.957 41.314 -1.357 25757 12985 1 16 . 1 1 63 63 ILE H H 63 8.907 8.907 8.560 0.347 25757 12986 1 16 . 1 1 64 64 ASP N N 64 128.253 128.253 129.327 -1.074 25757 12987 1 16 . 1 1 64 64 ASP HA H 64 5.321 5.321 5.070 0.251 25757 12988 1 16 . 1 1 64 64 ASP C C 64 176.431 176.431 177.148 -0.717 25757 12989 1 16 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.048 -0.717 25757 12990 1 16 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.467 -0.413 25757 12991 1 16 . 1 1 64 64 ASP H H 64 8.864 8.864 8.863 0.001 25757 12992 1 16 . 1 1 65 65 PHE N N 65 118.583 118.583 121.517 -2.934 25757 12993 1 16 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.270 -0.410 25757 12994 1 16 . 1 1 65 65 PHE C C 65 173.458 173.458 174.117 -0.659 25757 12995 1 16 . 1 1 65 65 PHE CA C 65 63.799 63.799 62.345 1.454 25757 12996 1 16 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.925 -1.045 25757 12997 1 16 . 1 1 65 65 PHE H H 65 8.962 8.962 8.963 -0.001 25757 12998 1 16 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.931 0.187 25757 12999 1 16 . 1 1 66 66 PRO C C 66 180.038 180.038 178.069 1.969 25757 13000 1 16 . 1 1 66 66 PRO CA C 66 66.690 66.690 64.793 1.897 25757 13001 1 16 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.741 -0.065 25757 13002 1 16 . 1 1 67 67 GLU N N 67 118.402 118.402 118.671 -0.269 25757 13003 1 16 . 1 1 67 67 GLU C C 67 178.737 178.737 178.287 0.450 25757 13004 1 16 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.151 -0.143 25757 13005 1 16 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.595 0.090 25757 13006 1 16 . 1 1 67 67 GLU H H 67 7.953 7.953 8.015 -0.062 25757 13007 1 16 . 1 1 68 68 PHE N N 68 123.421 123.421 121.788 1.633 25757 13008 1 16 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.161 -0.189 25757 13009 1 16 . 1 1 68 68 PHE C C 68 177.184 177.184 177.050 0.134 25757 13010 1 16 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.758 -0.420 25757 13011 1 16 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.427 0.542 25757 13012 1 16 . 1 1 68 68 PHE H H 68 8.928 8.928 8.091 0.837 25757 13013 1 16 . 1 1 69 69 LEU N N 69 119.284 119.284 118.834 0.450 25757 13014 1 16 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.635 -0.300 25757 13015 1 16 . 1 1 69 69 LEU C C 69 178.987 178.987 178.346 0.641 25757 13016 1 16 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.931 -1.069 25757 13017 1 16 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.387 -0.555 25757 13018 1 16 . 1 1 69 69 LEU H H 69 8.374 8.374 7.861 0.513 25757 13019 1 16 . 1 1 70 70 THR N N 70 116.017 116.017 114.752 1.265 25757 13020 1 16 . 1 1 70 70 THR HA H 70 4.338 4.338 3.828 0.510 25757 13021 1 16 . 1 1 70 70 THR C C 70 176.169 176.169 176.615 -0.446 25757 13022 1 16 . 1 1 70 70 THR CA C 70 66.700 66.700 66.535 0.165 25757 13023 1 16 . 1 1 70 70 THR CB C 70 68.379 68.379 68.512 -0.133 25757 13024 1 16 . 1 1 70 70 THR H H 70 7.493 7.493 7.136 0.357 25757 13025 1 16 . 1 1 71 71 MET N N 71 121.915 121.915 122.504 -0.589 25757 13026 1 16 . 1 1 71 71 MET HA H 71 3.718 3.718 3.953 -0.235 25757 13027 1 16 . 1 1 71 71 MET C C 71 178.190 178.190 177.825 0.365 25757 13028 1 16 . 1 1 71 71 MET CA C 71 59.335 59.335 58.522 0.813 25757 13029 1 16 . 1 1 71 71 MET CB C 71 33.894 33.894 31.988 1.906 25757 13030 1 16 . 1 1 71 71 MET H H 71 7.924 7.924 7.984 -0.060 25757 13031 1 16 . 1 1 72 72 MET N N 72 116.973 116.973 118.253 -1.280 25757 13032 1 16 . 1 1 72 72 MET HA H 72 3.968 3.968 3.905 0.063 25757 13033 1 16 . 1 1 72 72 MET C C 72 178.211 178.211 178.283 -0.072 25757 13034 1 16 . 1 1 72 72 MET CA C 72 56.059 56.059 59.045 -2.986 25757 13035 1 16 . 1 1 72 72 MET CB C 72 31.639 31.639 32.392 -0.753 25757 13036 1 16 . 1 1 72 72 MET H H 72 8.276 8.276 7.777 0.499 25757 13037 1 16 . 1 1 73 73 ALA N N 73 122.499 122.499 120.494 2.005 25757 13038 1 16 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.919 0.031 25757 13039 1 16 . 1 1 73 73 ALA C C 73 180.231 180.231 179.382 0.849 25757 13040 1 16 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.833 0.120 25757 13041 1 16 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.907 0.125 25757 13042 1 16 . 1 1 73 73 ALA H H 73 8.240 8.240 7.972 0.268 25757 13043 1 16 . 1 1 74 74 ARG N N 74 116.098 116.098 117.575 -1.477 25757 13044 1 16 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.038 -0.046 25757 13045 1 16 . 1 1 74 74 ARG C C 74 178.567 178.567 179.032 -0.465 25757 13046 1 16 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.100 -0.275 25757 13047 1 16 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.282 -0.207 25757 13048 1 16 . 1 1 74 74 ARG H H 74 7.420 7.420 7.868 -0.448 25757 13049 1 16 . 1 1 75 75 LYS N N 75 119.046 119.046 119.213 -0.167 25757 13050 1 16 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.238 -0.195 25757 13051 1 16 . 1 1 75 75 LYS C C 75 179.045 179.045 178.623 0.422 25757 13052 1 16 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.748 0.140 25757 13053 1 16 . 1 1 75 75 LYS CB C 75 31.766 31.766 32.067 -0.301 25757 13054 1 16 . 1 1 75 75 LYS H H 75 7.862 7.862 7.738 0.124 25757 13055 1 16 . 1 1 76 76 MET N N 76 116.772 116.772 119.081 -2.309 25757 13056 1 16 . 1 1 76 76 MET H H 76 8.099 8.099 7.735 0.364 25757 13057 1 16 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.538 0.096 25757 13058 1 16 . 1 1 78 78 ASP C C 78 176.395 176.395 176.653 -0.258 25757 13059 1 16 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.451 0.193 25757 13060 1 16 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.063 0.411 25757 13061 1 16 . 1 1 79 79 THR N N 79 113.904 113.904 119.692 -5.788 25757 13062 1 16 . 1 1 79 79 THR HA H 79 4.215 4.215 4.146 0.069 25757 13063 1 16 . 1 1 79 79 THR C C 79 174.204 174.204 174.150 0.054 25757 13064 1 16 . 1 1 79 79 THR CA C 79 62.264 62.264 63.932 -1.669 25757 13065 1 16 . 1 1 79 79 THR CB C 79 69.884 69.884 69.162 0.722 25757 13066 1 16 . 1 1 79 79 THR H H 79 8.039 8.039 8.267 -0.228 25757 13067 1 16 . 1 1 80 80 ASP N N 80 123.572 123.572 122.610 0.962 25757 13068 1 16 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.872 -0.152 25757 13069 1 16 . 1 1 80 80 ASP C C 80 176.221 176.221 175.610 0.611 25757 13070 1 16 . 1 1 80 80 ASP CA C 80 54.315 54.315 53.782 0.533 25757 13071 1 16 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.467 0.960 25757 13072 1 16 . 1 1 80 80 ASP H H 80 8.441 8.441 7.822 0.619 25757 13073 1 16 . 1 1 81 81 SER N N 81 117.879 117.879 118.696 -0.817 25757 13074 1 16 . 1 1 81 81 SER HA H 81 3.925 3.925 4.731 -0.806 25757 13075 1 16 . 1 1 81 81 SER C C 81 175.264 175.264 175.514 -0.250 25757 13076 1 16 . 1 1 81 81 SER CA C 81 58.860 58.860 58.551 0.309 25757 13077 1 16 . 1 1 81 81 SER CB C 81 63.790 63.790 63.965 -0.175 25757 13078 1 16 . 1 1 81 81 SER H H 81 8.503 8.503 8.656 -0.153 25757 13079 1 16 . 1 1 82 82 GLU N N 82 123.206 123.206 122.666 0.540 25757 13080 1 16 . 1 1 82 82 GLU HA H 82 4.058 4.058 3.945 0.113 25757 13081 1 16 . 1 1 82 82 GLU C C 82 178.378 178.378 178.177 0.201 25757 13082 1 16 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.355 -0.769 25757 13083 1 16 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.704 -0.101 25757 13084 1 16 . 1 1 82 82 GLU H H 82 8.563 8.563 8.638 -0.075 25757 13085 1 16 . 1 1 83 83 GLU N N 83 119.262 119.262 118.998 0.264 25757 13086 1 16 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.900 0.057 25757 13087 1 16 . 1 1 83 83 GLU C C 83 178.606 178.606 178.799 -0.193 25757 13088 1 16 . 1 1 83 83 GLU CA C 83 59.669 59.669 60.119 -0.450 25757 13089 1 16 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.238 0.117 25757 13090 1 16 . 1 1 83 83 GLU H H 83 7.728 7.728 8.621 -0.893 25757 13091 1 16 . 1 1 84 84 GLU N N 84 118.432 118.432 119.103 -0.671 25757 13092 1 16 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.030 0.077 25757 13093 1 16 . 1 1 84 84 GLU C C 84 179.436 179.436 179.226 0.210 25757 13094 1 16 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.899 -0.396 25757 13095 1 16 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.217 -0.110 25757 13096 1 16 . 1 1 84 84 GLU H H 84 8.346 8.346 8.381 -0.035 25757 13097 1 16 . 1 1 85 85 ILE N N 85 120.925 120.925 120.005 0.920 25757 13098 1 16 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.752 -0.004 25757 13099 1 16 . 1 1 85 85 ILE C C 85 177.661 177.661 177.996 -0.335 25757 13100 1 16 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.484 0.006 25757 13101 1 16 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.862 -0.431 25757 13102 1 16 . 1 1 85 85 ILE H H 85 7.821 7.821 8.281 -0.460 25757 13103 1 16 . 1 1 86 86 ARG N N 86 121.916 121.916 118.986 2.930 25757 13104 1 16 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.073 0.063 25757 13105 1 16 . 1 1 86 86 ARG C C 86 179.208 179.208 178.492 0.716 25757 13106 1 16 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.445 0.926 25757 13107 1 16 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.462 0.636 25757 13108 1 16 . 1 1 86 86 ARG H H 86 8.432 8.432 8.329 0.103 25757 13109 1 16 . 1 1 87 87 GLU N N 87 118.261 118.261 119.750 -1.489 25757 13110 1 16 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.925 0.187 25757 13111 1 16 . 1 1 87 87 GLU C C 87 178.516 178.516 178.351 0.165 25757 13112 1 16 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.286 -0.261 25757 13113 1 16 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.267 -0.097 25757 13114 1 16 . 1 1 87 87 GLU H H 87 8.225 8.225 8.220 0.005 25757 13115 1 16 . 1 1 88 88 ALA N N 88 121.009 121.009 122.515 -1.506 25757 13116 1 16 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.537 0.290 25757 13117 1 16 . 1 1 88 88 ALA C C 88 177.947 177.947 178.473 -0.526 25757 13118 1 16 . 1 1 88 88 ALA CA C 88 54.861 54.861 55.121 -0.260 25757 13119 1 16 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.352 -0.397 25757 13120 1 16 . 1 1 88 88 ALA H H 88 7.789 7.789 7.938 -0.149 25757 13121 1 16 . 1 1 89 89 PHE N N 89 117.164 117.164 118.649 -1.485 25757 13122 1 16 . 1 1 89 89 PHE C C 89 176.134 176.134 177.368 -1.234 25757 13123 1 16 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.545 2.105 25757 13124 1 16 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.948 -0.055 25757 13125 1 16 . 1 1 89 89 PHE H H 89 8.337 8.337 7.662 0.675 25757 13126 1 16 . 1 1 90 90 ARG N N 90 114.900 114.900 117.739 -2.839 25757 13127 1 16 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.894 0.020 25757 13128 1 16 . 1 1 90 90 ARG C C 90 178.296 178.296 177.575 0.721 25757 13129 1 16 . 1 1 90 90 ARG CA C 90 59.079 59.079 57.982 1.097 25757 13130 1 16 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.180 -0.087 25757 13131 1 16 . 1 1 90 90 ARG H H 90 7.681 7.681 7.846 -0.165 25757 13132 1 16 . 1 1 91 91 VAL N N 91 116.927 116.927 115.607 1.320 25757 13133 1 16 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.866 -0.259 25757 13134 1 16 . 1 1 91 91 VAL C C 91 177.964 177.964 177.120 0.844 25757 13135 1 16 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.858 1.102 25757 13136 1 16 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.044 0.575 25757 13137 1 16 . 1 1 91 91 VAL H H 91 7.405 7.405 7.555 -0.150 25757 13138 1 16 . 1 1 92 92 PHE N N 92 119.026 119.026 117.132 1.894 25757 13139 1 16 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.317 0.045 25757 13140 1 16 . 1 1 92 92 PHE C C 92 177.639 177.639 176.194 1.445 25757 13141 1 16 . 1 1 92 92 PHE CA C 92 57.721 57.721 59.132 -1.411 25757 13142 1 16 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.898 -0.471 25757 13143 1 16 . 1 1 92 92 PHE H H 92 7.886 7.886 7.502 0.384 25757 13144 1 16 . 1 1 93 93 ASP N N 93 118.238 118.238 118.857 -0.619 25757 13145 1 16 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.989 -0.527 25757 13146 1 16 . 1 1 93 93 ASP C C 93 176.979 176.979 177.095 -0.116 25757 13147 1 16 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.300 -0.152 25757 13148 1 16 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.324 -1.175 25757 13149 1 16 . 1 1 93 93 ASP H H 93 8.009 8.009 7.488 0.521 25757 13150 1 16 . 1 1 94 94 LYS N N 94 125.792 125.792 124.389 1.403 25757 13151 1 16 . 1 1 94 94 LYS C C 94 178.213 178.213 177.357 0.856 25757 13152 1 16 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.807 0.511 25757 13153 1 16 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.556 -1.528 25757 13154 1 16 . 1 1 94 94 LYS H H 94 7.428 7.428 8.065 -0.637 25757 13155 1 16 . 1 1 95 95 ASP N N 95 113.833 113.833 116.017 -2.184 25757 13156 1 16 . 1 1 95 95 ASP C C 95 177.718 177.718 176.989 0.729 25757 13157 1 16 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.392 -1.447 25757 13158 1 16 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.975 -1.232 25757 13159 1 16 . 1 1 95 95 ASP H H 95 8.159 8.159 8.202 -0.043 25757 13160 1 16 . 1 1 96 96 GLY N N 96 109.414 109.414 108.695 0.719 25757 13161 1 16 . 1 1 96 96 GLY C C 96 175.093 175.093 174.832 0.261 25757 13162 1 16 . 1 1 96 96 GLY CA C 96 47.254 47.254 46.235 1.019 25757 13163 1 16 . 1 1 96 96 GLY H H 96 7.848 7.848 7.883 -0.035 25757 13164 1 16 . 1 1 97 97 ASN N N 97 119.590 119.590 117.466 2.124 25757 13165 1 16 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.524 0.088 25757 13166 1 16 . 1 1 97 97 ASN C C 97 175.937 175.937 176.458 -0.521 25757 13167 1 16 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.280 -0.392 25757 13168 1 16 . 1 1 97 97 ASN CB C 97 38.320 38.320 38.802 -0.482 25757 13169 1 16 . 1 1 97 97 ASN H H 97 8.338 8.338 8.190 0.148 25757 13170 1 16 . 1 1 98 98 GLY N N 98 112.940 112.940 108.136 4.804 25757 13171 1 16 . 1 1 98 98 GLY C C 98 172.429 172.429 172.586 -0.157 25757 13172 1 16 . 1 1 98 98 GLY CA C 98 45.092 45.092 44.998 0.094 25757 13173 1 16 . 1 1 98 98 GLY H H 98 10.695 10.695 8.751 1.944 25757 13174 1 16 . 1 1 99 99 TYR N N 99 115.544 115.544 117.998 -2.454 25757 13175 1 16 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.258 -0.171 25757 13176 1 16 . 1 1 99 99 TYR C C 99 174.859 174.859 174.797 0.062 25757 13177 1 16 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.995 -0.977 25757 13178 1 16 . 1 1 99 99 TYR CB C 99 43.353 43.353 41.852 1.502 25757 13179 1 16 . 1 1 99 99 TYR H H 99 7.597 7.597 7.933 -0.336 25757 13180 1 16 . 1 1 100 100 ILE N N 100 127.078 127.078 123.794 3.284 25757 13181 1 16 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.774 0.015 25757 13182 1 16 . 1 1 100 100 ILE C C 100 175.387 175.387 175.994 -0.607 25757 13183 1 16 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.807 0.199 25757 13184 1 16 . 1 1 100 100 ILE CB C 100 38.790 38.790 40.378 -1.588 25757 13185 1 16 . 1 1 100 100 ILE H H 100 10.267 10.267 8.994 1.273 25757 13186 1 16 . 1 1 101 101 SER N N 101 124.102 124.102 121.353 2.749 25757 13187 1 16 . 1 1 101 101 SER HA H 101 4.417 4.417 5.201 -0.784 25757 13188 1 16 . 1 1 101 101 SER C C 101 175.360 175.360 175.157 0.203 25757 13189 1 16 . 1 1 101 101 SER CA C 101 56.036 56.036 55.543 0.493 25757 13190 1 16 . 1 1 101 101 SER CB C 101 66.896 66.896 65.239 1.657 25757 13191 1 16 . 1 1 101 101 SER H H 101 8.985 8.985 9.052 -0.067 25757 13192 1 16 . 1 1 102 102 ALA N N 102 122.780 122.780 124.155 -1.375 25757 13193 1 16 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.970 -0.226 25757 13194 1 16 . 1 1 102 102 ALA C C 102 179.175 179.175 178.320 0.855 25757 13195 1 16 . 1 1 102 102 ALA CA C 102 56.290 56.290 54.841 1.449 25757 13196 1 16 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.355 -0.328 25757 13197 1 16 . 1 1 102 102 ALA H H 102 9.269 9.269 9.163 0.106 25757 13198 1 16 . 1 1 103 103 ALA N N 103 118.513 118.513 121.377 -2.864 25757 13199 1 16 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.711 0.300 25757 13200 1 16 . 1 1 103 103 ALA C C 103 181.521 181.521 178.554 2.967 25757 13201 1 16 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.074 0.280 25757 13202 1 16 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.201 0.090 25757 13203 1 16 . 1 1 103 103 ALA H H 103 8.321 8.321 8.168 0.153 25757 13204 1 16 . 1 1 104 104 GLU N N 104 119.550 119.550 119.191 0.359 25757 13205 1 16 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.022 -0.016 25757 13206 1 16 . 1 1 104 104 GLU C C 104 179.750 179.750 178.653 1.097 25757 13207 1 16 . 1 1 104 104 GLU CA C 104 59.169 59.169 58.511 0.658 25757 13208 1 16 . 1 1 104 104 GLU CB C 104 29.215 29.215 28.518 0.697 25757 13209 1 16 . 1 1 104 104 GLU H H 104 7.867 7.867 8.129 -0.262 25757 13210 1 16 . 1 1 105 105 LEU N N 105 122.688 122.688 121.800 0.888 25757 13211 1 16 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.805 0.113 25757 13212 1 16 . 1 1 105 105 LEU C C 105 178.233 178.233 178.831 -0.598 25757 13213 1 16 . 1 1 105 105 LEU CA C 105 57.734 57.734 57.992 -0.258 25757 13214 1 16 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.517 0.503 25757 13215 1 16 . 1 1 105 105 LEU H H 105 8.746 8.746 7.933 0.813 25757 13216 1 16 . 1 1 106 106 ARG N N 106 118.835 118.835 117.893 0.942 25757 13217 1 16 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.821 -0.171 25757 13218 1 16 . 1 1 106 106 ARG C C 106 178.742 178.742 179.225 -0.483 25757 13219 1 16 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.439 0.524 25757 13220 1 16 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.768 0.278 25757 13221 1 16 . 1 1 106 106 ARG H H 106 8.684 8.684 7.768 0.916 25757 13222 1 16 . 1 1 107 107 HIS N N 107 119.258 119.258 118.515 0.743 25757 13223 1 16 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.303 -0.036 25757 13224 1 16 . 1 1 107 107 HIS C C 107 177.244 177.244 178.097 -0.853 25757 13225 1 16 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.664 1.488 25757 13226 1 16 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.838 0.737 25757 13227 1 16 . 1 1 107 107 HIS H H 107 7.691 7.691 8.115 -0.424 25757 13228 1 16 . 1 1 108 108 VAL N N 108 118.996 118.996 121.648 -2.652 25757 13229 1 16 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.885 -0.447 25757 13230 1 16 . 1 1 108 108 VAL C C 108 177.998 177.998 177.971 0.027 25757 13231 1 16 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.183 0.247 25757 13232 1 16 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.668 -0.244 25757 13233 1 16 . 1 1 108 108 VAL H H 108 7.599 7.599 8.263 -0.664 25757 13234 1 16 . 1 1 109 109 MET N N 109 114.880 114.880 117.444 -2.564 25757 13235 1 16 . 1 1 109 109 MET C C 109 179.119 179.119 177.551 1.568 25757 13236 1 16 . 1 1 109 109 MET CA C 109 56.979 56.979 58.761 -1.782 25757 13237 1 16 . 1 1 109 109 MET CB C 109 29.253 29.253 32.673 -3.420 25757 13238 1 16 . 1 1 109 109 MET H H 109 7.911 7.911 8.245 -0.334 25757 13239 1 16 . 1 1 110 110 THR N N 110 116.943 116.943 116.388 0.555 25757 13240 1 16 . 1 1 110 110 THR HA H 110 4.229 4.229 4.196 0.033 25757 13241 1 16 . 1 1 110 110 THR C C 110 178.506 178.506 176.459 2.047 25757 13242 1 16 . 1 1 110 110 THR CA C 110 66.573 66.573 66.828 -0.255 25757 13243 1 16 . 1 1 110 110 THR CB C 110 68.575 68.575 68.697 -0.122 25757 13244 1 16 . 1 1 110 110 THR H H 110 8.353 8.353 8.228 0.125 25757 13245 1 16 . 1 1 111 111 ASN N N 111 123.829 123.829 120.059 3.770 25757 13246 1 16 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.400 -0.038 25757 13247 1 16 . 1 1 111 111 ASN C C 111 177.197 177.197 176.773 0.424 25757 13248 1 16 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.887 0.072 25757 13249 1 16 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.440 -1.217 25757 13250 1 16 . 1 1 111 111 ASN H H 111 8.053 8.053 8.323 -0.270 25757 13251 1 16 . 1 1 112 112 LEU N N 112 119.036 119.036 116.198 2.838 25757 13252 1 16 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.236 -0.066 25757 13253 1 16 . 1 1 112 112 LEU C C 112 176.377 176.377 176.934 -0.557 25757 13254 1 16 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.170 -0.665 25757 13255 1 16 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.947 -0.587 25757 13256 1 16 . 1 1 112 112 LEU H H 112 7.794 7.794 7.471 0.323 25757 13257 1 16 . 1 1 113 113 GLY N N 113 106.045 106.045 104.623 1.422 25757 13258 1 16 . 1 1 113 113 GLY C C 113 174.248 174.248 174.039 0.209 25757 13259 1 16 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.595 0.712 25757 13260 1 16 . 1 1 113 113 GLY H H 113 7.741 7.741 7.545 0.196 25757 13261 1 16 . 1 1 114 114 GLU N N 114 120.556 120.556 121.354 -0.798 25757 13262 1 16 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.416 -0.106 25757 13263 1 16 . 1 1 114 114 GLU C C 114 174.993 174.993 176.359 -1.366 25757 13264 1 16 . 1 1 114 114 GLU CA C 114 54.637 54.637 54.624 0.013 25757 13265 1 16 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.676 1.541 25757 13266 1 16 . 1 1 114 114 GLU H H 114 7.980 7.980 8.163 -0.183 25757 13267 1 16 . 1 1 115 115 LYS N N 115 124.986 124.986 128.098 -3.112 25757 13268 1 16 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.167 0.167 25757 13269 1 16 . 1 1 115 115 LYS C C 115 175.285 175.285 175.397 -0.112 25757 13270 1 16 . 1 1 115 115 LYS CA C 115 55.581 55.581 57.073 -1.492 25757 13271 1 16 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.999 -1.026 25757 13272 1 16 . 1 1 115 115 LYS H H 115 8.613 8.613 8.138 0.475 25757 13273 1 16 . 1 1 116 116 LEU N N 116 125.243 125.243 118.682 6.561 25757 13274 1 16 . 1 1 116 116 LEU HA H 116 4.688 4.688 5.078 -0.390 25757 13275 1 16 . 1 1 116 116 LEU C C 116 178.365 178.365 175.993 2.372 25757 13276 1 16 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.193 1.155 25757 13277 1 16 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.492 -0.203 25757 13278 1 16 . 1 1 116 116 LEU H H 116 8.066 8.066 7.985 0.081 25757 13279 1 16 . 1 1 117 117 THR N N 117 114.324 114.324 113.951 0.373 25757 13280 1 16 . 1 1 117 117 THR HA H 117 4.713 4.713 4.597 0.116 25757 13281 1 16 . 1 1 117 117 THR C C 117 175.539 175.539 174.468 1.071 25757 13282 1 16 . 1 1 117 117 THR CA C 117 60.756 60.756 59.302 1.454 25757 13283 1 16 . 1 1 117 117 THR CB C 117 71.144 71.144 70.556 0.588 25757 13284 1 16 . 1 1 117 117 THR H H 117 9.228 9.228 8.560 0.668 25757 13285 1 16 . 1 1 118 118 ASP N N 118 121.016 121.016 122.128 -1.112 25757 13286 1 16 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.327 -0.172 25757 13287 1 16 . 1 1 118 118 ASP H H 118 8.919 8.919 8.764 0.155 25757 13288 1 16 . 1 1 119 119 GLU N N 119 121.016 121.016 118.747 2.269 25757 13289 1 16 . 1 1 119 119 GLU C C 119 179.204 179.204 178.524 0.680 25757 13290 1 16 . 1 1 119 119 GLU CA C 119 58.070 58.070 58.965 -0.895 25757 13291 1 16 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.337 -0.293 25757 13292 1 16 . 1 1 119 119 GLU H H 119 8.919 8.919 8.092 0.827 25757 13293 1 16 . 1 1 120 120 GLU N N 120 120.566 120.566 120.994 -0.428 25757 13294 1 16 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.874 0.127 25757 13295 1 16 . 1 1 120 120 GLU C C 120 180.329 180.329 178.768 1.561 25757 13296 1 16 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.610 -0.519 25757 13297 1 16 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.392 1.246 25757 13298 1 16 . 1 1 120 120 GLU H H 120 7.732 7.732 7.528 0.204 25757 13299 1 16 . 1 1 121 121 VAL N N 121 121.875 121.875 119.075 2.800 25757 13300 1 16 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.493 -0.028 25757 13301 1 16 . 1 1 121 121 VAL C C 121 177.477 177.477 177.872 -0.395 25757 13302 1 16 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.473 0.698 25757 13303 1 16 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.568 -0.134 25757 13304 1 16 . 1 1 121 121 VAL H H 121 8.104 8.104 7.410 0.694 25757 13305 1 16 . 1 1 122 122 ASP N N 122 120.566 120.566 119.899 0.667 25757 13306 1 16 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.216 0.119 25757 13307 1 16 . 1 1 122 122 ASP C C 122 179.298 179.298 178.206 1.092 25757 13308 1 16 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.820 0.019 25757 13309 1 16 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.796 -0.484 25757 13310 1 16 . 1 1 122 122 ASP H H 122 8.089 8.089 8.180 -0.091 25757 13311 1 16 . 1 1 123 123 GLU N N 123 119.821 119.821 119.408 0.413 25757 13312 1 16 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.056 -0.007 25757 13313 1 16 . 1 1 123 123 GLU C C 123 178.749 178.749 178.927 -0.178 25757 13314 1 16 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.833 0.485 25757 13315 1 16 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.548 -0.162 25757 13316 1 16 . 1 1 123 123 GLU H H 123 8.105 8.105 8.127 -0.022 25757 13317 1 16 . 1 1 124 124 MET N N 124 119.288 119.288 119.987 -0.699 25757 13318 1 16 . 1 1 124 124 MET C C 124 180.865 180.865 178.533 2.332 25757 13319 1 16 . 1 1 124 124 MET CA C 124 60.684 60.684 59.650 1.034 25757 13320 1 16 . 1 1 124 124 MET CB C 124 33.141 33.141 32.526 0.615 25757 13321 1 16 . 1 1 124 124 MET H H 124 7.726 7.726 8.070 -0.344 25757 13322 1 16 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.937 -0.208 25757 13323 1 16 . 1 1 125 125 ILE C C 125 177.341 177.341 178.449 -1.108 25757 13324 1 16 . 1 1 125 125 ILE CA C 125 63.801 63.801 64.205 -0.404 25757 13325 1 16 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.722 -1.157 25757 13326 1 16 . 1 1 126 126 ARG N N 126 118.555 118.555 119.788 -1.233 25757 13327 1 16 . 1 1 126 126 ARG C C 126 179.164 179.164 177.916 1.248 25757 13328 1 16 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.372 0.552 25757 13329 1 16 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.196 -0.331 25757 13330 1 16 . 1 1 126 126 ARG H H 126 8.380 8.380 8.200 0.180 25757 13331 1 16 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.337 -0.412 25757 13332 1 16 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.887 1.170 25757 13333 1 16 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.399 0.429 25757 13334 1 16 . 1 1 128 128 ALA N N 128 116.764 116.764 120.434 -3.670 25757 13335 1 16 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.058 0.359 25757 13336 1 16 . 1 1 128 128 ALA C C 128 177.885 177.885 177.107 0.778 25757 13337 1 16 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.244 -1.289 25757 13338 1 16 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.381 3.186 25757 13339 1 16 . 1 1 128 128 ALA H H 128 7.152 7.152 8.177 -1.025 25757 13340 1 16 . 1 1 129 129 ASP N N 129 117.762 117.762 117.989 -0.227 25757 13341 1 16 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.144 -0.667 25757 13342 1 16 . 1 1 129 129 ASP C C 129 175.935 175.935 177.214 -1.279 25757 13343 1 16 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.380 2.135 25757 13344 1 16 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.439 -0.694 25757 13345 1 16 . 1 1 129 129 ASP H H 129 8.007 8.007 7.809 0.198 25757 13346 1 16 . 1 1 130 130 ILE N N 130 128.249 128.249 121.990 6.259 25757 13347 1 16 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.037 -0.173 25757 13348 1 16 . 1 1 130 130 ILE C C 130 177.764 177.764 176.943 0.821 25757 13349 1 16 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.518 0.030 25757 13350 1 16 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.275 0.373 25757 13351 1 16 . 1 1 130 130 ILE H H 130 8.412 8.412 8.042 0.370 25757 13352 1 16 . 1 1 131 131 ASP N N 131 116.430 116.430 118.753 -2.323 25757 13353 1 16 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.699 -0.165 25757 13354 1 16 . 1 1 131 131 ASP C C 131 178.313 178.313 176.414 1.899 25757 13355 1 16 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.353 -0.469 25757 13356 1 16 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.046 -1.084 25757 13357 1 16 . 1 1 131 131 ASP H H 131 8.254 8.254 7.986 0.268 25757 13358 1 16 . 1 1 132 132 GLY N N 132 108.460 108.460 108.668 -0.208 25757 13359 1 16 . 1 1 132 132 GLY C C 132 175.211 175.211 174.906 0.305 25757 13360 1 16 . 1 1 132 132 GLY CA C 132 47.603 47.603 46.162 1.441 25757 13361 1 16 . 1 1 132 132 GLY H H 132 7.547 7.547 7.866 -0.319 25757 13362 1 16 . 1 1 133 133 ASP N N 133 120.909 120.909 119.541 1.368 25757 13363 1 16 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.547 -0.084 25757 13364 1 16 . 1 1 133 133 ASP C C 133 177.691 177.691 177.578 0.113 25757 13365 1 16 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.494 1.320 25757 13366 1 16 . 1 1 133 133 ASP CB C 133 40.298 40.298 39.852 0.446 25757 13367 1 16 . 1 1 133 133 ASP H H 133 8.339 8.339 8.322 0.017 25757 13368 1 16 . 1 1 134 134 GLY N N 134 112.704 112.704 107.633 5.071 25757 13369 1 16 . 1 1 134 134 GLY C C 134 172.722 172.722 173.546 -0.824 25757 13370 1 16 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.768 0.269 25757 13371 1 16 . 1 1 134 134 GLY H H 134 10.396 10.396 8.060 2.336 25757 13372 1 16 . 1 1 135 135 GLN N N 135 114.799 114.799 118.283 -3.484 25757 13373 1 16 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.315 -0.451 25757 13374 1 16 . 1 1 135 135 GLN C C 135 174.760 174.760 175.333 -0.573 25757 13375 1 16 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.659 -1.338 25757 13376 1 16 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.990 -0.926 25757 13377 1 16 . 1 1 135 135 GLN H H 135 7.975 7.975 8.478 -0.503 25757 13378 1 16 . 1 1 136 136 VAL N N 136 125.364 125.364 126.771 -1.407 25757 13379 1 16 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.650 0.558 25757 13380 1 16 . 1 1 136 136 VAL C C 136 175.831 175.831 175.572 0.259 25757 13381 1 16 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.510 0.307 25757 13382 1 16 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.714 0.960 25757 13383 1 16 . 1 1 136 136 VAL H H 136 9.169 9.169 9.214 -0.045 25757 13384 1 16 . 1 1 137 137 ASN N N 137 129.155 129.155 126.125 3.030 25757 13385 1 16 . 1 1 137 137 ASN C C 137 174.737 174.737 175.690 -0.953 25757 13386 1 16 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.869 -0.518 25757 13387 1 16 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.459 -3.136 25757 13388 1 16 . 1 1 137 137 ASN H H 137 9.652 9.652 8.917 0.735 25757 13389 1 16 . 1 1 138 138 TYR N N 138 118.504 118.504 122.700 -4.196 25757 13390 1 16 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.537 -0.258 25757 13391 1 16 . 1 1 138 138 TYR C C 138 176.174 176.174 177.249 -1.075 25757 13392 1 16 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.124 0.450 25757 13393 1 16 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.307 -0.577 25757 13394 1 16 . 1 1 138 138 TYR H H 138 8.460 8.460 8.771 -0.311 25757 13395 1 16 . 1 1 139 139 GLU N N 139 118.644 118.644 117.250 1.394 25757 13396 1 16 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.828 -0.280 25757 13397 1 16 . 1 1 139 139 GLU C C 139 180.265 180.265 178.788 1.477 25757 13398 1 16 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.221 0.265 25757 13399 1 16 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.262 -0.271 25757 13400 1 16 . 1 1 139 139 GLU H H 139 8.136 8.136 8.005 0.131 25757 13401 1 16 . 1 1 140 140 GLU N N 140 120.030 120.030 117.409 2.621 25757 13402 1 16 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.024 -0.136 25757 13403 1 16 . 1 1 140 140 GLU C C 140 179.627 179.627 177.980 1.647 25757 13404 1 16 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.101 0.576 25757 13405 1 16 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.259 0.468 25757 13406 1 16 . 1 1 140 140 GLU H H 140 8.798 8.798 8.123 0.675 25757 13407 1 16 . 1 1 141 141 PHE N N 141 123.154 123.154 122.216 0.938 25757 13408 1 16 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.782 -0.085 25757 13409 1 16 . 1 1 141 141 PHE C C 141 176.952 176.952 176.899 0.053 25757 13410 1 16 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.283 0.769 25757 13411 1 16 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.030 1.101 25757 13412 1 16 . 1 1 141 141 PHE H H 141 8.633 8.633 7.960 0.673 25757 13413 1 16 . 1 1 142 142 VAL N N 142 120.046 120.046 113.504 6.542 25757 13414 1 16 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.541 -0.585 25757 13415 1 16 . 1 1 142 142 VAL C C 142 179.627 179.627 177.629 1.998 25757 13416 1 16 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.652 1.591 25757 13417 1 16 . 1 1 142 142 VAL CB C 142 31.140 31.140 31.481 -0.341 25757 13418 1 16 . 1 1 142 142 VAL H H 142 8.894 8.894 7.660 1.234 25757 13419 1 16 . 1 1 143 143 GLN N N 143 118.996 118.996 119.851 -0.855 25757 13420 1 16 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.041 -0.265 25757 13421 1 16 . 1 1 143 143 GLN C C 143 178.443 178.443 177.951 0.492 25757 13422 1 16 . 1 1 143 143 GLN CA C 143 59.129 59.129 57.726 1.403 25757 13423 1 16 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.769 -1.026 25757 13424 1 16 . 1 1 143 143 GLN H H 143 7.627 7.627 7.429 0.198 25757 13425 1 16 . 1 1 144 144 MET N N 144 116.361 116.361 119.038 -2.677 25757 13426 1 16 . 1 1 144 144 MET HA H 144 4.169 4.169 4.124 0.045 25757 13427 1 16 . 1 1 144 144 MET C C 144 178.418 178.418 176.265 2.153 25757 13428 1 16 . 1 1 144 144 MET CA C 144 56.137 56.137 57.813 -1.676 25757 13429 1 16 . 1 1 144 144 MET CB C 144 31.095 31.095 32.191 -1.096 25757 13430 1 16 . 1 1 144 144 MET H H 144 7.179 7.179 7.797 -0.618 25757 13431 1 16 . 1 1 145 145 MET N N 145 115.373 115.373 111.046 4.327 25757 13432 1 16 . 1 1 145 145 MET HA H 145 4.334 4.334 4.626 -0.292 25757 13433 1 16 . 1 1 145 145 MET C C 145 177.217 177.217 176.580 0.637 25757 13434 1 16 . 1 1 145 145 MET CA C 145 55.296 55.296 55.825 -0.529 25757 13435 1 16 . 1 1 145 145 MET CB C 145 34.458 34.458 33.612 0.846 25757 13436 1 16 . 1 1 145 145 MET H H 145 7.776 7.776 7.241 0.535 25757 13437 1 16 . 1 1 146 146 THR N N 146 107.988 107.988 113.503 -5.515 25757 13438 1 16 . 1 1 146 146 THR HA H 146 4.239 4.239 4.335 -0.096 25757 13439 1 16 . 1 1 146 146 THR C C 146 175.378 175.378 174.845 0.533 25757 13440 1 16 . 1 1 146 146 THR CA C 146 61.625 61.625 61.446 0.179 25757 13441 1 16 . 1 1 146 146 THR CB C 146 70.817 70.817 67.165 3.652 25757 13442 1 16 . 1 1 146 146 THR H H 146 7.736 7.736 7.619 0.117 25757 13443 1 16 . 1 1 147 147 GLY N N 147 110.157 110.157 111.050 -0.893 25757 13444 1 16 . 1 1 147 147 GLY C C 147 174.046 174.046 173.905 0.141 25757 13445 1 16 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.815 0.729 25757 13446 1 16 . 1 1 147 147 GLY H H 147 7.793 7.793 7.631 0.162 25757 13447 1 16 . 1 1 150 150 THR HA H 150 4.239 4.239 4.385 -0.146 25757 13448 1 16 . 1 1 150 150 THR C C 150 174.397 174.397 174.726 -0.329 25757 13449 1 16 . 1 1 150 150 THR CA C 150 61.260 61.260 61.003 0.257 25757 13450 1 16 . 1 1 150 150 THR CB C 150 70.358 70.358 69.764 0.594 25757 13451 1 16 . 1 1 151 151 ALA N N 151 126.304 126.304 124.615 1.689 25757 13452 1 16 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.285 0.003 25757 13453 1 16 . 1 1 151 151 ALA C C 151 177.678 177.678 177.757 -0.079 25757 13454 1 16 . 1 1 151 151 ALA CA C 151 52.148 52.148 52.218 -0.070 25757 13455 1 16 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.449 -0.030 25757 13456 1 16 . 1 1 151 151 ALA H H 151 8.618 8.618 7.750 0.868 25757 13457 1 16 . 1 1 152 152 ALA N N 152 123.861 123.861 121.425 2.436 25757 13458 1 16 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.391 -0.273 25757 13459 1 16 . 1 1 152 152 ALA C C 152 178.823 178.823 178.371 0.452 25757 13460 1 16 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.475 2.018 25757 13461 1 16 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.227 0.530 25757 13462 1 16 . 1 1 152 152 ALA H H 152 8.354 8.354 8.720 -0.366 25757 13463 1 16 . 1 1 153 153 GLY N N 153 109.984 109.984 107.516 2.468 25757 13464 1 16 . 1 1 153 153 GLY C C 153 174.389 174.389 175.645 -1.256 25757 13465 1 16 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.185 -2.054 25757 13466 1 16 . 1 1 153 153 GLY H H 153 9.028 9.028 8.382 0.646 25757 13467 1 16 . 1 1 154 154 SER N N 154 113.934 113.934 118.137 -4.203 25757 13468 1 16 . 1 1 154 154 SER HA H 154 4.255 4.255 4.029 0.226 25757 13469 1 16 . 1 1 154 154 SER C C 154 177.929 177.929 176.622 1.307 25757 13470 1 16 . 1 1 154 154 SER CA C 154 59.379 59.379 61.435 -2.056 25757 13471 1 16 . 1 1 154 154 SER CB C 154 64.090 64.090 62.214 1.877 25757 13472 1 16 . 1 1 154 154 SER H H 154 7.962 7.962 8.081 -0.119 25757 13473 1 16 . 1 1 155 155 GLY N N 155 115.337 115.337 109.872 5.465 25757 13474 1 16 . 1 1 155 155 GLY C C 155 175.891 175.891 175.594 0.297 25757 13475 1 16 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.716 0.930 25757 13476 1 16 . 1 1 155 155 GLY H H 155 9.451 9.451 7.800 1.651 25757 13477 1 16 . 1 1 156 156 TRP N N 156 119.600 119.600 121.873 -2.273 25757 13478 1 16 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.296 -0.025 25757 13479 1 16 . 1 1 156 156 TRP C C 156 178.947 178.947 178.910 0.037 25757 13480 1 16 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.420 -0.256 25757 13481 1 16 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.074 0.529 25757 13482 1 16 . 1 1 156 156 TRP H H 156 8.542 8.542 7.377 1.165 25757 13483 1 16 . 1 1 157 157 ARG N N 157 118.583 118.583 118.899 -0.316 25757 13484 1 16 . 1 1 157 157 ARG HA H 157 3.982 3.982 3.976 0.006 25757 13485 1 16 . 1 1 157 157 ARG C C 157 177.894 177.894 178.515 -0.621 25757 13486 1 16 . 1 1 157 157 ARG CA C 157 59.338 59.338 58.796 0.542 25757 13487 1 16 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.560 0.497 25757 13488 1 16 . 1 1 157 157 ARG H H 157 7.747 7.747 8.588 -0.841 25757 13489 1 16 . 1 1 158 158 LYS N N 158 117.033 117.033 120.308 -3.275 25757 13490 1 16 . 1 1 158 158 LYS HA H 158 3.943 3.943 3.987 -0.044 25757 13491 1 16 . 1 1 158 158 LYS C C 158 176.973 176.973 178.992 -2.019 25757 13492 1 16 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.355 0.019 25757 13493 1 16 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.317 -0.026 25757 13494 1 16 . 1 1 158 158 LYS H H 158 7.529 7.529 8.012 -0.483 25757 13495 1 16 . 1 1 159 159 ILE N N 159 116.553 116.553 120.115 -3.562 25757 13496 1 16 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.756 -0.212 25757 13497 1 16 . 1 1 159 159 ILE C C 159 176.894 176.894 177.069 -0.175 25757 13498 1 16 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.091 0.425 25757 13499 1 16 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.030 -0.226 25757 13500 1 16 . 1 1 159 159 ILE H H 159 7.348 7.348 8.156 -0.808 25757 13501 1 16 . 1 1 160 160 LYS N N 160 119.278 119.278 120.436 -1.158 25757 13502 1 16 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.281 -0.242 25757 13503 1 16 . 1 1 160 160 LYS C C 160 178.566 178.566 179.233 -0.667 25757 13504 1 16 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.976 0.398 25757 13505 1 16 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.548 0.270 25757 13506 1 16 . 1 1 160 160 LYS H H 160 8.225 8.225 8.127 0.098 25757 13507 1 16 . 1 1 161 161 LEU N N 161 117.056 117.056 120.012 -2.956 25757 13508 1 16 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.051 0.009 25757 13509 1 16 . 1 1 161 161 LEU C C 161 178.977 178.977 178.625 0.352 25757 13510 1 16 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.901 -0.877 25757 13511 1 16 . 1 1 161 161 LEU CB C 161 41.982 41.982 42.009 -0.027 25757 13512 1 16 . 1 1 161 161 LEU H H 161 8.057 8.057 8.324 -0.267 25757 13513 1 16 . 1 1 162 162 ALA N N 162 121.814 121.814 121.704 0.110 25757 13514 1 16 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.153 -0.061 25757 13515 1 16 . 1 1 162 162 ALA C C 162 178.374 178.374 179.771 -1.397 25757 13516 1 16 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.477 0.313 25757 13517 1 16 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.625 -0.300 25757 13518 1 16 . 1 1 162 162 ALA H H 162 8.170 8.170 8.315 -0.145 25757 13519 1 16 . 1 1 163 163 VAL N N 163 115.449 115.449 115.683 -0.234 25757 13520 1 16 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.903 -0.285 25757 13521 1 16 . 1 1 163 163 VAL C C 163 178.362 178.362 177.523 0.839 25757 13522 1 16 . 1 1 163 163 VAL CA C 163 66.272 66.272 64.785 1.486 25757 13523 1 16 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.721 1.316 25757 13524 1 16 . 1 1 163 163 VAL H H 163 8.499 8.499 8.174 0.325 25757 13525 1 16 . 1 1 164 164 ARG N N 164 115.775 115.775 121.088 -5.313 25757 13526 1 16 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.135 0.062 25757 13527 1 16 . 1 1 164 164 ARG C C 164 178.938 178.938 177.959 0.979 25757 13528 1 16 . 1 1 164 164 ARG CA C 164 57.683 57.683 59.124 -1.441 25757 13529 1 16 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.528 -0.694 25757 13530 1 16 . 1 1 164 164 ARG H H 164 8.165 8.165 8.167 -0.002 25757 13531 1 16 . 1 1 165 165 GLY N N 165 105.570 105.570 105.521 0.049 25757 13532 1 16 . 1 1 165 165 GLY C C 165 173.134 173.134 175.173 -2.039 25757 13533 1 16 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.407 1.335 25757 13534 1 16 . 1 1 165 165 GLY H H 165 8.455 8.455 8.298 0.157 25757 13535 1 16 . 1 1 166 166 ALA N N 166 120.648 120.648 122.592 -1.944 25757 13536 1 16 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.100 0.242 25757 13537 1 16 . 1 1 166 166 ALA C C 166 176.155 176.155 176.982 -0.827 25757 13538 1 16 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.882 -2.109 25757 13539 1 16 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.039 0.439 25757 13540 1 16 . 1 1 166 166 ALA H H 166 7.826 7.826 7.746 0.080 25757 13541 1 16 . 1 1 167 167 GLN N N 167 117.315 117.315 117.977 -0.662 25757 13542 1 16 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.390 -0.113 25757 13543 1 16 . 1 1 167 167 GLN C C 167 175.571 175.571 174.755 0.816 25757 13544 1 16 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.715 1.212 25757 13545 1 16 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.825 0.360 25757 13546 1 16 . 1 1 167 167 GLN H H 167 7.498 7.498 7.650 -0.152 25757 13547 1 16 . 1 1 168 168 ALA N N 168 126.706 126.706 130.627 -3.921 25757 13548 1 16 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.168 0.111 25757 13549 1 16 . 1 1 168 168 ALA C C 168 177.227 177.227 176.494 0.733 25757 13550 1 16 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.364 -1.298 25757 13551 1 16 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.351 0.355 25757 13552 1 16 . 1 1 168 168 ALA H H 168 8.534 8.534 8.569 -0.035 25757 13553 1 17 . 1 1 9 9 ILE N N 9 116.733 116.733 119.878 -3.145 25757 13554 1 17 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.791 -0.034 25757 13555 1 17 . 1 1 9 9 ILE C C 9 177.828 177.828 177.285 0.543 25757 13556 1 17 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.165 3.439 25757 13557 1 17 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.868 -0.270 25757 13558 1 17 . 1 1 9 9 ILE H H 9 7.366 7.366 8.032 -0.666 25757 13559 1 17 . 1 1 10 10 ALA N N 10 121.080 121.080 123.546 -2.466 25757 13560 1 17 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.909 0.166 25757 13561 1 17 . 1 1 10 10 ALA C C 10 180.921 180.921 179.159 1.762 25757 13562 1 17 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.368 0.235 25757 13563 1 17 . 1 1 10 10 ALA CB C 10 17.984 17.984 18.106 -0.122 25757 13564 1 17 . 1 1 10 10 ALA H H 10 8.039 8.039 8.166 -0.127 25757 13565 1 17 . 1 1 11 11 GLU N N 11 119.580 119.580 118.571 1.009 25757 13566 1 17 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.895 0.194 25757 13567 1 17 . 1 1 11 11 GLU C C 11 179.561 179.561 178.990 0.571 25757 13568 1 17 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.231 0.654 25757 13569 1 17 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.011 0.452 25757 13570 1 17 . 1 1 11 11 GLU H H 11 7.741 7.741 8.392 -0.651 25757 13571 1 17 . 1 1 12 12 PHE N N 12 118.509 118.509 118.061 0.448 25757 13572 1 17 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.397 0.429 25757 13573 1 17 . 1 1 12 12 PHE C C 12 179.000 179.000 178.132 0.868 25757 13574 1 17 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.301 0.863 25757 13575 1 17 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.968 0.143 25757 13576 1 17 . 1 1 12 12 PHE H H 12 8.470 8.470 6.821 1.649 25757 13577 1 17 . 1 1 13 13 LYS N N 13 123.523 123.523 120.261 3.262 25757 13578 1 17 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.076 -0.050 25757 13579 1 17 . 1 1 13 13 LYS C C 13 179.260 179.260 179.190 0.070 25757 13580 1 17 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.627 0.537 25757 13581 1 17 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.111 -0.278 25757 13582 1 17 . 1 1 13 13 LYS H H 13 9.171 9.171 8.232 0.939 25757 13583 1 17 . 1 1 14 14 GLU N N 14 120.415 120.415 118.872 1.543 25757 13584 1 17 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.167 -0.072 25757 13585 1 17 . 1 1 14 14 GLU C C 14 179.851 179.851 179.035 0.816 25757 13586 1 17 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.312 0.274 25757 13587 1 17 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.195 0.366 25757 13588 1 17 . 1 1 14 14 GLU H H 14 7.822 7.822 8.263 -0.441 25757 13589 1 17 . 1 1 15 15 ALA N N 15 122.143 122.143 123.035 -0.892 25757 13590 1 17 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.142 -0.012 25757 13591 1 17 . 1 1 15 15 ALA C C 15 178.222 178.222 179.440 -1.218 25757 13592 1 17 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.083 0.107 25757 13593 1 17 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.746 -0.244 25757 13594 1 17 . 1 1 15 15 ALA H H 15 8.244 8.244 8.181 0.063 25757 13595 1 17 . 1 1 16 16 PHE N N 16 119.809 119.809 118.346 1.463 25757 13596 1 17 . 1 1 16 16 PHE HA H 16 4.012 4.012 3.929 0.083 25757 13597 1 17 . 1 1 16 16 PHE C C 16 177.444 177.444 176.793 0.651 25757 13598 1 17 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.072 1.992 25757 13599 1 17 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.756 -0.324 25757 13600 1 17 . 1 1 16 16 PHE H H 16 8.891 8.891 8.480 0.411 25757 13601 1 17 . 1 1 17 17 SER N N 17 112.631 112.631 116.560 -3.929 25757 13602 1 17 . 1 1 17 17 SER HA H 17 4.034 4.034 3.884 0.150 25757 13603 1 17 . 1 1 17 17 SER C C 17 174.675 174.675 176.014 -1.339 25757 13604 1 17 . 1 1 17 17 SER CA C 17 61.507 61.507 62.002 -0.495 25757 13605 1 17 . 1 1 17 17 SER CB C 17 63.414 63.414 63.373 0.041 25757 13606 1 17 . 1 1 17 17 SER H H 17 7.910 7.910 8.245 -0.335 25757 13607 1 17 . 1 1 18 18 LEU N N 18 120.614 120.614 117.359 3.255 25757 13608 1 17 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.253 -0.241 25757 13609 1 17 . 1 1 18 18 LEU C C 18 177.366 177.366 178.038 -0.672 25757 13610 1 17 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.039 0.347 25757 13611 1 17 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.700 -0.105 25757 13612 1 17 . 1 1 18 18 LEU H H 18 7.423 7.423 7.841 -0.418 25757 13613 1 17 . 1 1 19 19 PHE N N 19 114.602 114.602 117.870 -3.268 25757 13614 1 17 . 1 1 19 19 PHE C C 19 176.961 176.961 176.095 0.866 25757 13615 1 17 . 1 1 19 19 PHE CA C 19 59.484 59.484 59.844 -0.360 25757 13616 1 17 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.029 1.740 25757 13617 1 17 . 1 1 19 19 PHE H H 19 7.254 7.254 7.227 0.027 25757 13618 1 17 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.706 -0.131 25757 13619 1 17 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.309 -1.661 25757 13620 1 17 . 1 1 22 22 ASP CB C 22 40.010 40.010 41.352 -1.342 25757 13621 1 17 . 1 1 23 23 GLY N N 23 108.244 108.244 110.194 -1.950 25757 13622 1 17 . 1 1 23 23 GLY C C 23 175.188 175.188 174.913 0.275 25757 13623 1 17 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.119 1.284 25757 13624 1 17 . 1 1 23 23 GLY H H 23 7.555 7.555 7.895 -0.340 25757 13625 1 17 . 1 1 24 24 ASP N N 24 120.667 120.667 120.059 0.608 25757 13626 1 17 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.640 -0.171 25757 13627 1 17 . 1 1 24 24 ASP C C 24 177.457 177.457 177.744 -0.287 25757 13628 1 17 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.377 0.416 25757 13629 1 17 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.729 -1.213 25757 13630 1 17 . 1 1 24 24 ASP H H 24 8.397 8.397 8.115 0.282 25757 13631 1 17 . 1 1 25 25 GLY N N 25 112.989 112.989 108.670 4.319 25757 13632 1 17 . 1 1 25 25 GLY C C 25 173.639 173.639 173.257 0.382 25757 13633 1 17 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.183 0.318 25757 13634 1 17 . 1 1 25 25 GLY H H 25 10.592 10.592 8.320 2.272 25757 13635 1 17 . 1 1 26 26 THR N N 26 112.948 112.948 113.487 -0.539 25757 13636 1 17 . 1 1 26 26 THR HA H 26 5.282 5.282 5.094 0.188 25757 13637 1 17 . 1 1 26 26 THR C C 26 172.853 172.853 172.970 -0.117 25757 13638 1 17 . 1 1 26 26 THR CA C 26 59.817 59.817 60.943 -1.126 25757 13639 1 17 . 1 1 26 26 THR CB C 26 72.465 72.465 71.477 0.988 25757 13640 1 17 . 1 1 26 26 THR H H 26 8.121 8.121 8.137 -0.016 25757 13641 1 17 . 1 1 27 27 ILE N N 27 127.195 127.195 124.697 2.498 25757 13642 1 17 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.899 0.014 25757 13643 1 17 . 1 1 27 27 ILE C C 27 176.091 176.091 175.655 0.436 25757 13644 1 17 . 1 1 27 27 ILE CA C 27 60.765 60.765 58.460 2.305 25757 13645 1 17 . 1 1 27 27 ILE CB C 27 39.705 39.705 37.924 1.781 25757 13646 1 17 . 1 1 27 27 ILE H H 27 9.867 9.867 8.582 1.285 25757 13647 1 17 . 1 1 28 28 THR N N 28 116.655 116.655 121.674 -5.019 25757 13648 1 17 . 1 1 28 28 THR HA H 28 4.790 4.790 4.967 -0.177 25757 13649 1 17 . 1 1 28 28 THR C C 28 176.696 176.696 176.403 0.293 25757 13650 1 17 . 1 1 28 28 THR CA C 28 59.590 59.590 61.005 -1.415 25757 13651 1 17 . 1 1 28 28 THR CB C 28 72.457 72.457 70.947 1.510 25757 13652 1 17 . 1 1 28 28 THR H H 28 8.457 8.457 8.801 -0.344 25757 13653 1 17 . 1 1 29 29 THR N N 29 111.878 111.878 119.673 -7.795 25757 13654 1 17 . 1 1 29 29 THR HA H 29 4.188 4.188 3.883 0.305 25757 13655 1 17 . 1 1 29 29 THR C C 29 177.399 177.399 176.424 0.975 25757 13656 1 17 . 1 1 29 29 THR CA C 29 66.386 66.386 66.723 -0.337 25757 13657 1 17 . 1 1 29 29 THR CB C 29 67.726 67.726 68.490 -0.764 25757 13658 1 17 . 1 1 29 29 THR H H 29 9.211 9.211 8.595 0.617 25757 13659 1 17 . 1 1 30 30 LYS N N 30 121.140 121.140 121.178 -0.038 25757 13660 1 17 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.894 0.183 25757 13661 1 17 . 1 1 30 30 LYS C C 30 179.793 179.793 178.848 0.945 25757 13662 1 17 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.826 -0.534 25757 13663 1 17 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.770 0.676 25757 13664 1 17 . 1 1 30 30 LYS H H 30 7.580 7.580 7.514 0.066 25757 13665 1 17 . 1 1 31 31 GLU N N 31 121.865 121.865 119.679 2.186 25757 13666 1 17 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.824 0.170 25757 13667 1 17 . 1 1 31 31 GLU C C 31 179.355 179.355 178.567 0.788 25757 13668 1 17 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.748 -0.115 25757 13669 1 17 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.355 0.496 25757 13670 1 17 . 1 1 31 31 GLU H H 31 7.708 7.708 7.591 0.117 25757 13671 1 17 . 1 1 32 32 LEU N N 32 120.597 120.597 120.324 0.273 25757 13672 1 17 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.594 0.522 25757 13673 1 17 . 1 1 32 32 LEU C C 32 178.885 178.885 178.579 0.306 25757 13674 1 17 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.107 0.254 25757 13675 1 17 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.718 1.318 25757 13676 1 17 . 1 1 32 32 LEU H H 32 8.688 8.688 7.456 1.232 25757 13677 1 17 . 1 1 33 33 GLY N N 33 104.837 104.837 106.047 -1.210 25757 13678 1 17 . 1 1 33 33 GLY C C 33 175.123 175.123 175.906 -0.783 25757 13679 1 17 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.427 0.820 25757 13680 1 17 . 1 1 33 33 GLY H H 33 8.694 8.694 8.587 0.107 25757 13681 1 17 . 1 1 34 34 THR N N 34 117.631 117.631 119.054 -1.423 25757 13682 1 17 . 1 1 34 34 THR HA H 34 3.899 3.899 3.903 -0.004 25757 13683 1 17 . 1 1 34 34 THR C C 34 176.951 176.951 176.664 0.287 25757 13684 1 17 . 1 1 34 34 THR CA C 34 67.234 67.234 67.008 0.226 25757 13685 1 17 . 1 1 34 34 THR CB C 34 68.863 68.863 68.473 0.390 25757 13686 1 17 . 1 1 34 34 THR H H 34 7.960 7.960 7.954 0.006 25757 13687 1 17 . 1 1 35 35 VAL N N 35 121.659 121.659 122.013 -0.354 25757 13688 1 17 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.533 -0.016 25757 13689 1 17 . 1 1 35 35 VAL C C 35 178.265 178.265 177.394 0.871 25757 13690 1 17 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.333 0.342 25757 13691 1 17 . 1 1 35 35 VAL CB C 35 31.293 31.293 30.907 0.386 25757 13692 1 17 . 1 1 35 35 VAL H H 35 7.358 7.358 8.211 -0.853 25757 13693 1 17 . 1 1 36 36 MET N N 36 117.456 117.456 115.429 2.027 25757 13694 1 17 . 1 1 36 36 MET C C 36 179.088 179.088 178.677 0.411 25757 13695 1 17 . 1 1 36 36 MET CA C 36 60.477 60.477 58.091 2.386 25757 13696 1 17 . 1 1 36 36 MET CB C 36 32.443 32.443 32.175 0.268 25757 13697 1 17 . 1 1 36 36 MET H H 36 8.194 8.194 7.959 0.235 25757 13698 1 17 . 1 1 37 37 ARG CA C 37 59.147 59.147 57.875 1.272 25757 13699 1 17 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.843 0.507 25757 13700 1 17 . 1 1 38 38 SER HA H 38 4.085 4.085 4.416 -0.331 25757 13701 1 17 . 1 1 38 38 SER C C 38 173.788 173.788 174.142 -0.354 25757 13702 1 17 . 1 1 38 38 SER CA C 38 61.617 61.617 60.170 1.447 25757 13703 1 17 . 1 1 38 38 SER CB C 38 62.943 62.943 63.165 -0.222 25757 13704 1 17 . 1 1 39 39 LEU N N 39 119.003 119.003 120.187 -1.184 25757 13705 1 17 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.506 -0.012 25757 13706 1 17 . 1 1 39 39 LEU C C 39 176.470 176.470 176.999 -0.529 25757 13707 1 17 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.116 0.563 25757 13708 1 17 . 1 1 39 39 LEU CB C 39 41.514 41.514 41.005 0.509 25757 13709 1 17 . 1 1 39 39 LEU H H 39 7.230 7.230 7.266 -0.036 25757 13710 1 17 . 1 1 40 40 GLY N N 40 105.026 105.026 106.809 -1.783 25757 13711 1 17 . 1 1 40 40 GLY C C 40 174.322 174.322 174.158 0.164 25757 13712 1 17 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.432 0.783 25757 13713 1 17 . 1 1 40 40 GLY H H 40 7.698 7.698 7.601 0.097 25757 13714 1 17 . 1 1 41 41 GLN N N 41 117.929 117.929 119.698 -1.769 25757 13715 1 17 . 1 1 41 41 GLN C C 41 174.557 174.557 174.475 0.082 25757 13716 1 17 . 1 1 41 41 GLN CB C 41 30.844 30.844 31.795 -0.951 25757 13717 1 17 . 1 1 41 41 GLN H H 41 7.866 7.866 7.364 0.502 25757 13718 1 17 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.493 0.243 25757 13719 1 17 . 1 1 43 43 PRO C C 43 177.805 177.805 176.045 1.760 25757 13720 1 17 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.912 -0.407 25757 13721 1 17 . 1 1 43 43 PRO CB C 43 32.162 32.162 31.969 0.193 25757 13722 1 17 . 1 1 44 44 THR N N 44 113.167 113.167 116.986 -3.819 25757 13723 1 17 . 1 1 44 44 THR HA H 44 4.684 4.684 4.448 0.236 25757 13724 1 17 . 1 1 44 44 THR C C 44 175.139 175.139 175.776 -0.637 25757 13725 1 17 . 1 1 44 44 THR CA C 44 60.556 60.556 59.049 1.507 25757 13726 1 17 . 1 1 44 44 THR CB C 44 71.064 71.064 71.291 -0.227 25757 13727 1 17 . 1 1 44 44 THR H H 44 8.798 8.798 7.978 0.820 25757 13728 1 17 . 1 1 45 45 GLU N N 45 120.673 120.673 122.070 -1.397 25757 13729 1 17 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.939 0.052 25757 13730 1 17 . 1 1 45 45 GLU C C 45 178.940 178.940 178.102 0.838 25757 13731 1 17 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.547 -0.646 25757 13732 1 17 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.599 -0.570 25757 13733 1 17 . 1 1 45 45 GLU H H 45 8.812 8.812 9.015 -0.203 25757 13734 1 17 . 1 1 46 46 ALA N N 46 120.576 120.576 121.297 -0.721 25757 13735 1 17 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.051 -0.084 25757 13736 1 17 . 1 1 46 46 ALA C C 46 180.290 180.290 179.776 0.514 25757 13737 1 17 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.182 -0.263 25757 13738 1 17 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.205 -0.044 25757 13739 1 17 . 1 1 46 46 ALA H H 46 8.276 8.276 8.171 0.105 25757 13740 1 17 . 1 1 47 47 GLU N N 47 116.104 116.104 119.318 -3.214 25757 13741 1 17 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.054 -0.054 25757 13742 1 17 . 1 1 47 47 GLU C C 47 180.224 180.224 179.210 1.014 25757 13743 1 17 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.386 -0.455 25757 13744 1 17 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.262 0.727 25757 13745 1 17 . 1 1 47 47 GLU H H 47 7.425 7.425 7.551 -0.126 25757 13746 1 17 . 1 1 48 48 LEU N N 48 120.425 120.425 119.950 0.475 25757 13747 1 17 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.841 0.209 25757 13748 1 17 . 1 1 48 48 LEU C C 48 178.551 178.551 179.167 -0.616 25757 13749 1 17 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.497 -0.658 25757 13750 1 17 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.321 1.248 25757 13751 1 17 . 1 1 48 48 LEU H H 48 8.121 8.121 8.054 0.067 25757 13752 1 17 . 1 1 49 49 GLN N N 49 118.372 118.372 118.326 0.046 25757 13753 1 17 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.873 -0.111 25757 13754 1 17 . 1 1 49 49 GLN C C 49 178.567 178.567 178.734 -0.167 25757 13755 1 17 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.180 -0.317 25757 13756 1 17 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.388 -0.146 25757 13757 1 17 . 1 1 49 49 GLN H H 49 8.302 8.302 8.233 0.069 25757 13758 1 17 . 1 1 50 50 ASP N N 50 119.992 119.992 119.926 0.066 25757 13759 1 17 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.343 0.017 25757 13760 1 17 . 1 1 50 50 ASP C C 50 178.600 178.600 178.511 0.089 25757 13761 1 17 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.110 0.593 25757 13762 1 17 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.546 -0.079 25757 13763 1 17 . 1 1 50 50 ASP H H 50 8.150 8.150 8.308 -0.158 25757 13764 1 17 . 1 1 51 51 MET N N 51 119.238 119.238 119.337 -0.099 25757 13765 1 17 . 1 1 51 51 MET HA H 51 3.981 3.981 4.082 -0.101 25757 13766 1 17 . 1 1 51 51 MET C C 51 179.006 179.006 178.624 0.382 25757 13767 1 17 . 1 1 51 51 MET CA C 51 59.443 59.443 58.406 1.037 25757 13768 1 17 . 1 1 51 51 MET CB C 51 33.380 33.380 32.514 0.866 25757 13769 1 17 . 1 1 51 51 MET H H 51 7.844 7.844 8.023 -0.179 25757 13770 1 17 . 1 1 52 52 ILE N N 52 118.161 118.161 117.695 0.466 25757 13771 1 17 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.728 -0.250 25757 13772 1 17 . 1 1 52 52 ILE C C 52 177.847 177.847 178.656 -0.809 25757 13773 1 17 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.172 0.823 25757 13774 1 17 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.593 0.530 25757 13775 1 17 . 1 1 52 52 ILE H H 52 7.686 7.686 8.223 -0.537 25757 13776 1 17 . 1 1 53 53 ASN N N 53 117.884 117.884 116.519 1.365 25757 13777 1 17 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.463 -0.098 25757 13778 1 17 . 1 1 53 53 ASN C C 53 177.515 177.515 176.173 1.342 25757 13779 1 17 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.464 0.743 25757 13780 1 17 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.811 -0.733 25757 13781 1 17 . 1 1 53 53 ASN H H 53 8.713 8.713 8.312 0.401 25757 13782 1 17 . 1 1 54 54 GLU N N 54 116.178 116.178 116.666 -0.488 25757 13783 1 17 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.316 -0.327 25757 13784 1 17 . 1 1 54 54 GLU C C 54 177.557 177.557 177.602 -0.045 25757 13785 1 17 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.450 1.540 25757 13786 1 17 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.779 -0.316 25757 13787 1 17 . 1 1 54 54 GLU H H 54 7.530 7.530 7.927 -0.397 25757 13788 1 17 . 1 1 55 55 VAL N N 55 107.164 107.164 109.534 -2.370 25757 13789 1 17 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.451 0.071 25757 13790 1 17 . 1 1 55 55 VAL C C 55 175.602 175.602 173.876 1.726 25757 13791 1 17 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.663 -0.310 25757 13792 1 17 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.375 0.228 25757 13793 1 17 . 1 1 55 55 VAL H H 55 7.175 7.175 7.537 -0.362 25757 13794 1 17 . 1 1 56 56 ASP N N 56 122.126 122.126 119.572 2.554 25757 13795 1 17 . 1 1 56 56 ASP HA H 56 4.599 4.599 4.874 -0.275 25757 13796 1 17 . 1 1 56 56 ASP C C 56 176.182 176.182 175.723 0.459 25757 13797 1 17 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.822 -0.016 25757 13798 1 17 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.757 -2.487 25757 13799 1 17 . 1 1 56 56 ASP H H 56 7.569 7.569 7.462 0.107 25757 13800 1 17 . 1 1 57 57 ALA N N 57 103.782 103.782 128.458 -24.676 25757 13801 1 17 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.239 -0.059 25757 13802 1 17 . 1 1 57 57 ALA C C 57 178.584 178.584 178.068 0.516 25757 13803 1 17 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.708 0.636 25757 13804 1 17 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.271 0.253 25757 13805 1 17 . 1 1 57 57 ALA H H 57 8.515 8.515 8.698 -0.183 25757 13806 1 17 . 1 1 58 58 ASP N N 58 113.602 113.602 119.822 -6.220 25757 13807 1 17 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.547 0.039 25757 13808 1 17 . 1 1 58 58 ASP C C 58 177.756 177.756 177.174 0.582 25757 13809 1 17 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.802 -2.040 25757 13810 1 17 . 1 1 58 58 ASP CB C 58 39.678 39.678 40.938 -1.260 25757 13811 1 17 . 1 1 58 58 ASP H H 58 8.130 8.130 8.158 -0.028 25757 13812 1 17 . 1 1 59 59 GLY N N 59 109.195 109.195 108.364 0.831 25757 13813 1 17 . 1 1 59 59 GLY C C 59 175.139 175.139 175.112 0.027 25757 13814 1 17 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.202 2.062 25757 13815 1 17 . 1 1 59 59 GLY H H 59 7.694 7.694 8.468 -0.774 25757 13816 1 17 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.705 -0.100 25757 13817 1 17 . 1 1 61 61 GLY N N 61 113.316 113.316 110.245 3.071 25757 13818 1 17 . 1 1 61 61 GLY C C 61 173.234 173.234 172.801 0.433 25757 13819 1 17 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.139 0.559 25757 13820 1 17 . 1 1 61 61 GLY H H 61 10.633 10.633 8.719 1.914 25757 13821 1 17 . 1 1 62 62 THR N N 62 108.892 108.892 111.959 -3.067 25757 13822 1 17 . 1 1 62 62 THR HA H 62 4.736 4.736 5.022 -0.286 25757 13823 1 17 . 1 1 62 62 THR C C 62 173.091 173.091 173.666 -0.575 25757 13824 1 17 . 1 1 62 62 THR CA C 62 59.617 59.617 59.989 -0.372 25757 13825 1 17 . 1 1 62 62 THR CB C 62 72.004 72.004 71.893 0.111 25757 13826 1 17 . 1 1 62 62 THR H H 62 7.673 7.673 7.347 0.326 25757 13827 1 17 . 1 1 63 63 ILE N N 63 123.324 123.324 125.624 -2.300 25757 13828 1 17 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.564 0.565 25757 13829 1 17 . 1 1 63 63 ILE C C 63 175.652 175.652 176.219 -0.567 25757 13830 1 17 . 1 1 63 63 ILE CA C 63 60.486 60.486 61.772 -1.286 25757 13831 1 17 . 1 1 63 63 ILE CB C 63 39.957 39.957 39.401 0.556 25757 13832 1 17 . 1 1 63 63 ILE H H 63 8.907 8.907 8.844 0.063 25757 13833 1 17 . 1 1 64 64 ASP N N 64 128.253 128.253 127.435 0.818 25757 13834 1 17 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.774 0.547 25757 13835 1 17 . 1 1 64 64 ASP C C 64 176.431 176.431 178.135 -1.704 25757 13836 1 17 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.371 -1.040 25757 13837 1 17 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.509 -0.456 25757 13838 1 17 . 1 1 64 64 ASP H H 64 8.864 8.864 8.980 -0.116 25757 13839 1 17 . 1 1 65 65 PHE N N 65 118.583 118.583 119.976 -1.393 25757 13840 1 17 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.361 -0.501 25757 13841 1 17 . 1 1 65 65 PHE C C 65 173.458 173.458 175.796 -2.338 25757 13842 1 17 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.495 0.304 25757 13843 1 17 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.372 -1.492 25757 13844 1 17 . 1 1 65 65 PHE H H 65 8.962 8.962 8.720 0.242 25757 13845 1 17 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.349 -0.231 25757 13846 1 17 . 1 1 66 66 PRO C C 66 180.038 180.038 178.528 1.510 25757 13847 1 17 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.540 1.150 25757 13848 1 17 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.334 -0.657 25757 13849 1 17 . 1 1 67 67 GLU N N 67 118.402 118.402 119.544 -1.142 25757 13850 1 17 . 1 1 67 67 GLU C C 67 178.737 178.737 178.773 -0.036 25757 13851 1 17 . 1 1 67 67 GLU CA C 67 59.008 59.008 60.124 -1.116 25757 13852 1 17 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.349 0.336 25757 13853 1 17 . 1 1 67 67 GLU H H 67 7.953 7.953 8.538 -0.585 25757 13854 1 17 . 1 1 68 68 PHE N N 68 123.421 123.421 119.831 3.590 25757 13855 1 17 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.165 -0.193 25757 13856 1 17 . 1 1 68 68 PHE C C 68 177.184 177.184 176.997 0.187 25757 13857 1 17 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.006 0.332 25757 13858 1 17 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.943 1.026 25757 13859 1 17 . 1 1 68 68 PHE H H 68 8.928 8.928 7.585 1.343 25757 13860 1 17 . 1 1 69 69 LEU N N 69 119.284 119.284 119.057 0.227 25757 13861 1 17 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.444 -0.109 25757 13862 1 17 . 1 1 69 69 LEU C C 69 178.987 178.987 178.930 0.057 25757 13863 1 17 . 1 1 69 69 LEU CA C 69 57.862 57.862 57.764 0.098 25757 13864 1 17 . 1 1 69 69 LEU CB C 69 40.832 40.832 40.439 0.393 25757 13865 1 17 . 1 1 69 69 LEU H H 69 8.374 8.374 7.592 0.782 25757 13866 1 17 . 1 1 70 70 THR N N 70 116.017 116.017 112.232 3.785 25757 13867 1 17 . 1 1 70 70 THR HA H 70 4.338 4.338 3.705 0.633 25757 13868 1 17 . 1 1 70 70 THR C C 70 176.169 176.169 176.862 -0.693 25757 13869 1 17 . 1 1 70 70 THR CA C 70 66.700 66.700 65.988 0.712 25757 13870 1 17 . 1 1 70 70 THR CB C 70 68.379 68.379 68.837 -0.458 25757 13871 1 17 . 1 1 70 70 THR H H 70 7.493 7.493 8.192 -0.699 25757 13872 1 17 . 1 1 71 71 MET N N 71 121.915 121.915 122.591 -0.676 25757 13873 1 17 . 1 1 71 71 MET HA H 71 3.718 3.718 3.910 -0.192 25757 13874 1 17 . 1 1 71 71 MET C C 71 178.190 178.190 177.824 0.366 25757 13875 1 17 . 1 1 71 71 MET CA C 71 59.335 59.335 59.200 0.135 25757 13876 1 17 . 1 1 71 71 MET CB C 71 33.894 33.894 32.520 1.374 25757 13877 1 17 . 1 1 71 71 MET H H 71 7.924 7.924 7.986 -0.062 25757 13878 1 17 . 1 1 72 72 MET N N 72 116.973 116.973 118.058 -1.085 25757 13879 1 17 . 1 1 72 72 MET HA H 72 3.968 3.968 4.013 -0.044 25757 13880 1 17 . 1 1 72 72 MET C C 72 178.211 178.211 178.283 -0.072 25757 13881 1 17 . 1 1 72 72 MET CA C 72 56.059 56.059 57.557 -1.498 25757 13882 1 17 . 1 1 72 72 MET CB C 72 31.639 31.639 31.906 -0.267 25757 13883 1 17 . 1 1 72 72 MET H H 72 8.276 8.276 7.701 0.575 25757 13884 1 17 . 1 1 73 73 ALA N N 73 122.499 122.499 119.856 2.643 25757 13885 1 17 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.863 0.087 25757 13886 1 17 . 1 1 73 73 ALA C C 73 180.231 180.231 179.416 0.815 25757 13887 1 17 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.484 0.469 25757 13888 1 17 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.875 0.157 25757 13889 1 17 . 1 1 73 73 ALA H H 73 8.240 8.240 8.140 0.100 25757 13890 1 17 . 1 1 74 74 ARG N N 74 116.098 116.098 119.103 -3.005 25757 13891 1 17 . 1 1 74 74 ARG HA H 74 3.992 3.992 3.964 0.028 25757 13892 1 17 . 1 1 74 74 ARG C C 74 178.567 178.567 179.001 -0.434 25757 13893 1 17 . 1 1 74 74 ARG CA C 74 58.825 58.825 59.553 -0.728 25757 13894 1 17 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.019 0.056 25757 13895 1 17 . 1 1 74 74 ARG H H 74 7.420 7.420 7.932 -0.512 25757 13896 1 17 . 1 1 75 75 LYS N N 75 119.046 119.046 119.451 -0.405 25757 13897 1 17 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.110 -0.067 25757 13898 1 17 . 1 1 75 75 LYS C C 75 179.045 179.045 179.034 0.011 25757 13899 1 17 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.690 -0.801 25757 13900 1 17 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.953 -0.187 25757 13901 1 17 . 1 1 75 75 LYS H H 75 7.862 7.862 8.063 -0.201 25757 13902 1 17 . 1 1 76 76 MET N N 76 116.772 116.772 119.695 -2.923 25757 13903 1 17 . 1 1 76 76 MET H H 76 8.099 8.099 7.803 0.296 25757 13904 1 17 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.528 0.106 25757 13905 1 17 . 1 1 78 78 ASP C C 78 176.395 176.395 176.640 -0.245 25757 13906 1 17 . 1 1 78 78 ASP CA C 78 54.644 54.644 55.102 -0.458 25757 13907 1 17 . 1 1 78 78 ASP CB C 78 41.474 41.474 40.481 0.993 25757 13908 1 17 . 1 1 79 79 THR N N 79 113.904 113.904 117.324 -3.420 25757 13909 1 17 . 1 1 79 79 THR HA H 79 4.215 4.215 3.946 0.269 25757 13910 1 17 . 1 1 79 79 THR C C 79 174.204 174.204 174.592 -0.388 25757 13911 1 17 . 1 1 79 79 THR CA C 79 62.264 62.264 65.203 -2.939 25757 13912 1 17 . 1 1 79 79 THR CB C 79 69.884 69.884 69.335 0.549 25757 13913 1 17 . 1 1 79 79 THR H H 79 8.039 8.039 7.892 0.147 25757 13914 1 17 . 1 1 80 80 ASP N N 80 123.572 123.572 121.068 2.504 25757 13915 1 17 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.694 0.026 25757 13916 1 17 . 1 1 80 80 ASP C C 80 176.221 176.221 176.035 0.186 25757 13917 1 17 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.891 -0.576 25757 13918 1 17 . 1 1 80 80 ASP CB C 80 41.427 41.427 40.699 0.728 25757 13919 1 17 . 1 1 80 80 ASP H H 80 8.441 8.441 8.438 0.003 25757 13920 1 17 . 1 1 81 81 SER N N 81 117.879 117.879 119.783 -1.904 25757 13921 1 17 . 1 1 81 81 SER HA H 81 3.925 3.925 4.545 -0.620 25757 13922 1 17 . 1 1 81 81 SER C C 81 175.264 175.264 175.322 -0.058 25757 13923 1 17 . 1 1 81 81 SER CA C 81 58.860 58.860 59.140 -0.280 25757 13924 1 17 . 1 1 81 81 SER CB C 81 63.790 63.790 63.541 0.249 25757 13925 1 17 . 1 1 81 81 SER H H 81 8.503 8.503 8.719 -0.216 25757 13926 1 17 . 1 1 82 82 GLU N N 82 123.206 123.206 121.120 2.086 25757 13927 1 17 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.012 0.046 25757 13928 1 17 . 1 1 82 82 GLU C C 82 178.378 178.378 178.379 -0.001 25757 13929 1 17 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.256 -0.670 25757 13930 1 17 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.531 0.072 25757 13931 1 17 . 1 1 82 82 GLU H H 82 8.563 8.563 8.692 -0.129 25757 13932 1 17 . 1 1 83 83 GLU N N 83 119.262 119.262 118.534 0.728 25757 13933 1 17 . 1 1 83 83 GLU HA H 83 3.957 3.957 4.018 -0.061 25757 13934 1 17 . 1 1 83 83 GLU C C 83 178.606 178.606 178.780 -0.174 25757 13935 1 17 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.490 0.179 25757 13936 1 17 . 1 1 83 83 GLU CB C 83 29.355 29.355 28.711 0.644 25757 13937 1 17 . 1 1 83 83 GLU H H 83 7.728 7.728 8.445 -0.717 25757 13938 1 17 . 1 1 84 84 GLU N N 84 118.432 118.432 120.150 -1.718 25757 13939 1 17 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.050 0.057 25757 13940 1 17 . 1 1 84 84 GLU C C 84 179.436 179.436 178.939 0.497 25757 13941 1 17 . 1 1 84 84 GLU CA C 84 59.503 59.503 58.651 0.852 25757 13942 1 17 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.196 -0.089 25757 13943 1 17 . 1 1 84 84 GLU H H 84 8.346 8.346 8.176 0.170 25757 13944 1 17 . 1 1 85 85 ILE N N 85 120.925 120.925 121.983 -1.058 25757 13945 1 17 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.779 -0.031 25757 13946 1 17 . 1 1 85 85 ILE C C 85 177.661 177.661 178.339 -0.678 25757 13947 1 17 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.573 -0.083 25757 13948 1 17 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.849 -0.418 25757 13949 1 17 . 1 1 85 85 ILE H H 85 7.821 7.821 8.226 -0.405 25757 13950 1 17 . 1 1 86 86 ARG N N 86 121.916 121.916 118.834 3.082 25757 13951 1 17 . 1 1 86 86 ARG HA H 86 4.136 4.136 4.109 0.027 25757 13952 1 17 . 1 1 86 86 ARG C C 86 179.208 179.208 179.032 0.176 25757 13953 1 17 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.893 0.478 25757 13954 1 17 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.944 0.154 25757 13955 1 17 . 1 1 86 86 ARG H H 86 8.432 8.432 8.193 0.239 25757 13956 1 17 . 1 1 87 87 GLU N N 87 118.261 118.261 118.752 -0.491 25757 13957 1 17 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.952 0.160 25757 13958 1 17 . 1 1 87 87 GLU C C 87 178.516 178.516 178.717 -0.201 25757 13959 1 17 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.226 -0.201 25757 13960 1 17 . 1 1 87 87 GLU CB C 87 29.170 29.170 28.771 0.399 25757 13961 1 17 . 1 1 87 87 GLU H H 87 8.225 8.225 8.164 0.061 25757 13962 1 17 . 1 1 88 88 ALA N N 88 121.009 121.009 122.883 -1.874 25757 13963 1 17 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.565 0.262 25757 13964 1 17 . 1 1 88 88 ALA C C 88 177.947 177.947 178.476 -0.529 25757 13965 1 17 . 1 1 88 88 ALA CA C 88 54.861 54.861 55.071 -0.209 25757 13966 1 17 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.418 -0.463 25757 13967 1 17 . 1 1 88 88 ALA H H 88 7.789 7.789 7.953 -0.164 25757 13968 1 17 . 1 1 89 89 PHE N N 89 117.164 117.164 118.254 -1.090 25757 13969 1 17 . 1 1 89 89 PHE C C 89 176.134 176.134 177.469 -1.335 25757 13970 1 17 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.370 2.280 25757 13971 1 17 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.618 0.275 25757 13972 1 17 . 1 1 89 89 PHE H H 89 8.337 8.337 7.794 0.543 25757 13973 1 17 . 1 1 90 90 ARG N N 90 114.900 114.900 117.908 -3.008 25757 13974 1 17 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.351 0.563 25757 13975 1 17 . 1 1 90 90 ARG C C 90 178.296 178.296 177.289 1.007 25757 13976 1 17 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.416 0.663 25757 13977 1 17 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.556 -0.463 25757 13978 1 17 . 1 1 90 90 ARG H H 90 7.681 7.681 7.549 0.132 25757 13979 1 17 . 1 1 91 91 VAL N N 91 116.927 116.927 114.957 1.970 25757 13980 1 17 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.828 -0.221 25757 13981 1 17 . 1 1 91 91 VAL C C 91 177.964 177.964 177.063 0.901 25757 13982 1 17 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.679 0.281 25757 13983 1 17 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.857 -0.238 25757 13984 1 17 . 1 1 91 91 VAL H H 91 7.405 7.405 7.455 -0.050 25757 13985 1 17 . 1 1 92 92 PHE N N 92 119.026 119.026 116.783 2.243 25757 13986 1 17 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.347 0.015 25757 13987 1 17 . 1 1 92 92 PHE C C 92 177.639 177.639 176.278 1.361 25757 13988 1 17 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.593 -0.872 25757 13989 1 17 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.815 -0.388 25757 13990 1 17 . 1 1 92 92 PHE H H 92 7.886 7.886 7.583 0.303 25757 13991 1 17 . 1 1 93 93 ASP N N 93 118.238 118.238 118.871 -0.633 25757 13992 1 17 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.951 -0.489 25757 13993 1 17 . 1 1 93 93 ASP C C 93 176.979 176.979 176.837 0.142 25757 13994 1 17 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.569 -1.421 25757 13995 1 17 . 1 1 93 93 ASP CB C 93 38.149 38.149 40.080 -1.931 25757 13996 1 17 . 1 1 93 93 ASP H H 93 8.009 8.009 7.588 0.421 25757 13997 1 17 . 1 1 94 94 LYS N N 94 125.792 125.792 125.306 0.486 25757 13998 1 17 . 1 1 94 94 LYS C C 94 178.213 178.213 177.191 1.022 25757 13999 1 17 . 1 1 94 94 LYS CA C 94 59.318 59.318 57.892 1.426 25757 14000 1 17 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.483 -1.455 25757 14001 1 17 . 1 1 94 94 LYS H H 94 7.428 7.428 8.289 -0.861 25757 14002 1 17 . 1 1 95 95 ASP N N 95 113.833 113.833 115.863 -2.030 25757 14003 1 17 . 1 1 95 95 ASP C C 95 177.718 177.718 176.617 1.101 25757 14004 1 17 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.177 -1.232 25757 14005 1 17 . 1 1 95 95 ASP CB C 95 39.743 39.743 42.110 -2.367 25757 14006 1 17 . 1 1 95 95 ASP H H 95 8.159 8.159 7.914 0.245 25757 14007 1 17 . 1 1 96 96 GLY N N 96 109.414 109.414 110.251 -0.837 25757 14008 1 17 . 1 1 96 96 GLY C C 96 175.093 175.093 175.296 -0.203 25757 14009 1 17 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.782 1.472 25757 14010 1 17 . 1 1 96 96 GLY H H 96 7.848 7.848 7.855 -0.007 25757 14011 1 17 . 1 1 97 97 ASN N N 97 119.590 119.590 119.734 -0.144 25757 14012 1 17 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.644 -0.032 25757 14013 1 17 . 1 1 97 97 ASN C C 97 175.937 175.937 176.689 -0.752 25757 14014 1 17 . 1 1 97 97 ASN CA C 97 52.888 52.888 52.981 -0.093 25757 14015 1 17 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.663 -1.343 25757 14016 1 17 . 1 1 97 97 ASN H H 97 8.338 8.338 8.420 -0.082 25757 14017 1 17 . 1 1 98 98 GLY N N 98 112.940 112.940 108.179 4.761 25757 14018 1 17 . 1 1 98 98 GLY C C 98 172.429 172.429 172.650 -0.221 25757 14019 1 17 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.080 0.012 25757 14020 1 17 . 1 1 98 98 GLY H H 98 10.695 10.695 9.098 1.597 25757 14021 1 17 . 1 1 99 99 TYR N N 99 115.544 115.544 117.404 -1.860 25757 14022 1 17 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.315 -0.228 25757 14023 1 17 . 1 1 99 99 TYR C C 99 174.859 174.859 174.684 0.175 25757 14024 1 17 . 1 1 99 99 TYR CA C 99 56.018 56.018 56.688 -0.670 25757 14025 1 17 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.515 0.838 25757 14026 1 17 . 1 1 99 99 TYR H H 99 7.597 7.597 8.620 -1.023 25757 14027 1 17 . 1 1 100 100 ILE N N 100 127.078 127.078 122.065 5.013 25757 14028 1 17 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.873 -0.084 25757 14029 1 17 . 1 1 100 100 ILE C C 100 175.387 175.387 175.821 -0.434 25757 14030 1 17 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.263 0.743 25757 14031 1 17 . 1 1 100 100 ILE CB C 100 38.790 38.790 41.051 -2.261 25757 14032 1 17 . 1 1 100 100 ILE H H 100 10.267 10.267 8.887 1.380 25757 14033 1 17 . 1 1 101 101 SER N N 101 124.102 124.102 122.664 1.438 25757 14034 1 17 . 1 1 101 101 SER HA H 101 4.417 4.417 5.317 -0.900 25757 14035 1 17 . 1 1 101 101 SER C C 101 175.360 175.360 175.378 -0.018 25757 14036 1 17 . 1 1 101 101 SER CA C 101 56.036 56.036 56.867 -0.831 25757 14037 1 17 . 1 1 101 101 SER CB C 101 66.896 66.896 65.416 1.480 25757 14038 1 17 . 1 1 101 101 SER H H 101 8.985 8.985 8.317 0.668 25757 14039 1 17 . 1 1 102 102 ALA N N 102 122.780 122.780 125.288 -2.508 25757 14040 1 17 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.909 -0.165 25757 14041 1 17 . 1 1 102 102 ALA C C 102 179.175 179.175 178.380 0.795 25757 14042 1 17 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.517 0.772 25757 14043 1 17 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.394 -0.367 25757 14044 1 17 . 1 1 102 102 ALA H H 102 9.269 9.269 8.990 0.279 25757 14045 1 17 . 1 1 103 103 ALA N N 103 118.513 118.513 120.779 -2.266 25757 14046 1 17 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.665 0.346 25757 14047 1 17 . 1 1 103 103 ALA C C 103 181.521 181.521 179.587 1.934 25757 14048 1 17 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.069 0.285 25757 14049 1 17 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.169 0.121 25757 14050 1 17 . 1 1 103 103 ALA H H 103 8.321 8.321 8.268 0.053 25757 14051 1 17 . 1 1 104 104 GLU N N 104 119.550 119.550 119.322 0.228 25757 14052 1 17 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.080 -0.074 25757 14053 1 17 . 1 1 104 104 GLU C C 104 179.750 179.750 179.187 0.563 25757 14054 1 17 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.490 -0.321 25757 14055 1 17 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.395 -0.180 25757 14056 1 17 . 1 1 104 104 GLU H H 104 7.867 7.867 7.953 -0.086 25757 14057 1 17 . 1 1 105 105 LEU N N 105 122.688 122.688 120.329 2.359 25757 14058 1 17 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.901 0.017 25757 14059 1 17 . 1 1 105 105 LEU C C 105 178.233 178.233 178.122 0.111 25757 14060 1 17 . 1 1 105 105 LEU CA C 105 57.734 57.734 57.910 -0.176 25757 14061 1 17 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.750 0.270 25757 14062 1 17 . 1 1 105 105 LEU H H 105 8.746 8.746 8.213 0.533 25757 14063 1 17 . 1 1 106 106 ARG N N 106 118.835 118.835 117.949 0.886 25757 14064 1 17 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.777 -0.127 25757 14065 1 17 . 1 1 106 106 ARG C C 106 178.742 178.742 178.541 0.201 25757 14066 1 17 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.276 0.687 25757 14067 1 17 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.312 0.734 25757 14068 1 17 . 1 1 106 106 ARG H H 106 8.684 8.684 8.226 0.458 25757 14069 1 17 . 1 1 107 107 HIS N N 107 119.258 119.258 118.561 0.697 25757 14070 1 17 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.525 -0.258 25757 14071 1 17 . 1 1 107 107 HIS C C 107 177.244 177.244 178.070 -0.826 25757 14072 1 17 . 1 1 107 107 HIS CA C 107 60.152 60.152 57.936 2.216 25757 14073 1 17 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.549 1.026 25757 14074 1 17 . 1 1 107 107 HIS H H 107 7.691 7.691 8.141 -0.450 25757 14075 1 17 . 1 1 108 108 VAL N N 108 118.996 118.996 122.448 -3.452 25757 14076 1 17 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.798 -0.360 25757 14077 1 17 . 1 1 108 108 VAL C C 108 177.998 177.998 178.508 -0.510 25757 14078 1 17 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.599 -0.168 25757 14079 1 17 . 1 1 108 108 VAL CB C 108 31.424 31.424 32.018 -0.594 25757 14080 1 17 . 1 1 108 108 VAL H H 108 7.599 7.599 8.036 -0.437 25757 14081 1 17 . 1 1 109 109 MET N N 109 114.880 114.880 117.381 -2.501 25757 14082 1 17 . 1 1 109 109 MET C C 109 179.119 179.119 177.872 1.247 25757 14083 1 17 . 1 1 109 109 MET CA C 109 56.979 56.979 58.960 -1.981 25757 14084 1 17 . 1 1 109 109 MET CB C 109 29.253 29.253 33.040 -3.787 25757 14085 1 17 . 1 1 109 109 MET H H 109 7.911 7.911 8.213 -0.302 25757 14086 1 17 . 1 1 110 110 THR N N 110 116.943 116.943 116.550 0.393 25757 14087 1 17 . 1 1 110 110 THR HA H 110 4.229 4.229 4.298 -0.069 25757 14088 1 17 . 1 1 110 110 THR C C 110 178.506 178.506 177.501 1.005 25757 14089 1 17 . 1 1 110 110 THR CA C 110 66.573 66.573 66.758 -0.185 25757 14090 1 17 . 1 1 110 110 THR CB C 110 68.575 68.575 68.480 0.095 25757 14091 1 17 . 1 1 110 110 THR H H 110 8.353 8.353 8.064 0.289 25757 14092 1 17 . 1 1 111 111 ASN N N 111 123.829 123.829 120.522 3.307 25757 14093 1 17 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.442 -0.080 25757 14094 1 17 . 1 1 111 111 ASN C C 111 177.197 177.197 177.192 0.005 25757 14095 1 17 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.819 0.140 25757 14096 1 17 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.367 -1.144 25757 14097 1 17 . 1 1 111 111 ASN H H 111 8.053 8.053 8.421 -0.368 25757 14098 1 17 . 1 1 112 112 LEU N N 112 119.036 119.036 116.586 2.450 25757 14099 1 17 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.061 0.109 25757 14100 1 17 . 1 1 112 112 LEU C C 112 176.377 176.377 177.035 -0.658 25757 14101 1 17 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.090 -0.584 25757 14102 1 17 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.368 -0.008 25757 14103 1 17 . 1 1 112 112 LEU H H 112 7.794 7.794 7.456 0.338 25757 14104 1 17 . 1 1 113 113 GLY N N 113 106.045 106.045 104.924 1.121 25757 14105 1 17 . 1 1 113 113 GLY C C 113 174.248 174.248 173.840 0.408 25757 14106 1 17 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.570 0.737 25757 14107 1 17 . 1 1 113 113 GLY H H 113 7.741 7.741 7.726 0.015 25757 14108 1 17 . 1 1 114 114 GLU N N 114 120.556 120.556 122.592 -2.036 25757 14109 1 17 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.304 0.006 25757 14110 1 17 . 1 1 114 114 GLU C C 114 174.993 174.993 175.911 -0.918 25757 14111 1 17 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.038 -0.400 25757 14112 1 17 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.935 1.282 25757 14113 1 17 . 1 1 114 114 GLU H H 114 7.980 7.980 7.747 0.233 25757 14114 1 17 . 1 1 115 115 LYS N N 115 124.986 124.986 127.780 -2.794 25757 14115 1 17 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.195 0.139 25757 14116 1 17 . 1 1 115 115 LYS C C 115 175.285 175.285 175.851 -0.566 25757 14117 1 17 . 1 1 115 115 LYS CA C 115 55.581 55.581 57.142 -1.561 25757 14118 1 17 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.446 -0.473 25757 14119 1 17 . 1 1 115 115 LYS H H 115 8.613 8.613 8.388 0.225 25757 14120 1 17 . 1 1 116 116 LEU N N 116 125.243 125.243 121.935 3.308 25757 14121 1 17 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.756 -0.068 25757 14122 1 17 . 1 1 116 116 LEU C C 116 178.365 178.365 175.718 2.647 25757 14123 1 17 . 1 1 116 116 LEU CA C 116 54.348 54.348 52.523 1.825 25757 14124 1 17 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.569 -0.280 25757 14125 1 17 . 1 1 116 116 LEU H H 116 8.066 8.066 8.228 -0.162 25757 14126 1 17 . 1 1 117 117 THR N N 117 114.324 114.324 113.029 1.295 25757 14127 1 17 . 1 1 117 117 THR HA H 117 4.713 4.713 4.514 0.199 25757 14128 1 17 . 1 1 117 117 THR C C 117 175.539 175.539 174.997 0.542 25757 14129 1 17 . 1 1 117 117 THR CA C 117 60.756 60.756 59.786 0.970 25757 14130 1 17 . 1 1 117 117 THR CB C 117 71.144 71.144 71.677 -0.534 25757 14131 1 17 . 1 1 117 117 THR H H 117 9.228 9.228 8.206 1.022 25757 14132 1 17 . 1 1 118 118 ASP N N 118 121.016 121.016 122.928 -1.912 25757 14133 1 17 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.327 -0.172 25757 14134 1 17 . 1 1 118 118 ASP H H 118 8.919 8.919 8.780 0.139 25757 14135 1 17 . 1 1 119 119 GLU N N 119 121.016 121.016 119.054 1.962 25757 14136 1 17 . 1 1 119 119 GLU C C 119 179.204 179.204 178.899 0.305 25757 14137 1 17 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.081 -1.011 25757 14138 1 17 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.440 -0.396 25757 14139 1 17 . 1 1 119 119 GLU H H 119 8.919 8.919 7.692 1.227 25757 14140 1 17 . 1 1 120 120 GLU N N 120 120.566 120.566 120.192 0.374 25757 14141 1 17 . 1 1 120 120 GLU HA H 120 4.001 4.001 4.012 -0.011 25757 14142 1 17 . 1 1 120 120 GLU C C 120 180.329 180.329 178.806 1.523 25757 14143 1 17 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.299 -0.208 25757 14144 1 17 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.141 1.497 25757 14145 1 17 . 1 1 120 120 GLU H H 120 7.732 7.732 7.687 0.045 25757 14146 1 17 . 1 1 121 121 VAL N N 121 121.875 121.875 119.694 2.181 25757 14147 1 17 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.515 -0.050 25757 14148 1 17 . 1 1 121 121 VAL C C 121 177.477 177.477 178.094 -0.617 25757 14149 1 17 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.221 0.950 25757 14150 1 17 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.565 -0.131 25757 14151 1 17 . 1 1 121 121 VAL H H 121 8.104 8.104 7.419 0.685 25757 14152 1 17 . 1 1 122 122 ASP N N 122 120.566 120.566 118.656 1.910 25757 14153 1 17 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.306 0.029 25757 14154 1 17 . 1 1 122 122 ASP C C 122 179.298 179.298 178.505 0.793 25757 14155 1 17 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.434 0.406 25757 14156 1 17 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.820 -0.508 25757 14157 1 17 . 1 1 122 122 ASP H H 122 8.089 8.089 8.144 -0.055 25757 14158 1 17 . 1 1 123 123 GLU N N 123 119.821 119.821 120.657 -0.836 25757 14159 1 17 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.094 -0.045 25757 14160 1 17 . 1 1 123 123 GLU C C 123 178.749 178.749 178.828 -0.079 25757 14161 1 17 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.935 0.383 25757 14162 1 17 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.312 0.074 25757 14163 1 17 . 1 1 123 123 GLU H H 123 8.105 8.105 7.892 0.213 25757 14164 1 17 . 1 1 124 124 MET N N 124 119.288 119.288 117.371 1.917 25757 14165 1 17 . 1 1 124 124 MET C C 124 180.865 180.865 178.701 2.164 25757 14166 1 17 . 1 1 124 124 MET CA C 124 60.684 60.684 59.266 1.418 25757 14167 1 17 . 1 1 124 124 MET CB C 124 33.141 33.141 32.065 1.077 25757 14168 1 17 . 1 1 124 124 MET H H 124 7.726 7.726 8.050 -0.324 25757 14169 1 17 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.002 -0.273 25757 14170 1 17 . 1 1 125 125 ILE C C 125 177.341 177.341 178.348 -1.007 25757 14171 1 17 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.562 0.239 25757 14172 1 17 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.781 -1.216 25757 14173 1 17 . 1 1 126 126 ARG N N 126 118.555 118.555 118.847 -0.292 25757 14174 1 17 . 1 1 126 126 ARG C C 126 179.164 179.164 178.312 0.852 25757 14175 1 17 . 1 1 126 126 ARG CA C 126 59.924 59.924 58.887 1.037 25757 14176 1 17 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.992 -0.127 25757 14177 1 17 . 1 1 126 126 ARG H H 126 8.380 8.380 7.928 0.452 25757 14178 1 17 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.241 -0.316 25757 14179 1 17 . 1 1 127 127 GLU CA C 127 59.057 59.057 58.404 0.653 25757 14180 1 17 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.170 0.658 25757 14181 1 17 . 1 1 128 128 ALA N N 128 116.764 116.764 119.149 -2.385 25757 14182 1 17 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.161 0.256 25757 14183 1 17 . 1 1 128 128 ALA C C 128 177.885 177.885 176.884 1.001 25757 14184 1 17 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.908 -0.953 25757 14185 1 17 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.539 3.028 25757 14186 1 17 . 1 1 128 128 ALA H H 128 7.152 7.152 7.984 -0.832 25757 14187 1 17 . 1 1 129 129 ASP N N 129 117.762 117.762 117.985 -0.223 25757 14188 1 17 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.250 -0.773 25757 14189 1 17 . 1 1 129 129 ASP C C 129 175.935 175.935 176.297 -0.362 25757 14190 1 17 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.501 2.014 25757 14191 1 17 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.208 -0.463 25757 14192 1 17 . 1 1 129 129 ASP H H 129 8.007 8.007 7.680 0.327 25757 14193 1 17 . 1 1 130 130 ILE N N 130 128.249 128.249 125.156 3.093 25757 14194 1 17 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.855 0.009 25757 14195 1 17 . 1 1 130 130 ILE C C 130 177.764 177.764 177.454 0.310 25757 14196 1 17 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.867 -0.319 25757 14197 1 17 . 1 1 130 130 ILE CB C 130 38.648 38.648 38.227 0.420 25757 14198 1 17 . 1 1 130 130 ILE H H 130 8.412 8.412 8.157 0.255 25757 14199 1 17 . 1 1 131 131 ASP N N 131 116.430 116.430 117.148 -0.718 25757 14200 1 17 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.555 -0.021 25757 14201 1 17 . 1 1 131 131 ASP C C 131 178.313 178.313 177.227 1.086 25757 14202 1 17 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.971 -1.087 25757 14203 1 17 . 1 1 131 131 ASP CB C 131 39.962 39.962 40.718 -0.756 25757 14204 1 17 . 1 1 131 131 ASP H H 131 8.254 8.254 8.217 0.037 25757 14205 1 17 . 1 1 132 132 GLY N N 132 108.460 108.460 108.885 -0.425 25757 14206 1 17 . 1 1 132 132 GLY C C 132 175.211 175.211 174.660 0.551 25757 14207 1 17 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.921 1.682 25757 14208 1 17 . 1 1 132 132 GLY H H 132 7.547 7.547 7.804 -0.257 25757 14209 1 17 . 1 1 133 133 ASP N N 133 120.909 120.909 120.062 0.847 25757 14210 1 17 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.545 -0.082 25757 14211 1 17 . 1 1 133 133 ASP C C 133 177.691 177.691 177.720 -0.029 25757 14212 1 17 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.739 1.075 25757 14213 1 17 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.518 -0.220 25757 14214 1 17 . 1 1 133 133 ASP H H 133 8.339 8.339 8.176 0.163 25757 14215 1 17 . 1 1 134 134 GLY N N 134 112.704 112.704 108.071 4.633 25757 14216 1 17 . 1 1 134 134 GLY C C 134 172.722 172.722 173.523 -0.801 25757 14217 1 17 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.637 0.400 25757 14218 1 17 . 1 1 134 134 GLY H H 134 10.396 10.396 8.025 2.371 25757 14219 1 17 . 1 1 135 135 GLN N N 135 114.799 114.799 117.792 -2.993 25757 14220 1 17 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.110 -0.246 25757 14221 1 17 . 1 1 135 135 GLN C C 135 174.760 174.760 175.174 -0.414 25757 14222 1 17 . 1 1 135 135 GLN CA C 135 53.321 53.321 53.977 -0.656 25757 14223 1 17 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.746 -0.681 25757 14224 1 17 . 1 1 135 135 GLN H H 135 7.975 7.975 8.365 -0.390 25757 14225 1 17 . 1 1 136 136 VAL N N 136 125.364 125.364 126.068 -0.704 25757 14226 1 17 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.639 0.569 25757 14227 1 17 . 1 1 136 136 VAL C C 136 175.831 175.831 175.564 0.267 25757 14228 1 17 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.610 0.207 25757 14229 1 17 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.806 0.869 25757 14230 1 17 . 1 1 136 136 VAL H H 136 9.169 9.169 9.103 0.066 25757 14231 1 17 . 1 1 137 137 ASN N N 137 129.155 129.155 125.995 3.160 25757 14232 1 17 . 1 1 137 137 ASN C C 137 174.737 174.737 175.816 -1.079 25757 14233 1 17 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.302 0.049 25757 14234 1 17 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.183 -2.860 25757 14235 1 17 . 1 1 137 137 ASN H H 137 9.652 9.652 9.036 0.616 25757 14236 1 17 . 1 1 138 138 TYR N N 138 118.504 118.504 124.473 -5.969 25757 14237 1 17 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.888 -0.609 25757 14238 1 17 . 1 1 138 138 TYR C C 138 176.174 176.174 177.052 -0.878 25757 14239 1 17 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.225 0.349 25757 14240 1 17 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.225 -0.495 25757 14241 1 17 . 1 1 138 138 TYR H H 138 8.460 8.460 8.779 -0.319 25757 14242 1 17 . 1 1 139 139 GLU N N 139 118.644 118.644 117.831 0.813 25757 14243 1 17 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.814 -0.266 25757 14244 1 17 . 1 1 139 139 GLU C C 139 180.265 180.265 178.525 1.740 25757 14245 1 17 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.226 0.260 25757 14246 1 17 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.780 0.211 25757 14247 1 17 . 1 1 139 139 GLU H H 139 8.136 8.136 8.926 -0.790 25757 14248 1 17 . 1 1 140 140 GLU N N 140 120.030 120.030 116.863 3.167 25757 14249 1 17 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.123 -0.235 25757 14250 1 17 . 1 1 140 140 GLU C C 140 179.627 179.627 178.162 1.465 25757 14251 1 17 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.104 0.573 25757 14252 1 17 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.044 0.683 25757 14253 1 17 . 1 1 140 140 GLU H H 140 8.798 8.798 8.376 0.422 25757 14254 1 17 . 1 1 141 141 PHE N N 141 123.154 123.154 122.231 0.923 25757 14255 1 17 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.766 -0.069 25757 14256 1 17 . 1 1 141 141 PHE C C 141 176.952 176.952 176.890 0.062 25757 14257 1 17 . 1 1 141 141 PHE CA C 141 62.052 62.052 61.371 0.681 25757 14258 1 17 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.100 1.031 25757 14259 1 17 . 1 1 141 141 PHE H H 141 8.633 8.633 8.064 0.569 25757 14260 1 17 . 1 1 142 142 VAL N N 142 120.046 120.046 115.400 4.646 25757 14261 1 17 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.606 -0.650 25757 14262 1 17 . 1 1 142 142 VAL C C 142 179.627 179.627 177.830 1.797 25757 14263 1 17 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.053 2.190 25757 14264 1 17 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.725 0.415 25757 14265 1 17 . 1 1 142 142 VAL H H 142 8.894 8.894 7.783 1.111 25757 14266 1 17 . 1 1 143 143 GLN N N 143 118.996 118.996 119.554 -0.558 25757 14267 1 17 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.050 -0.274 25757 14268 1 17 . 1 1 143 143 GLN C C 143 178.443 178.443 178.109 0.334 25757 14269 1 17 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.347 0.782 25757 14270 1 17 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.590 -0.847 25757 14271 1 17 . 1 1 143 143 GLN H H 143 7.627 7.627 7.132 0.495 25757 14272 1 17 . 1 1 144 144 MET N N 144 116.361 116.361 118.442 -2.081 25757 14273 1 17 . 1 1 144 144 MET HA H 144 4.169 4.169 4.136 0.033 25757 14274 1 17 . 1 1 144 144 MET C C 144 178.418 178.418 176.236 2.182 25757 14275 1 17 . 1 1 144 144 MET CA C 144 56.137 56.137 57.504 -1.367 25757 14276 1 17 . 1 1 144 144 MET CB C 144 31.095 31.095 31.994 -0.899 25757 14277 1 17 . 1 1 144 144 MET H H 144 7.179 7.179 7.656 -0.477 25757 14278 1 17 . 1 1 145 145 MET N N 145 115.373 115.373 115.294 0.079 25757 14279 1 17 . 1 1 145 145 MET HA H 145 4.334 4.334 4.460 -0.126 25757 14280 1 17 . 1 1 145 145 MET C C 145 177.217 177.217 176.475 0.742 25757 14281 1 17 . 1 1 145 145 MET CA C 145 55.296 55.296 54.490 0.806 25757 14282 1 17 . 1 1 145 145 MET CB C 145 34.458 34.458 33.266 1.192 25757 14283 1 17 . 1 1 145 145 MET H H 145 7.776 7.776 7.204 0.572 25757 14284 1 17 . 1 1 146 146 THR N N 146 107.988 107.988 112.776 -4.788 25757 14285 1 17 . 1 1 146 146 THR HA H 146 4.239 4.239 4.435 -0.196 25757 14286 1 17 . 1 1 146 146 THR C C 146 175.378 175.378 174.694 0.684 25757 14287 1 17 . 1 1 146 146 THR CA C 146 61.625 61.625 61.694 -0.069 25757 14288 1 17 . 1 1 146 146 THR CB C 146 70.817 70.817 68.286 2.531 25757 14289 1 17 . 1 1 146 146 THR H H 146 7.736 7.736 7.523 0.213 25757 14290 1 17 . 1 1 147 147 GLY N N 147 110.157 110.157 110.196 -0.039 25757 14291 1 17 . 1 1 147 147 GLY C C 147 174.046 174.046 174.026 0.020 25757 14292 1 17 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.685 0.859 25757 14293 1 17 . 1 1 147 147 GLY H H 147 7.793 7.793 7.668 0.125 25757 14294 1 17 . 1 1 150 150 THR HA H 150 4.239 4.239 4.408 -0.169 25757 14295 1 17 . 1 1 150 150 THR C C 150 174.397 174.397 174.835 -0.438 25757 14296 1 17 . 1 1 150 150 THR CA C 150 61.260 61.260 61.519 -0.259 25757 14297 1 17 . 1 1 150 150 THR CB C 150 70.358 70.358 69.983 0.376 25757 14298 1 17 . 1 1 151 151 ALA N N 151 126.304 126.304 124.575 1.729 25757 14299 1 17 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.495 -0.207 25757 14300 1 17 . 1 1 151 151 ALA C C 151 177.678 177.678 177.861 -0.183 25757 14301 1 17 . 1 1 151 151 ALA CA C 151 52.148 52.148 52.204 -0.056 25757 14302 1 17 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.541 -0.122 25757 14303 1 17 . 1 1 151 151 ALA H H 151 8.618 8.618 7.721 0.897 25757 14304 1 17 . 1 1 152 152 ALA N N 152 123.861 123.861 121.020 2.841 25757 14305 1 17 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.380 -0.262 25757 14306 1 17 . 1 1 152 152 ALA C C 152 178.823 178.823 178.189 0.634 25757 14307 1 17 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.544 1.950 25757 14308 1 17 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.356 0.401 25757 14309 1 17 . 1 1 152 152 ALA H H 152 8.354 8.354 8.305 0.049 25757 14310 1 17 . 1 1 153 153 GLY N N 153 109.984 109.984 107.251 2.733 25757 14311 1 17 . 1 1 153 153 GLY C C 153 174.389 174.389 175.551 -1.162 25757 14312 1 17 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.183 -2.052 25757 14313 1 17 . 1 1 153 153 GLY H H 153 9.028 9.028 8.202 0.826 25757 14314 1 17 . 1 1 154 154 SER N N 154 113.934 113.934 118.332 -4.398 25757 14315 1 17 . 1 1 154 154 SER HA H 154 4.255 4.255 3.980 0.275 25757 14316 1 17 . 1 1 154 154 SER C C 154 177.929 177.929 176.946 0.983 25757 14317 1 17 . 1 1 154 154 SER CA C 154 59.379 59.379 62.670 -3.291 25757 14318 1 17 . 1 1 154 154 SER CB C 154 64.090 64.090 62.487 1.603 25757 14319 1 17 . 1 1 154 154 SER H H 154 7.962 7.962 8.050 -0.088 25757 14320 1 17 . 1 1 155 155 GLY N N 155 115.337 115.337 109.350 5.987 25757 14321 1 17 . 1 1 155 155 GLY C C 155 175.891 175.891 175.545 0.346 25757 14322 1 17 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.680 0.966 25757 14323 1 17 . 1 1 155 155 GLY H H 155 9.451 9.451 7.734 1.717 25757 14324 1 17 . 1 1 156 156 TRP N N 156 119.600 119.600 122.082 -2.482 25757 14325 1 17 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.271 0.000 25757 14326 1 17 . 1 1 156 156 TRP C C 156 178.947 178.947 178.883 0.064 25757 14327 1 17 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.261 -0.097 25757 14328 1 17 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.112 0.491 25757 14329 1 17 . 1 1 156 156 TRP H H 156 8.542 8.542 7.382 1.160 25757 14330 1 17 . 1 1 157 157 ARG N N 157 118.583 118.583 119.918 -1.335 25757 14331 1 17 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.110 -0.128 25757 14332 1 17 . 1 1 157 157 ARG C C 157 177.894 177.894 178.624 -0.730 25757 14333 1 17 . 1 1 157 157 ARG CA C 157 59.338 59.338 58.787 0.551 25757 14334 1 17 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.669 0.387 25757 14335 1 17 . 1 1 157 157 ARG H H 157 7.747 7.747 8.537 -0.790 25757 14336 1 17 . 1 1 158 158 LYS N N 158 117.033 117.033 120.243 -3.210 25757 14337 1 17 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.040 -0.097 25757 14338 1 17 . 1 1 158 158 LYS C C 158 176.973 176.973 178.984 -2.011 25757 14339 1 17 . 1 1 158 158 LYS CA C 158 60.374 60.374 60.424 -0.050 25757 14340 1 17 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.102 0.189 25757 14341 1 17 . 1 1 158 158 LYS H H 158 7.529 7.529 8.018 -0.489 25757 14342 1 17 . 1 1 159 159 ILE N N 159 116.553 116.553 120.462 -3.909 25757 14343 1 17 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.744 -0.200 25757 14344 1 17 . 1 1 159 159 ILE C C 159 176.894 176.894 177.101 -0.207 25757 14345 1 17 . 1 1 159 159 ILE CA C 159 65.516 65.516 65.212 0.304 25757 14346 1 17 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.046 -0.242 25757 14347 1 17 . 1 1 159 159 ILE H H 159 7.348 7.348 8.187 -0.839 25757 14348 1 17 . 1 1 160 160 LYS N N 160 119.278 119.278 120.154 -0.876 25757 14349 1 17 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.349 -0.310 25757 14350 1 17 . 1 1 160 160 LYS C C 160 178.566 178.566 179.303 -0.737 25757 14351 1 17 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.848 0.526 25757 14352 1 17 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.580 0.238 25757 14353 1 17 . 1 1 160 160 LYS H H 160 8.225 8.225 8.123 0.102 25757 14354 1 17 . 1 1 161 161 LEU N N 161 117.056 117.056 119.425 -2.369 25757 14355 1 17 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.192 -0.132 25757 14356 1 17 . 1 1 161 161 LEU C C 161 178.977 178.977 178.907 0.070 25757 14357 1 17 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.971 0.052 25757 14358 1 17 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.991 -0.009 25757 14359 1 17 . 1 1 161 161 LEU H H 161 8.057 8.057 8.338 -0.281 25757 14360 1 17 . 1 1 162 162 ALA N N 162 121.814 121.814 122.121 -0.307 25757 14361 1 17 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.425 -0.333 25757 14362 1 17 . 1 1 162 162 ALA C C 162 178.374 178.374 179.763 -1.389 25757 14363 1 17 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.331 0.459 25757 14364 1 17 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.887 -0.562 25757 14365 1 17 . 1 1 162 162 ALA H H 162 8.170 8.170 8.257 -0.087 25757 14366 1 17 . 1 1 163 163 VAL N N 163 115.449 115.449 115.862 -0.413 25757 14367 1 17 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.823 -0.205 25757 14368 1 17 . 1 1 163 163 VAL C C 163 178.362 178.362 177.625 0.737 25757 14369 1 17 . 1 1 163 163 VAL CA C 163 66.272 66.272 66.259 0.013 25757 14370 1 17 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.777 0.260 25757 14371 1 17 . 1 1 163 163 VAL H H 163 8.499 8.499 8.216 0.283 25757 14372 1 17 . 1 1 164 164 ARG N N 164 115.775 115.775 118.683 -2.908 25757 14373 1 17 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.304 -0.107 25757 14374 1 17 . 1 1 164 164 ARG C C 164 178.938 178.938 177.299 1.639 25757 14375 1 17 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.584 -0.901 25757 14376 1 17 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.168 -0.334 25757 14377 1 17 . 1 1 164 164 ARG H H 164 8.165 8.165 8.177 -0.012 25757 14378 1 17 . 1 1 165 165 GLY N N 165 105.570 105.570 106.831 -1.261 25757 14379 1 17 . 1 1 165 165 GLY C C 165 173.134 173.134 175.342 -2.208 25757 14380 1 17 . 1 1 165 165 GLY CA C 165 46.742 46.742 45.622 1.120 25757 14381 1 17 . 1 1 165 165 GLY H H 165 8.455 8.455 7.979 0.476 25757 14382 1 17 . 1 1 166 166 ALA N N 166 120.648 120.648 122.570 -1.922 25757 14383 1 17 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.509 -0.167 25757 14384 1 17 . 1 1 166 166 ALA C C 166 176.155 176.155 177.307 -1.152 25757 14385 1 17 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.899 -2.126 25757 14386 1 17 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.304 0.174 25757 14387 1 17 . 1 1 166 166 ALA H H 166 7.826 7.826 8.057 -0.231 25757 14388 1 17 . 1 1 167 167 GLN N N 167 117.315 117.315 118.349 -1.034 25757 14389 1 17 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.485 -0.208 25757 14390 1 17 . 1 1 167 167 GLN C C 167 175.571 175.571 175.390 0.181 25757 14391 1 17 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.395 1.532 25757 14392 1 17 . 1 1 167 167 GLN CB C 167 30.185 30.185 28.882 1.303 25757 14393 1 17 . 1 1 167 167 GLN H H 167 7.498 7.498 7.516 -0.018 25757 14394 1 17 . 1 1 168 168 ALA N N 168 126.706 126.706 131.750 -5.044 25757 14395 1 17 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.025 0.254 25757 14396 1 17 . 1 1 168 168 ALA C C 168 177.227 177.227 178.137 -0.910 25757 14397 1 17 . 1 1 168 168 ALA CA C 168 52.066 52.066 54.631 -2.565 25757 14398 1 17 . 1 1 168 168 ALA CB C 168 19.706 19.706 18.787 0.919 25757 14399 1 17 . 1 1 168 168 ALA H H 168 8.534 8.534 8.683 -0.149 25757 14400 1 18 . 1 1 9 9 ILE N N 9 116.733 116.733 121.738 -5.005 25757 14401 1 18 . 1 1 9 9 ILE HA H 9 3.757 3.757 3.869 -0.112 25757 14402 1 18 . 1 1 9 9 ILE C C 9 177.828 177.828 177.067 0.761 25757 14403 1 18 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.784 2.820 25757 14404 1 18 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.313 0.285 25757 14405 1 18 . 1 1 9 9 ILE H H 9 7.366 7.366 8.137 -0.771 25757 14406 1 18 . 1 1 10 10 ALA N N 10 121.080 121.080 122.721 -1.641 25757 14407 1 18 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.961 0.114 25757 14408 1 18 . 1 1 10 10 ALA C C 10 180.921 180.921 179.409 1.512 25757 14409 1 18 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.224 0.379 25757 14410 1 18 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.747 0.237 25757 14411 1 18 . 1 1 10 10 ALA H H 10 8.039 8.039 8.341 -0.302 25757 14412 1 18 . 1 1 11 11 GLU N N 11 119.580 119.580 119.142 0.438 25757 14413 1 18 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.822 0.267 25757 14414 1 18 . 1 1 11 11 GLU C C 11 179.561 179.561 178.823 0.738 25757 14415 1 18 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.450 0.435 25757 14416 1 18 . 1 1 11 11 GLU CB C 11 29.463 29.463 29.214 0.249 25757 14417 1 18 . 1 1 11 11 GLU H H 11 7.741 7.741 7.576 0.165 25757 14418 1 18 . 1 1 12 12 PHE N N 12 118.509 118.509 117.388 1.121 25757 14419 1 18 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.284 0.542 25757 14420 1 18 . 1 1 12 12 PHE C C 12 179.000 179.000 178.350 0.650 25757 14421 1 18 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.190 0.974 25757 14422 1 18 . 1 1 12 12 PHE CB C 12 38.110 38.110 37.856 0.254 25757 14423 1 18 . 1 1 12 12 PHE H H 12 8.470 8.470 7.051 1.419 25757 14424 1 18 . 1 1 13 13 LYS N N 13 123.523 123.523 120.189 3.334 25757 14425 1 18 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.102 -0.076 25757 14426 1 18 . 1 1 13 13 LYS C C 13 179.260 179.260 179.385 -0.125 25757 14427 1 18 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.688 0.476 25757 14428 1 18 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.226 -0.393 25757 14429 1 18 . 1 1 13 13 LYS H H 13 9.171 9.171 8.534 0.637 25757 14430 1 18 . 1 1 14 14 GLU N N 14 120.415 120.415 118.526 1.889 25757 14431 1 18 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.124 -0.029 25757 14432 1 18 . 1 1 14 14 GLU C C 14 179.851 179.851 178.947 0.904 25757 14433 1 18 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.291 0.295 25757 14434 1 18 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.503 0.059 25757 14435 1 18 . 1 1 14 14 GLU H H 14 7.822 7.822 8.216 -0.394 25757 14436 1 18 . 1 1 15 15 ALA N N 15 122.143 122.143 122.302 -0.159 25757 14437 1 18 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.142 -0.012 25757 14438 1 18 . 1 1 15 15 ALA C C 15 178.222 178.222 179.729 -1.507 25757 14439 1 18 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.015 0.175 25757 14440 1 18 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.638 -0.136 25757 14441 1 18 . 1 1 15 15 ALA H H 15 8.244 8.244 8.282 -0.038 25757 14442 1 18 . 1 1 16 16 PHE N N 16 119.809 119.809 117.736 2.073 25757 14443 1 18 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.434 -0.422 25757 14444 1 18 . 1 1 16 16 PHE C C 16 177.444 177.444 176.745 0.699 25757 14445 1 18 . 1 1 16 16 PHE CA C 16 62.064 62.064 59.358 2.706 25757 14446 1 18 . 1 1 16 16 PHE CB C 16 39.432 39.432 40.222 -0.790 25757 14447 1 18 . 1 1 16 16 PHE H H 16 8.891 8.891 8.423 0.468 25757 14448 1 18 . 1 1 17 17 SER N N 17 112.631 112.631 117.174 -4.543 25757 14449 1 18 . 1 1 17 17 SER HA H 17 4.034 4.034 4.085 -0.051 25757 14450 1 18 . 1 1 17 17 SER C C 17 174.675 174.675 176.039 -1.364 25757 14451 1 18 . 1 1 17 17 SER CA C 17 61.507 61.507 61.632 -0.124 25757 14452 1 18 . 1 1 17 17 SER CB C 17 63.414 63.414 63.348 0.066 25757 14453 1 18 . 1 1 17 17 SER H H 17 7.910 7.910 8.174 -0.264 25757 14454 1 18 . 1 1 18 18 LEU N N 18 120.614 120.614 117.558 3.056 25757 14455 1 18 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.561 -0.549 25757 14456 1 18 . 1 1 18 18 LEU C C 18 177.366 177.366 177.840 -0.474 25757 14457 1 18 . 1 1 18 18 LEU CA C 18 57.386 57.386 56.952 0.434 25757 14458 1 18 . 1 1 18 18 LEU CB C 18 41.595 41.595 42.261 -0.666 25757 14459 1 18 . 1 1 18 18 LEU H H 18 7.423 7.423 7.872 -0.449 25757 14460 1 18 . 1 1 19 19 PHE N N 19 114.602 114.602 117.649 -3.047 25757 14461 1 18 . 1 1 19 19 PHE C C 19 176.961 176.961 176.360 0.601 25757 14462 1 18 . 1 1 19 19 PHE CA C 19 59.484 59.484 59.977 -0.493 25757 14463 1 18 . 1 1 19 19 PHE CB C 19 40.769 40.769 38.716 2.053 25757 14464 1 18 . 1 1 19 19 PHE H H 19 7.254 7.254 7.397 -0.143 25757 14465 1 18 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.657 -0.082 25757 14466 1 18 . 1 1 22 22 ASP CA C 22 52.648 52.648 53.458 -0.810 25757 14467 1 18 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.998 -0.988 25757 14468 1 18 . 1 1 23 23 GLY N N 23 108.244 108.244 109.666 -1.422 25757 14469 1 18 . 1 1 23 23 GLY C C 23 175.188 175.188 175.263 -0.075 25757 14470 1 18 . 1 1 23 23 GLY CA C 23 47.403 47.403 45.980 1.423 25757 14471 1 18 . 1 1 23 23 GLY H H 23 7.555 7.555 7.793 -0.238 25757 14472 1 18 . 1 1 24 24 ASP N N 24 120.667 120.667 118.736 1.931 25757 14473 1 18 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.556 -0.087 25757 14474 1 18 . 1 1 24 24 ASP C C 24 177.457 177.457 177.636 -0.179 25757 14475 1 18 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.760 0.032 25757 14476 1 18 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.108 -0.592 25757 14477 1 18 . 1 1 24 24 ASP H H 24 8.397 8.397 7.998 0.399 25757 14478 1 18 . 1 1 25 25 GLY N N 25 112.989 112.989 108.270 4.719 25757 14479 1 18 . 1 1 25 25 GLY C C 25 173.639 173.639 173.544 0.095 25757 14480 1 18 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.214 0.287 25757 14481 1 18 . 1 1 25 25 GLY H H 25 10.592 10.592 8.126 2.466 25757 14482 1 18 . 1 1 26 26 THR N N 26 112.948 112.948 113.273 -0.325 25757 14483 1 18 . 1 1 26 26 THR HA H 26 5.282 5.282 5.127 0.155 25757 14484 1 18 . 1 1 26 26 THR C C 26 172.853 172.853 171.933 0.920 25757 14485 1 18 . 1 1 26 26 THR CA C 26 59.817 59.817 61.908 -2.091 25757 14486 1 18 . 1 1 26 26 THR CB C 26 72.465 72.465 70.822 1.643 25757 14487 1 18 . 1 1 26 26 THR H H 26 8.121 8.121 8.124 -0.003 25757 14488 1 18 . 1 1 27 27 ILE N N 27 127.195 127.195 121.848 5.347 25757 14489 1 18 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.831 0.082 25757 14490 1 18 . 1 1 27 27 ILE C C 27 176.091 176.091 175.048 1.043 25757 14491 1 18 . 1 1 27 27 ILE CA C 27 60.765 60.765 59.887 0.878 25757 14492 1 18 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.878 -2.173 25757 14493 1 18 . 1 1 27 27 ILE H H 27 9.867 9.867 8.469 1.398 25757 14494 1 18 . 1 1 28 28 THR N N 28 116.655 116.655 120.282 -3.627 25757 14495 1 18 . 1 1 28 28 THR HA H 28 4.790 4.790 4.795 -0.005 25757 14496 1 18 . 1 1 28 28 THR C C 28 176.696 176.696 176.346 0.350 25757 14497 1 18 . 1 1 28 28 THR CA C 28 59.590 59.590 60.465 -0.875 25757 14498 1 18 . 1 1 28 28 THR CB C 28 72.457 72.457 70.874 1.583 25757 14499 1 18 . 1 1 28 28 THR H H 28 8.457 8.457 8.376 0.081 25757 14500 1 18 . 1 1 29 29 THR N N 29 111.878 111.878 118.190 -6.312 25757 14501 1 18 . 1 1 29 29 THR HA H 29 4.188 4.188 3.859 0.329 25757 14502 1 18 . 1 1 29 29 THR C C 29 177.399 177.399 176.266 1.133 25757 14503 1 18 . 1 1 29 29 THR CA C 29 66.386 66.386 66.273 0.113 25757 14504 1 18 . 1 1 29 29 THR CB C 29 67.726 67.726 68.561 -0.835 25757 14505 1 18 . 1 1 29 29 THR H H 29 9.211 9.211 8.966 0.245 25757 14506 1 18 . 1 1 30 30 LYS N N 30 121.140 121.140 119.999 1.141 25757 14507 1 18 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.893 0.184 25757 14508 1 18 . 1 1 30 30 LYS C C 30 179.793 179.793 178.736 1.057 25757 14509 1 18 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.162 0.130 25757 14510 1 18 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.833 0.614 25757 14511 1 18 . 1 1 30 30 LYS H H 30 7.580 7.580 7.663 -0.083 25757 14512 1 18 . 1 1 31 31 GLU N N 31 121.865 121.865 120.237 1.628 25757 14513 1 18 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.877 0.117 25757 14514 1 18 . 1 1 31 31 GLU C C 31 179.355 179.355 178.767 0.588 25757 14515 1 18 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.435 0.198 25757 14516 1 18 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.159 0.693 25757 14517 1 18 . 1 1 31 31 GLU H H 31 7.708 7.708 8.296 -0.588 25757 14518 1 18 . 1 1 32 32 LEU N N 32 120.597 120.597 117.027 3.570 25757 14519 1 18 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.655 0.461 25757 14520 1 18 . 1 1 32 32 LEU C C 32 178.885 178.885 178.734 0.151 25757 14521 1 18 . 1 1 32 32 LEU CA C 32 58.361 58.361 57.956 0.405 25757 14522 1 18 . 1 1 32 32 LEU CB C 32 43.036 43.036 40.708 2.329 25757 14523 1 18 . 1 1 32 32 LEU H H 32 8.688 8.688 7.589 1.099 25757 14524 1 18 . 1 1 33 33 GLY N N 33 104.837 104.837 107.601 -2.764 25757 14525 1 18 . 1 1 33 33 GLY C C 33 175.123 175.123 175.921 -0.798 25757 14526 1 18 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.688 0.559 25757 14527 1 18 . 1 1 33 33 GLY H H 33 8.694 8.694 8.484 0.210 25757 14528 1 18 . 1 1 34 34 THR N N 34 117.631 117.631 118.821 -1.190 25757 14529 1 18 . 1 1 34 34 THR HA H 34 3.899 3.899 3.956 -0.057 25757 14530 1 18 . 1 1 34 34 THR C C 34 176.951 176.951 176.784 0.167 25757 14531 1 18 . 1 1 34 34 THR CA C 34 67.234 67.234 67.226 0.008 25757 14532 1 18 . 1 1 34 34 THR CB C 34 68.863 68.863 68.491 0.372 25757 14533 1 18 . 1 1 34 34 THR H H 34 7.960 7.960 7.903 0.057 25757 14534 1 18 . 1 1 35 35 VAL N N 35 121.659 121.659 122.092 -0.433 25757 14535 1 18 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.439 0.078 25757 14536 1 18 . 1 1 35 35 VAL C C 35 178.265 178.265 177.060 1.205 25757 14537 1 18 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.834 -0.159 25757 14538 1 18 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.230 0.062 25757 14539 1 18 . 1 1 35 35 VAL H H 35 7.358 7.358 7.817 -0.459 25757 14540 1 18 . 1 1 36 36 MET N N 36 117.456 117.456 115.125 2.331 25757 14541 1 18 . 1 1 36 36 MET C C 36 179.088 179.088 178.784 0.304 25757 14542 1 18 . 1 1 36 36 MET CA C 36 60.477 60.477 56.200 4.277 25757 14543 1 18 . 1 1 36 36 MET CB C 36 32.443 32.443 31.730 0.713 25757 14544 1 18 . 1 1 36 36 MET H H 36 8.194 8.194 8.020 0.174 25757 14545 1 18 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.923 0.224 25757 14546 1 18 . 1 1 37 37 ARG CB C 37 30.350 30.350 29.009 1.341 25757 14547 1 18 . 1 1 38 38 SER HA H 38 4.085 4.085 4.255 -0.170 25757 14548 1 18 . 1 1 38 38 SER C C 38 173.788 173.788 174.995 -1.207 25757 14549 1 18 . 1 1 38 38 SER CA C 38 61.617 61.617 61.748 -0.131 25757 14550 1 18 . 1 1 38 38 SER CB C 38 62.943 62.943 63.056 -0.113 25757 14551 1 18 . 1 1 39 39 LEU N N 39 119.003 119.003 117.792 1.211 25757 14552 1 18 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.395 0.099 25757 14553 1 18 . 1 1 39 39 LEU C C 39 176.470 176.470 176.931 -0.461 25757 14554 1 18 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.472 0.207 25757 14555 1 18 . 1 1 39 39 LEU CB C 39 41.514 41.514 39.927 1.587 25757 14556 1 18 . 1 1 39 39 LEU H H 39 7.230 7.230 7.497 -0.267 25757 14557 1 18 . 1 1 40 40 GLY N N 40 105.026 105.026 105.549 -0.523 25757 14558 1 18 . 1 1 40 40 GLY C C 40 174.322 174.322 175.248 -0.926 25757 14559 1 18 . 1 1 40 40 GLY CA C 40 46.215 46.215 44.959 1.256 25757 14560 1 18 . 1 1 40 40 GLY H H 40 7.698 7.698 7.912 -0.214 25757 14561 1 18 . 1 1 41 41 GLN N N 41 117.929 117.929 120.037 -2.108 25757 14562 1 18 . 1 1 41 41 GLN C C 41 174.557 174.557 175.102 -0.545 25757 14563 1 18 . 1 1 41 41 GLN CB C 41 30.844 30.844 29.581 1.263 25757 14564 1 18 . 1 1 41 41 GLN H H 41 7.866 7.866 7.957 -0.091 25757 14565 1 18 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.574 0.162 25757 14566 1 18 . 1 1 43 43 PRO C C 43 177.805 177.805 176.180 1.625 25757 14567 1 18 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.721 -0.216 25757 14568 1 18 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.461 -0.299 25757 14569 1 18 . 1 1 44 44 THR N N 44 113.167 113.167 113.675 -0.508 25757 14570 1 18 . 1 1 44 44 THR HA H 44 4.684 4.684 4.491 0.193 25757 14571 1 18 . 1 1 44 44 THR C C 44 175.139 175.139 175.621 -0.482 25757 14572 1 18 . 1 1 44 44 THR CA C 44 60.556 60.556 59.350 1.206 25757 14573 1 18 . 1 1 44 44 THR CB C 44 71.064 71.064 70.923 0.141 25757 14574 1 18 . 1 1 44 44 THR H H 44 8.798 8.798 7.703 1.095 25757 14575 1 18 . 1 1 45 45 GLU N N 45 120.673 120.673 120.822 -0.149 25757 14576 1 18 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.870 0.121 25757 14577 1 18 . 1 1 45 45 GLU C C 45 178.940 178.940 178.617 0.323 25757 14578 1 18 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.694 -0.793 25757 14579 1 18 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.335 -0.306 25757 14580 1 18 . 1 1 45 45 GLU H H 45 8.812 8.812 9.019 -0.207 25757 14581 1 18 . 1 1 46 46 ALA N N 46 120.576 120.576 120.366 0.210 25757 14582 1 18 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.061 -0.094 25757 14583 1 18 . 1 1 46 46 ALA C C 46 180.290 180.290 179.806 0.484 25757 14584 1 18 . 1 1 46 46 ALA CA C 46 54.919 54.919 54.952 -0.033 25757 14585 1 18 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.342 -0.181 25757 14586 1 18 . 1 1 46 46 ALA H H 46 8.276 8.276 8.244 0.032 25757 14587 1 18 . 1 1 47 47 GLU N N 47 116.104 116.104 119.015 -2.911 25757 14588 1 18 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.020 -0.020 25757 14589 1 18 . 1 1 47 47 GLU C C 47 180.224 180.224 179.022 1.202 25757 14590 1 18 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.041 -0.110 25757 14591 1 18 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.274 0.715 25757 14592 1 18 . 1 1 47 47 GLU H H 47 7.425 7.425 7.688 -0.263 25757 14593 1 18 . 1 1 48 48 LEU N N 48 120.425 120.425 119.777 0.648 25757 14594 1 18 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.837 0.213 25757 14595 1 18 . 1 1 48 48 LEU C C 48 178.551 178.551 179.049 -0.498 25757 14596 1 18 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.395 -0.555 25757 14597 1 18 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.229 1.340 25757 14598 1 18 . 1 1 48 48 LEU H H 48 8.121 8.121 8.088 0.033 25757 14599 1 18 . 1 1 49 49 GLN N N 49 118.372 118.372 118.348 0.024 25757 14600 1 18 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.863 -0.101 25757 14601 1 18 . 1 1 49 49 GLN C C 49 178.567 178.567 178.330 0.237 25757 14602 1 18 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.172 -0.309 25757 14603 1 18 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.365 -0.123 25757 14604 1 18 . 1 1 49 49 GLN H H 49 8.302 8.302 8.191 0.111 25757 14605 1 18 . 1 1 50 50 ASP N N 50 119.992 119.992 120.513 -0.521 25757 14606 1 18 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.364 -0.004 25757 14607 1 18 . 1 1 50 50 ASP C C 50 178.600 178.600 178.613 -0.013 25757 14608 1 18 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.479 0.224 25757 14609 1 18 . 1 1 50 50 ASP CB C 50 40.467 40.467 41.098 -0.631 25757 14610 1 18 . 1 1 50 50 ASP H H 50 8.150 8.150 8.058 0.092 25757 14611 1 18 . 1 1 51 51 MET N N 51 119.238 119.238 118.988 0.250 25757 14612 1 18 . 1 1 51 51 MET HA H 51 3.981 3.981 4.086 -0.105 25757 14613 1 18 . 1 1 51 51 MET C C 51 179.006 179.006 179.174 -0.168 25757 14614 1 18 . 1 1 51 51 MET CA C 51 59.443 59.443 58.076 1.367 25757 14615 1 18 . 1 1 51 51 MET CB C 51 33.380 33.380 31.655 1.725 25757 14616 1 18 . 1 1 51 51 MET H H 51 7.844 7.844 8.140 -0.296 25757 14617 1 18 . 1 1 52 52 ILE N N 52 118.161 118.161 118.945 -0.784 25757 14618 1 18 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.643 -0.165 25757 14619 1 18 . 1 1 52 52 ILE C C 52 177.847 177.847 178.849 -1.002 25757 14620 1 18 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.507 0.488 25757 14621 1 18 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.479 0.644 25757 14622 1 18 . 1 1 52 52 ILE H H 52 7.686 7.686 8.390 -0.704 25757 14623 1 18 . 1 1 53 53 ASN N N 53 117.884 117.884 117.484 0.400 25757 14624 1 18 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.444 -0.079 25757 14625 1 18 . 1 1 53 53 ASN C C 53 177.515 177.515 177.496 0.019 25757 14626 1 18 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.851 0.356 25757 14627 1 18 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.488 -0.410 25757 14628 1 18 . 1 1 53 53 ASN H H 53 8.713 8.713 8.279 0.434 25757 14629 1 18 . 1 1 54 54 GLU N N 54 116.178 116.178 118.588 -2.410 25757 14630 1 18 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.298 -0.309 25757 14631 1 18 . 1 1 54 54 GLU C C 54 177.557 177.557 177.255 0.302 25757 14632 1 18 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.827 1.163 25757 14633 1 18 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.382 0.081 25757 14634 1 18 . 1 1 54 54 GLU H H 54 7.530 7.530 8.043 -0.513 25757 14635 1 18 . 1 1 55 55 VAL N N 55 107.164 107.164 112.990 -5.826 25757 14636 1 18 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.322 0.200 25757 14637 1 18 . 1 1 55 55 VAL C C 55 175.602 175.602 174.409 1.193 25757 14638 1 18 . 1 1 55 55 VAL CA C 55 60.352 60.352 61.194 -0.842 25757 14639 1 18 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.691 -0.088 25757 14640 1 18 . 1 1 55 55 VAL H H 55 7.175 7.175 7.541 -0.366 25757 14641 1 18 . 1 1 56 56 ASP N N 56 122.126 122.126 119.919 2.207 25757 14642 1 18 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.260 -0.661 25757 14643 1 18 . 1 1 56 56 ASP C C 56 176.182 176.182 175.823 0.359 25757 14644 1 18 . 1 1 56 56 ASP CA C 56 53.806 53.806 52.584 1.222 25757 14645 1 18 . 1 1 56 56 ASP CB C 56 40.270 40.270 43.084 -2.814 25757 14646 1 18 . 1 1 56 56 ASP H H 56 7.569 7.569 7.358 0.211 25757 14647 1 18 . 1 1 57 57 ALA N N 57 103.782 103.782 128.805 -25.023 25757 14648 1 18 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.377 -0.197 25757 14649 1 18 . 1 1 57 57 ALA C C 57 178.584 178.584 177.985 0.599 25757 14650 1 18 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.128 1.216 25757 14651 1 18 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.578 -0.054 25757 14652 1 18 . 1 1 57 57 ALA H H 57 8.515 8.515 8.508 0.007 25757 14653 1 18 . 1 1 58 58 ASP N N 58 113.602 113.602 120.198 -6.596 25757 14654 1 18 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.546 0.040 25757 14655 1 18 . 1 1 58 58 ASP C C 58 177.756 177.756 177.298 0.458 25757 14656 1 18 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.808 -2.046 25757 14657 1 18 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.150 -1.472 25757 14658 1 18 . 1 1 58 58 ASP H H 58 8.130 8.130 8.100 0.030 25757 14659 1 18 . 1 1 59 59 GLY N N 59 109.195 109.195 107.792 1.403 25757 14660 1 18 . 1 1 59 59 GLY C C 59 175.139 175.139 174.517 0.622 25757 14661 1 18 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.113 2.151 25757 14662 1 18 . 1 1 59 59 GLY H H 59 7.694 7.694 8.750 -1.056 25757 14663 1 18 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.817 -0.212 25757 14664 1 18 . 1 1 61 61 GLY N N 61 113.316 113.316 109.631 3.685 25757 14665 1 18 . 1 1 61 61 GLY C C 61 173.234 173.234 173.130 0.104 25757 14666 1 18 . 1 1 61 61 GLY CA C 61 45.698 45.698 46.358 -0.660 25757 14667 1 18 . 1 1 61 61 GLY H H 61 10.633 10.633 8.451 2.182 25757 14668 1 18 . 1 1 62 62 THR N N 62 108.892 108.892 109.473 -0.581 25757 14669 1 18 . 1 1 62 62 THR HA H 62 4.736 4.736 4.947 -0.211 25757 14670 1 18 . 1 1 62 62 THR C C 62 173.091 173.091 173.344 -0.253 25757 14671 1 18 . 1 1 62 62 THR CA C 62 59.617 59.617 59.807 -0.190 25757 14672 1 18 . 1 1 62 62 THR CB C 62 72.004 72.004 72.419 -0.415 25757 14673 1 18 . 1 1 62 62 THR H H 62 7.673 7.673 7.725 -0.052 25757 14674 1 18 . 1 1 63 63 ILE N N 63 123.324 123.324 123.059 0.265 25757 14675 1 18 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.747 0.382 25757 14676 1 18 . 1 1 63 63 ILE C C 63 175.652 175.652 175.283 0.369 25757 14677 1 18 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.545 -0.059 25757 14678 1 18 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.738 -0.781 25757 14679 1 18 . 1 1 63 63 ILE H H 63 8.907 8.907 8.779 0.128 25757 14680 1 18 . 1 1 64 64 ASP N N 64 128.253 128.253 126.467 1.786 25757 14681 1 18 . 1 1 64 64 ASP HA H 64 5.321 5.321 5.003 0.318 25757 14682 1 18 . 1 1 64 64 ASP C C 64 176.431 176.431 177.448 -1.017 25757 14683 1 18 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.226 -0.895 25757 14684 1 18 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.818 -0.765 25757 14685 1 18 . 1 1 64 64 ASP H H 64 8.864 8.864 8.979 -0.115 25757 14686 1 18 . 1 1 65 65 PHE N N 65 118.583 118.583 119.806 -1.223 25757 14687 1 18 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.395 -0.535 25757 14688 1 18 . 1 1 65 65 PHE C C 65 173.458 173.458 175.042 -1.584 25757 14689 1 18 . 1 1 65 65 PHE CA C 65 63.799 63.799 63.615 0.184 25757 14690 1 18 . 1 1 65 65 PHE CB C 65 35.880 35.880 37.259 -1.379 25757 14691 1 18 . 1 1 65 65 PHE H H 65 8.962 8.962 9.011 -0.050 25757 14692 1 18 . 1 1 66 66 PRO HA H 66 4.118 4.118 4.320 -0.202 25757 14693 1 18 . 1 1 66 66 PRO C C 66 180.038 180.038 178.503 1.535 25757 14694 1 18 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.522 1.167 25757 14695 1 18 . 1 1 66 66 PRO CB C 66 30.677 30.677 31.096 -0.419 25757 14696 1 18 . 1 1 67 67 GLU N N 67 118.402 118.402 119.141 -0.739 25757 14697 1 18 . 1 1 67 67 GLU C C 67 178.737 178.737 178.690 0.047 25757 14698 1 18 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.858 -0.850 25757 14699 1 18 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.215 0.470 25757 14700 1 18 . 1 1 67 67 GLU H H 67 7.953 7.953 8.628 -0.675 25757 14701 1 18 . 1 1 68 68 PHE N N 68 123.421 123.421 120.091 3.330 25757 14702 1 18 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.160 -0.188 25757 14703 1 18 . 1 1 68 68 PHE C C 68 177.184 177.184 177.207 -0.023 25757 14704 1 18 . 1 1 68 68 PHE CA C 68 61.338 61.338 60.252 1.086 25757 14705 1 18 . 1 1 68 68 PHE CB C 68 39.969 39.969 38.842 1.127 25757 14706 1 18 . 1 1 68 68 PHE H H 68 8.928 8.928 7.564 1.364 25757 14707 1 18 . 1 1 69 69 LEU N N 69 119.284 119.284 118.054 1.230 25757 14708 1 18 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.205 0.130 25757 14709 1 18 . 1 1 69 69 LEU C C 69 178.987 178.987 178.769 0.218 25757 14710 1 18 . 1 1 69 69 LEU CA C 69 57.862 57.862 57.782 0.080 25757 14711 1 18 . 1 1 69 69 LEU CB C 69 40.832 40.832 40.420 0.412 25757 14712 1 18 . 1 1 69 69 LEU H H 69 8.374 8.374 7.415 0.959 25757 14713 1 18 . 1 1 70 70 THR N N 70 116.017 116.017 114.976 1.041 25757 14714 1 18 . 1 1 70 70 THR HA H 70 4.338 4.338 3.781 0.557 25757 14715 1 18 . 1 1 70 70 THR C C 70 176.169 176.169 176.702 -0.533 25757 14716 1 18 . 1 1 70 70 THR CA C 70 66.700 66.700 66.309 0.391 25757 14717 1 18 . 1 1 70 70 THR CB C 70 68.379 68.379 68.421 -0.043 25757 14718 1 18 . 1 1 70 70 THR H H 70 7.493 7.493 8.258 -0.765 25757 14719 1 18 . 1 1 71 71 MET N N 71 121.915 121.915 121.605 0.310 25757 14720 1 18 . 1 1 71 71 MET HA H 71 3.718 3.718 3.976 -0.258 25757 14721 1 18 . 1 1 71 71 MET C C 71 178.190 178.190 177.834 0.356 25757 14722 1 18 . 1 1 71 71 MET CA C 71 59.335 59.335 58.206 1.129 25757 14723 1 18 . 1 1 71 71 MET CB C 71 33.894 33.894 32.189 1.705 25757 14724 1 18 . 1 1 71 71 MET H H 71 7.924 7.924 7.938 -0.014 25757 14725 1 18 . 1 1 72 72 MET N N 72 116.973 116.973 118.039 -1.066 25757 14726 1 18 . 1 1 72 72 MET HA H 72 3.968 3.968 3.951 0.017 25757 14727 1 18 . 1 1 72 72 MET C C 72 178.211 178.211 178.479 -0.268 25757 14728 1 18 . 1 1 72 72 MET CA C 72 56.059 56.059 59.214 -3.155 25757 14729 1 18 . 1 1 72 72 MET CB C 72 31.639 31.639 32.309 -0.670 25757 14730 1 18 . 1 1 72 72 MET H H 72 8.276 8.276 8.027 0.249 25757 14731 1 18 . 1 1 73 73 ALA N N 73 122.499 122.499 121.030 1.469 25757 14732 1 18 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.963 -0.013 25757 14733 1 18 . 1 1 73 73 ALA C C 73 180.231 180.231 179.552 0.679 25757 14734 1 18 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.957 -0.004 25757 14735 1 18 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.645 0.386 25757 14736 1 18 . 1 1 73 73 ALA H H 73 8.240 8.240 8.360 -0.120 25757 14737 1 18 . 1 1 74 74 ARG N N 74 116.098 116.098 118.762 -2.664 25757 14738 1 18 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.029 -0.037 25757 14739 1 18 . 1 1 74 74 ARG C C 74 178.567 178.567 178.594 -0.027 25757 14740 1 18 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.950 -0.125 25757 14741 1 18 . 1 1 74 74 ARG CB C 74 30.075 30.075 30.148 -0.073 25757 14742 1 18 . 1 1 74 74 ARG H H 74 7.420 7.420 7.732 -0.312 25757 14743 1 18 . 1 1 75 75 LYS N N 75 119.046 119.046 119.884 -0.838 25757 14744 1 18 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.127 -0.084 25757 14745 1 18 . 1 1 75 75 LYS C C 75 179.045 179.045 178.604 0.441 25757 14746 1 18 . 1 1 75 75 LYS CA C 75 57.889 57.889 57.670 0.219 25757 14747 1 18 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.785 -0.019 25757 14748 1 18 . 1 1 75 75 LYS H H 75 7.862 7.862 8.184 -0.322 25757 14749 1 18 . 1 1 76 76 MET N N 76 116.772 116.772 119.803 -3.031 25757 14750 1 18 . 1 1 76 76 MET H H 76 8.099 8.099 8.280 -0.181 25757 14751 1 18 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.598 0.036 25757 14752 1 18 . 1 1 78 78 ASP C C 78 176.395 176.395 176.542 -0.147 25757 14753 1 18 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.766 -0.122 25757 14754 1 18 . 1 1 78 78 ASP CB C 78 41.474 41.474 42.121 -0.647 25757 14755 1 18 . 1 1 79 79 THR N N 79 113.904 113.904 115.624 -1.720 25757 14756 1 18 . 1 1 79 79 THR HA H 79 4.215 4.215 4.371 -0.156 25757 14757 1 18 . 1 1 79 79 THR C C 79 174.204 174.204 174.257 -0.053 25757 14758 1 18 . 1 1 79 79 THR CA C 79 62.264 62.264 63.059 -0.795 25757 14759 1 18 . 1 1 79 79 THR CB C 79 69.884 69.884 69.928 -0.044 25757 14760 1 18 . 1 1 79 79 THR H H 79 8.039 8.039 8.108 -0.069 25757 14761 1 18 . 1 1 80 80 ASP N N 80 123.572 123.572 122.784 0.788 25757 14762 1 18 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.607 0.113 25757 14763 1 18 . 1 1 80 80 ASP C C 80 176.221 176.221 176.614 -0.393 25757 14764 1 18 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.675 -0.360 25757 14765 1 18 . 1 1 80 80 ASP CB C 80 41.427 41.427 41.329 0.098 25757 14766 1 18 . 1 1 80 80 ASP H H 80 8.441 8.441 8.035 0.406 25757 14767 1 18 . 1 1 81 81 SER N N 81 117.879 117.879 117.340 0.539 25757 14768 1 18 . 1 1 81 81 SER HA H 81 3.925 3.925 4.817 -0.892 25757 14769 1 18 . 1 1 81 81 SER C C 81 175.264 175.264 175.775 -0.511 25757 14770 1 18 . 1 1 81 81 SER CA C 81 58.860 58.860 60.011 -1.151 25757 14771 1 18 . 1 1 81 81 SER CB C 81 63.790 63.790 63.813 -0.023 25757 14772 1 18 . 1 1 81 81 SER H H 81 8.503 8.503 8.576 -0.073 25757 14773 1 18 . 1 1 82 82 GLU N N 82 123.206 123.206 121.762 1.444 25757 14774 1 18 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.068 -0.010 25757 14775 1 18 . 1 1 82 82 GLU C C 82 178.378 178.378 178.845 -0.467 25757 14776 1 18 . 1 1 82 82 GLU CA C 82 59.586 59.586 60.070 -0.484 25757 14777 1 18 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.282 0.321 25757 14778 1 18 . 1 1 82 82 GLU H H 82 8.563 8.563 8.782 -0.219 25757 14779 1 18 . 1 1 83 83 GLU N N 83 119.262 119.262 118.386 0.876 25757 14780 1 18 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.974 -0.017 25757 14781 1 18 . 1 1 83 83 GLU C C 83 178.606 178.606 179.046 -0.440 25757 14782 1 18 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.736 -0.068 25757 14783 1 18 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.227 0.128 25757 14784 1 18 . 1 1 83 83 GLU H H 83 7.728 7.728 8.321 -0.593 25757 14785 1 18 . 1 1 84 84 GLU N N 84 118.432 118.432 119.731 -1.299 25757 14786 1 18 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.059 0.048 25757 14787 1 18 . 1 1 84 84 GLU C C 84 179.436 179.436 179.284 0.152 25757 14788 1 18 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.665 -0.162 25757 14789 1 18 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.273 -0.166 25757 14790 1 18 . 1 1 84 84 GLU H H 84 8.346 8.346 8.345 0.001 25757 14791 1 18 . 1 1 85 85 ILE N N 85 120.925 120.925 119.743 1.182 25757 14792 1 18 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.900 -0.152 25757 14793 1 18 . 1 1 85 85 ILE C C 85 177.661 177.661 178.327 -0.666 25757 14794 1 18 . 1 1 85 85 ILE CA C 85 65.490 65.490 64.183 1.308 25757 14795 1 18 . 1 1 85 85 ILE CB C 85 37.431 37.431 36.822 0.609 25757 14796 1 18 . 1 1 85 85 ILE H H 85 7.821 7.821 8.311 -0.490 25757 14797 1 18 . 1 1 86 86 ARG N N 86 121.916 121.916 119.110 2.806 25757 14798 1 18 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.919 0.217 25757 14799 1 18 . 1 1 86 86 ARG C C 86 179.208 179.208 178.709 0.499 25757 14800 1 18 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.662 0.709 25757 14801 1 18 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.801 0.297 25757 14802 1 18 . 1 1 86 86 ARG H H 86 8.432 8.432 8.293 0.139 25757 14803 1 18 . 1 1 87 87 GLU N N 87 118.261 118.261 119.128 -0.867 25757 14804 1 18 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.969 0.143 25757 14805 1 18 . 1 1 87 87 GLU C C 87 178.516 178.516 178.426 0.090 25757 14806 1 18 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.154 -0.129 25757 14807 1 18 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.059 0.111 25757 14808 1 18 . 1 1 87 87 GLU H H 87 8.225 8.225 8.186 0.039 25757 14809 1 18 . 1 1 88 88 ALA N N 88 121.009 121.009 122.320 -1.311 25757 14810 1 18 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.502 0.325 25757 14811 1 18 . 1 1 88 88 ALA C C 88 177.947 177.947 178.396 -0.449 25757 14812 1 18 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.973 -0.112 25757 14813 1 18 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.320 -0.365 25757 14814 1 18 . 1 1 88 88 ALA H H 88 7.789 7.789 7.920 -0.131 25757 14815 1 18 . 1 1 89 89 PHE N N 89 117.164 117.164 118.663 -1.499 25757 14816 1 18 . 1 1 89 89 PHE C C 89 176.134 176.134 177.591 -1.457 25757 14817 1 18 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.864 1.786 25757 14818 1 18 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.938 -0.044 25757 14819 1 18 . 1 1 89 89 PHE H H 89 8.337 8.337 7.594 0.743 25757 14820 1 18 . 1 1 90 90 ARG N N 90 114.900 114.900 117.754 -2.854 25757 14821 1 18 . 1 1 90 90 ARG HA H 90 3.914 3.914 4.052 -0.138 25757 14822 1 18 . 1 1 90 90 ARG C C 90 178.296 178.296 177.456 0.840 25757 14823 1 18 . 1 1 90 90 ARG CA C 90 59.079 59.079 59.133 -0.054 25757 14824 1 18 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.645 -0.552 25757 14825 1 18 . 1 1 90 90 ARG H H 90 7.681 7.681 7.785 -0.104 25757 14826 1 18 . 1 1 91 91 VAL N N 91 116.927 116.927 115.475 1.452 25757 14827 1 18 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.900 -0.293 25757 14828 1 18 . 1 1 91 91 VAL C C 91 177.964 177.964 177.136 0.828 25757 14829 1 18 . 1 1 91 91 VAL CA C 91 64.960 64.960 63.946 1.014 25757 14830 1 18 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.293 0.326 25757 14831 1 18 . 1 1 91 91 VAL H H 91 7.405 7.405 7.559 -0.154 25757 14832 1 18 . 1 1 92 92 PHE N N 92 119.026 119.026 117.076 1.950 25757 14833 1 18 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.353 0.009 25757 14834 1 18 . 1 1 92 92 PHE C C 92 177.639 177.639 176.154 1.485 25757 14835 1 18 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.540 -0.819 25757 14836 1 18 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.697 -0.270 25757 14837 1 18 . 1 1 92 92 PHE H H 92 7.886 7.886 7.490 0.396 25757 14838 1 18 . 1 1 93 93 ASP N N 93 118.238 118.238 119.133 -0.895 25757 14839 1 18 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.964 -0.502 25757 14840 1 18 . 1 1 93 93 ASP C C 93 176.979 176.979 176.394 0.585 25757 14841 1 18 . 1 1 93 93 ASP CA C 93 52.148 52.148 52.859 -0.712 25757 14842 1 18 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.760 -1.611 25757 14843 1 18 . 1 1 93 93 ASP H H 93 8.009 8.009 7.396 0.613 25757 14844 1 18 . 1 1 94 94 LYS N N 94 125.792 125.792 125.192 0.600 25757 14845 1 18 . 1 1 94 94 LYS C C 94 178.213 178.213 177.650 0.563 25757 14846 1 18 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.659 0.659 25757 14847 1 18 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.272 -1.244 25757 14848 1 18 . 1 1 94 94 LYS H H 94 7.428 7.428 8.088 -0.660 25757 14849 1 18 . 1 1 95 95 ASP N N 95 113.833 113.833 117.245 -3.412 25757 14850 1 18 . 1 1 95 95 ASP C C 95 177.718 177.718 177.182 0.536 25757 14851 1 18 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.002 -1.057 25757 14852 1 18 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.554 -0.811 25757 14853 1 18 . 1 1 95 95 ASP H H 95 8.159 8.159 7.855 0.304 25757 14854 1 18 . 1 1 96 96 GLY N N 96 109.414 109.414 107.696 1.718 25757 14855 1 18 . 1 1 96 96 GLY C C 96 175.093 175.093 175.345 -0.252 25757 14856 1 18 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.918 1.336 25757 14857 1 18 . 1 1 96 96 GLY H H 96 7.848 7.848 8.062 -0.214 25757 14858 1 18 . 1 1 97 97 ASN N N 97 119.590 119.590 118.550 1.040 25757 14859 1 18 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.536 0.076 25757 14860 1 18 . 1 1 97 97 ASN C C 97 175.937 175.937 176.641 -0.704 25757 14861 1 18 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.790 -0.902 25757 14862 1 18 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.661 -1.341 25757 14863 1 18 . 1 1 97 97 ASN H H 97 8.338 8.338 8.646 -0.308 25757 14864 1 18 . 1 1 98 98 GLY N N 98 112.940 112.940 108.106 4.834 25757 14865 1 18 . 1 1 98 98 GLY C C 98 172.429 172.429 172.752 -0.323 25757 14866 1 18 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.098 -0.006 25757 14867 1 18 . 1 1 98 98 GLY H H 98 10.695 10.695 9.095 1.600 25757 14868 1 18 . 1 1 99 99 TYR N N 99 115.544 115.544 118.000 -2.456 25757 14869 1 18 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.330 -0.243 25757 14870 1 18 . 1 1 99 99 TYR C C 99 174.859 174.859 174.693 0.166 25757 14871 1 18 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.377 -1.359 25757 14872 1 18 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.281 1.072 25757 14873 1 18 . 1 1 99 99 TYR H H 99 7.597 7.597 8.620 -1.023 25757 14874 1 18 . 1 1 100 100 ILE N N 100 127.078 127.078 125.479 1.599 25757 14875 1 18 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.601 0.188 25757 14876 1 18 . 1 1 100 100 ILE C C 100 175.387 175.387 175.873 -0.486 25757 14877 1 18 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.797 0.209 25757 14878 1 18 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.322 -0.532 25757 14879 1 18 . 1 1 100 100 ILE H H 100 10.267 10.267 9.324 0.943 25757 14880 1 18 . 1 1 101 101 SER N N 101 124.102 124.102 123.142 0.960 25757 14881 1 18 . 1 1 101 101 SER HA H 101 4.417 4.417 4.973 -0.556 25757 14882 1 18 . 1 1 101 101 SER C C 101 175.360 175.360 175.400 -0.040 25757 14883 1 18 . 1 1 101 101 SER CA C 101 56.036 56.036 57.309 -1.273 25757 14884 1 18 . 1 1 101 101 SER CB C 101 66.896 66.896 65.394 1.502 25757 14885 1 18 . 1 1 101 101 SER H H 101 8.985 8.985 8.263 0.722 25757 14886 1 18 . 1 1 102 102 ALA N N 102 122.780 122.780 125.046 -2.266 25757 14887 1 18 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.882 -0.138 25757 14888 1 18 . 1 1 102 102 ALA C C 102 179.175 179.175 178.390 0.785 25757 14889 1 18 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.616 0.674 25757 14890 1 18 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.334 -0.307 25757 14891 1 18 . 1 1 102 102 ALA H H 102 9.269 9.269 9.096 0.173 25757 14892 1 18 . 1 1 103 103 ALA N N 103 118.513 118.513 120.661 -2.148 25757 14893 1 18 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.751 0.260 25757 14894 1 18 . 1 1 103 103 ALA C C 103 181.521 181.521 179.392 2.129 25757 14895 1 18 . 1 1 103 103 ALA CA C 103 55.354 55.354 54.944 0.410 25757 14896 1 18 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.329 -0.038 25757 14897 1 18 . 1 1 103 103 ALA H H 103 8.321 8.321 8.253 0.068 25757 14898 1 18 . 1 1 104 104 GLU N N 104 119.550 119.550 118.971 0.579 25757 14899 1 18 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.103 -0.096 25757 14900 1 18 . 1 1 104 104 GLU C C 104 179.750 179.750 179.126 0.624 25757 14901 1 18 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.845 -0.676 25757 14902 1 18 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.355 -0.140 25757 14903 1 18 . 1 1 104 104 GLU H H 104 7.867 7.867 8.386 -0.519 25757 14904 1 18 . 1 1 105 105 LEU N N 105 122.688 122.688 120.289 2.399 25757 14905 1 18 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.903 0.015 25757 14906 1 18 . 1 1 105 105 LEU C C 105 178.233 178.233 178.170 0.063 25757 14907 1 18 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.208 -0.474 25757 14908 1 18 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.871 0.149 25757 14909 1 18 . 1 1 105 105 LEU H H 105 8.746 8.746 8.256 0.490 25757 14910 1 18 . 1 1 106 106 ARG N N 106 118.835 118.835 118.098 0.737 25757 14911 1 18 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.838 -0.188 25757 14912 1 18 . 1 1 106 106 ARG C C 106 178.742 178.742 178.606 0.136 25757 14913 1 18 . 1 1 106 106 ARG CA C 106 59.963 59.963 58.887 1.076 25757 14914 1 18 . 1 1 106 106 ARG CB C 106 30.046 30.046 28.870 1.176 25757 14915 1 18 . 1 1 106 106 ARG H H 106 8.684 8.684 8.228 0.456 25757 14916 1 18 . 1 1 107 107 HIS N N 107 119.258 119.258 118.662 0.596 25757 14917 1 18 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.477 -0.210 25757 14918 1 18 . 1 1 107 107 HIS C C 107 177.244 177.244 177.946 -0.702 25757 14919 1 18 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.370 1.782 25757 14920 1 18 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.657 0.918 25757 14921 1 18 . 1 1 107 107 HIS H H 107 7.691 7.691 8.017 -0.326 25757 14922 1 18 . 1 1 108 108 VAL N N 108 118.996 118.996 121.236 -2.240 25757 14923 1 18 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.680 -0.242 25757 14924 1 18 . 1 1 108 108 VAL C C 108 177.998 177.998 178.295 -0.297 25757 14925 1 18 . 1 1 108 108 VAL CA C 108 66.431 66.431 67.013 -0.582 25757 14926 1 18 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.821 -0.397 25757 14927 1 18 . 1 1 108 108 VAL H H 108 7.599 7.599 8.072 -0.473 25757 14928 1 18 . 1 1 109 109 MET N N 109 114.880 114.880 117.767 -2.887 25757 14929 1 18 . 1 1 109 109 MET C C 109 179.119 179.119 178.023 1.096 25757 14930 1 18 . 1 1 109 109 MET CA C 109 56.979 56.979 59.071 -2.092 25757 14931 1 18 . 1 1 109 109 MET CB C 109 29.253 29.253 33.053 -3.800 25757 14932 1 18 . 1 1 109 109 MET H H 109 7.911 7.911 8.112 -0.201 25757 14933 1 18 . 1 1 110 110 THR N N 110 116.943 116.943 115.866 1.077 25757 14934 1 18 . 1 1 110 110 THR HA H 110 4.229 4.229 4.152 0.077 25757 14935 1 18 . 1 1 110 110 THR C C 110 178.506 178.506 177.289 1.217 25757 14936 1 18 . 1 1 110 110 THR CA C 110 66.573 66.573 65.726 0.847 25757 14937 1 18 . 1 1 110 110 THR CB C 110 68.575 68.575 68.665 -0.090 25757 14938 1 18 . 1 1 110 110 THR H H 110 8.353 8.353 7.888 0.465 25757 14939 1 18 . 1 1 111 111 ASN N N 111 123.829 123.829 120.592 3.237 25757 14940 1 18 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.434 -0.072 25757 14941 1 18 . 1 1 111 111 ASN C C 111 177.197 177.197 176.750 0.447 25757 14942 1 18 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.910 0.049 25757 14943 1 18 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.549 -1.326 25757 14944 1 18 . 1 1 111 111 ASN H H 111 8.053 8.053 8.182 -0.129 25757 14945 1 18 . 1 1 112 112 LEU N N 112 119.036 119.036 116.695 2.341 25757 14946 1 18 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.007 0.163 25757 14947 1 18 . 1 1 112 112 LEU C C 112 176.377 176.377 177.060 -0.683 25757 14948 1 18 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.403 -0.898 25757 14949 1 18 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.490 -0.130 25757 14950 1 18 . 1 1 112 112 LEU H H 112 7.794 7.794 7.653 0.141 25757 14951 1 18 . 1 1 113 113 GLY N N 113 106.045 106.045 103.864 2.181 25757 14952 1 18 . 1 1 113 113 GLY C C 113 174.248 174.248 174.127 0.121 25757 14953 1 18 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.514 0.793 25757 14954 1 18 . 1 1 113 113 GLY H H 113 7.741 7.741 7.570 0.171 25757 14955 1 18 . 1 1 114 114 GLU N N 114 120.556 120.556 122.662 -2.106 25757 14956 1 18 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.085 0.225 25757 14957 1 18 . 1 1 114 114 GLU C C 114 174.993 174.993 176.168 -1.175 25757 14958 1 18 . 1 1 114 114 GLU CA C 114 54.637 54.637 56.209 -1.572 25757 14959 1 18 . 1 1 114 114 GLU CB C 114 31.217 31.217 29.788 1.429 25757 14960 1 18 . 1 1 114 114 GLU H H 114 7.980 7.980 8.117 -0.137 25757 14961 1 18 . 1 1 115 115 LYS N N 115 124.986 124.986 126.589 -1.603 25757 14962 1 18 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.215 0.119 25757 14963 1 18 . 1 1 115 115 LYS C C 115 175.285 175.285 175.825 -0.540 25757 14964 1 18 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.807 -1.226 25757 14965 1 18 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.578 -0.605 25757 14966 1 18 . 1 1 115 115 LYS H H 115 8.613 8.613 8.377 0.236 25757 14967 1 18 . 1 1 116 116 LEU N N 116 125.243 125.243 126.387 -1.144 25757 14968 1 18 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.532 0.156 25757 14969 1 18 . 1 1 116 116 LEU C C 116 178.365 178.365 176.774 1.591 25757 14970 1 18 . 1 1 116 116 LEU CA C 116 54.348 54.348 54.007 0.341 25757 14971 1 18 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.754 -0.465 25757 14972 1 18 . 1 1 116 116 LEU H H 116 8.066 8.066 8.315 -0.249 25757 14973 1 18 . 1 1 117 117 THR N N 117 114.324 114.324 111.107 3.217 25757 14974 1 18 . 1 1 117 117 THR HA H 117 4.713 4.713 4.616 0.097 25757 14975 1 18 . 1 1 117 117 THR C C 117 175.539 175.539 174.615 0.924 25757 14976 1 18 . 1 1 117 117 THR CA C 117 60.756 60.756 59.719 1.037 25757 14977 1 18 . 1 1 117 117 THR CB C 117 71.144 71.144 71.188 -0.044 25757 14978 1 18 . 1 1 117 117 THR H H 117 9.228 9.228 7.974 1.254 25757 14979 1 18 . 1 1 118 118 ASP N N 118 121.016 121.016 122.544 -1.528 25757 14980 1 18 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.280 -0.125 25757 14981 1 18 . 1 1 118 118 ASP H H 118 8.919 8.919 8.847 0.072 25757 14982 1 18 . 1 1 119 119 GLU N N 119 121.016 121.016 118.490 2.526 25757 14983 1 18 . 1 1 119 119 GLU C C 119 179.204 179.204 178.535 0.669 25757 14984 1 18 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.474 -1.404 25757 14985 1 18 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.174 -0.130 25757 14986 1 18 . 1 1 119 119 GLU H H 119 8.919 8.919 8.618 0.301 25757 14987 1 18 . 1 1 120 120 GLU N N 120 120.566 120.566 120.092 0.474 25757 14988 1 18 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.999 0.002 25757 14989 1 18 . 1 1 120 120 GLU C C 120 180.329 180.329 178.775 1.554 25757 14990 1 18 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.074 0.017 25757 14991 1 18 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.145 1.493 25757 14992 1 18 . 1 1 120 120 GLU H H 120 7.732 7.732 7.406 0.326 25757 14993 1 18 . 1 1 121 121 VAL N N 121 121.875 121.875 118.348 3.527 25757 14994 1 18 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.546 -0.081 25757 14995 1 18 . 1 1 121 121 VAL C C 121 177.477 177.477 177.779 -0.302 25757 14996 1 18 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.740 0.431 25757 14997 1 18 . 1 1 121 121 VAL CB C 121 31.434 31.434 30.799 0.635 25757 14998 1 18 . 1 1 121 121 VAL H H 121 8.104 8.104 7.432 0.672 25757 14999 1 18 . 1 1 122 122 ASP N N 122 120.566 120.566 120.237 0.329 25757 15000 1 18 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.267 0.068 25757 15001 1 18 . 1 1 122 122 ASP C C 122 179.298 179.298 178.077 1.221 25757 15002 1 18 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.740 0.099 25757 15003 1 18 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.830 -0.518 25757 15004 1 18 . 1 1 122 122 ASP H H 122 8.089 8.089 8.211 -0.122 25757 15005 1 18 . 1 1 123 123 GLU N N 123 119.821 119.821 119.712 0.109 25757 15006 1 18 . 1 1 123 123 GLU HA H 123 4.049 4.049 3.917 0.132 25757 15007 1 18 . 1 1 123 123 GLU C C 123 178.749 178.749 179.320 -0.571 25757 15008 1 18 . 1 1 123 123 GLU CA C 123 59.318 59.318 58.830 0.488 25757 15009 1 18 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.245 0.141 25757 15010 1 18 . 1 1 123 123 GLU H H 123 8.105 8.105 8.157 -0.052 25757 15011 1 18 . 1 1 124 124 MET N N 124 119.288 119.288 119.602 -0.314 25757 15012 1 18 . 1 1 124 124 MET C C 124 180.865 180.865 178.647 2.218 25757 15013 1 18 . 1 1 124 124 MET CA C 124 60.684 60.684 58.617 2.067 25757 15014 1 18 . 1 1 124 124 MET CB C 124 33.141 33.141 32.125 1.016 25757 15015 1 18 . 1 1 124 124 MET H H 124 7.726 7.726 8.000 -0.274 25757 15016 1 18 . 1 1 125 125 ILE HA H 125 3.729 3.729 3.968 -0.239 25757 15017 1 18 . 1 1 125 125 ILE C C 125 177.341 177.341 178.366 -1.025 25757 15018 1 18 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.674 0.127 25757 15019 1 18 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.522 -0.957 25757 15020 1 18 . 1 1 126 126 ARG N N 126 118.555 118.555 119.236 -0.681 25757 15021 1 18 . 1 1 126 126 ARG C C 126 179.164 179.164 178.359 0.805 25757 15022 1 18 . 1 1 126 126 ARG CA C 126 59.924 59.924 58.795 1.129 25757 15023 1 18 . 1 1 126 126 ARG CB C 126 29.865 29.865 29.652 0.212 25757 15024 1 18 . 1 1 126 126 ARG H H 126 8.380 8.380 8.147 0.233 25757 15025 1 18 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.300 -0.375 25757 15026 1 18 . 1 1 127 127 GLU CA C 127 59.057 59.057 58.136 0.921 25757 15027 1 18 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.227 0.601 25757 15028 1 18 . 1 1 128 128 ALA N N 128 116.764 116.764 120.849 -4.085 25757 15029 1 18 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.105 0.312 25757 15030 1 18 . 1 1 128 128 ALA C C 128 177.885 177.885 177.475 0.410 25757 15031 1 18 . 1 1 128 128 ALA CA C 128 51.955 51.955 53.419 -1.464 25757 15032 1 18 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.727 2.840 25757 15033 1 18 . 1 1 128 128 ALA H H 128 7.152 7.152 7.966 -0.814 25757 15034 1 18 . 1 1 129 129 ASP N N 129 117.762 117.762 118.970 -1.208 25757 15035 1 18 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.071 -0.594 25757 15036 1 18 . 1 1 129 129 ASP C C 129 175.935 175.935 176.902 -0.967 25757 15037 1 18 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.659 1.856 25757 15038 1 18 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.012 -0.267 25757 15039 1 18 . 1 1 129 129 ASP H H 129 8.007 8.007 8.074 -0.067 25757 15040 1 18 . 1 1 130 130 ILE N N 130 128.249 128.249 121.190 7.059 25757 15041 1 18 . 1 1 130 130 ILE HA H 130 3.864 3.864 4.144 -0.280 25757 15042 1 18 . 1 1 130 130 ILE C C 130 177.764 177.764 176.191 1.573 25757 15043 1 18 . 1 1 130 130 ILE CA C 130 63.548 63.548 62.387 1.161 25757 15044 1 18 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.590 1.058 25757 15045 1 18 . 1 1 130 130 ILE H H 130 8.412 8.412 8.251 0.161 25757 15046 1 18 . 1 1 131 131 ASP N N 131 116.430 116.430 120.223 -3.793 25757 15047 1 18 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.699 -0.165 25757 15048 1 18 . 1 1 131 131 ASP C C 131 178.313 178.313 176.723 1.590 25757 15049 1 18 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.444 -0.560 25757 15050 1 18 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.560 -1.598 25757 15051 1 18 . 1 1 131 131 ASP H H 131 8.254 8.254 7.868 0.386 25757 15052 1 18 . 1 1 132 132 GLY N N 132 108.460 108.460 109.384 -0.924 25757 15053 1 18 . 1 1 132 132 GLY C C 132 175.211 175.211 174.847 0.364 25757 15054 1 18 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.900 1.703 25757 15055 1 18 . 1 1 132 132 GLY H H 132 7.547 7.547 7.695 -0.148 25757 15056 1 18 . 1 1 133 133 ASP N N 133 120.909 120.909 118.487 2.422 25757 15057 1 18 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.559 -0.096 25757 15058 1 18 . 1 1 133 133 ASP C C 133 177.691 177.691 177.428 0.263 25757 15059 1 18 . 1 1 133 133 ASP CA C 133 53.814 53.814 53.769 0.045 25757 15060 1 18 . 1 1 133 133 ASP CB C 133 40.298 40.298 42.060 -1.762 25757 15061 1 18 . 1 1 133 133 ASP H H 133 8.339 8.339 8.447 -0.108 25757 15062 1 18 . 1 1 134 134 GLY N N 134 112.704 112.704 110.019 2.685 25757 15063 1 18 . 1 1 134 134 GLY C C 134 172.722 172.722 173.331 -0.609 25757 15064 1 18 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.146 0.891 25757 15065 1 18 . 1 1 134 134 GLY H H 134 10.396 10.396 8.267 2.129 25757 15066 1 18 . 1 1 135 135 GLN N N 135 114.799 114.799 118.125 -3.326 25757 15067 1 18 . 1 1 135 135 GLN HA H 135 4.864 4.864 4.962 -0.098 25757 15068 1 18 . 1 1 135 135 GLN C C 135 174.760 174.760 174.992 -0.232 25757 15069 1 18 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.450 -1.129 25757 15070 1 18 . 1 1 135 135 GLN CB C 135 32.065 32.065 33.056 -0.991 25757 15071 1 18 . 1 1 135 135 GLN H H 135 7.975 7.975 8.102 -0.127 25757 15072 1 18 . 1 1 136 136 VAL N N 136 125.364 125.364 124.631 0.733 25757 15073 1 18 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.684 0.524 25757 15074 1 18 . 1 1 136 136 VAL C C 136 175.831 175.831 175.576 0.255 25757 15075 1 18 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.391 0.426 25757 15076 1 18 . 1 1 136 136 VAL CB C 136 33.674 33.674 33.355 0.319 25757 15077 1 18 . 1 1 136 136 VAL H H 136 9.169 9.169 9.148 0.021 25757 15078 1 18 . 1 1 137 137 ASN N N 137 129.155 129.155 124.433 4.722 25757 15079 1 18 . 1 1 137 137 ASN C C 137 174.737 174.737 175.566 -0.829 25757 15080 1 18 . 1 1 137 137 ASN CA C 137 51.351 51.351 50.993 0.358 25757 15081 1 18 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.731 -3.408 25757 15082 1 18 . 1 1 137 137 ASN H H 137 9.652 9.652 8.665 0.987 25757 15083 1 18 . 1 1 138 138 TYR N N 138 118.504 118.504 122.141 -3.637 25757 15084 1 18 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.785 -0.506 25757 15085 1 18 . 1 1 138 138 TYR C C 138 176.174 176.174 177.364 -1.190 25757 15086 1 18 . 1 1 138 138 TYR CA C 138 62.574 62.574 62.059 0.515 25757 15087 1 18 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.419 -0.689 25757 15088 1 18 . 1 1 138 138 TYR H H 138 8.460 8.460 8.550 -0.090 25757 15089 1 18 . 1 1 139 139 GLU N N 139 118.644 118.644 118.058 0.586 25757 15090 1 18 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.844 -0.296 25757 15091 1 18 . 1 1 139 139 GLU C C 139 180.265 180.265 178.808 1.457 25757 15092 1 18 . 1 1 139 139 GLU CA C 139 60.486 60.486 60.055 0.431 25757 15093 1 18 . 1 1 139 139 GLU CB C 139 28.991 28.991 29.211 -0.220 25757 15094 1 18 . 1 1 139 139 GLU H H 139 8.136 8.136 7.889 0.247 25757 15095 1 18 . 1 1 140 140 GLU N N 140 120.030 120.030 117.126 2.904 25757 15096 1 18 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.024 -0.136 25757 15097 1 18 . 1 1 140 140 GLU C C 140 179.627 179.627 177.797 1.830 25757 15098 1 18 . 1 1 140 140 GLU CA C 140 58.677 58.677 57.943 0.734 25757 15099 1 18 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.081 0.645 25757 15100 1 18 . 1 1 140 140 GLU H H 140 8.798 8.798 8.230 0.568 25757 15101 1 18 . 1 1 141 141 PHE N N 141 123.154 123.154 122.596 0.558 25757 15102 1 18 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.838 -0.141 25757 15103 1 18 . 1 1 141 141 PHE C C 141 176.952 176.952 177.972 -1.020 25757 15104 1 18 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.857 1.195 25757 15105 1 18 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.393 0.738 25757 15106 1 18 . 1 1 141 141 PHE H H 141 8.633 8.633 8.188 0.445 25757 15107 1 18 . 1 1 142 142 VAL N N 142 120.046 120.046 116.873 3.173 25757 15108 1 18 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.545 -0.589 25757 15109 1 18 . 1 1 142 142 VAL C C 142 179.627 179.627 177.642 1.985 25757 15110 1 18 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.228 2.015 25757 15111 1 18 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.396 0.744 25757 15112 1 18 . 1 1 142 142 VAL H H 142 8.894 8.894 8.018 0.876 25757 15113 1 18 . 1 1 143 143 GLN N N 143 118.996 118.996 120.053 -1.057 25757 15114 1 18 . 1 1 143 143 GLN HA H 143 3.776 3.776 3.983 -0.207 25757 15115 1 18 . 1 1 143 143 GLN C C 143 178.443 178.443 177.974 0.469 25757 15116 1 18 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.419 0.710 25757 15117 1 18 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.099 -0.357 25757 15118 1 18 . 1 1 143 143 GLN H H 143 7.627 7.627 7.308 0.319 25757 15119 1 18 . 1 1 144 144 MET N N 144 116.361 116.361 117.959 -1.598 25757 15120 1 18 . 1 1 144 144 MET HA H 144 4.169 4.169 4.075 0.094 25757 15121 1 18 . 1 1 144 144 MET C C 144 178.418 178.418 176.992 1.426 25757 15122 1 18 . 1 1 144 144 MET CA C 144 56.137 56.137 57.689 -1.552 25757 15123 1 18 . 1 1 144 144 MET CB C 144 31.095 31.095 32.391 -1.296 25757 15124 1 18 . 1 1 144 144 MET H H 144 7.179 7.179 7.319 -0.140 25757 15125 1 18 . 1 1 145 145 MET N N 145 115.373 115.373 117.143 -1.770 25757 15126 1 18 . 1 1 145 145 MET HA H 145 4.334 4.334 4.527 -0.193 25757 15127 1 18 . 1 1 145 145 MET C C 145 177.217 177.217 175.579 1.638 25757 15128 1 18 . 1 1 145 145 MET CA C 145 55.296 55.296 55.329 -0.033 25757 15129 1 18 . 1 1 145 145 MET CB C 145 34.458 34.458 33.836 0.622 25757 15130 1 18 . 1 1 145 145 MET H H 145 7.776 7.776 7.666 0.110 25757 15131 1 18 . 1 1 146 146 THR N N 146 107.988 107.988 112.604 -4.616 25757 15132 1 18 . 1 1 146 146 THR HA H 146 4.239 4.239 4.445 -0.206 25757 15133 1 18 . 1 1 146 146 THR C C 146 175.378 175.378 174.810 0.568 25757 15134 1 18 . 1 1 146 146 THR CA C 146 61.625 61.625 61.713 -0.088 25757 15135 1 18 . 1 1 146 146 THR CB C 146 70.817 70.817 68.574 2.243 25757 15136 1 18 . 1 1 146 146 THR H H 146 7.736 7.736 7.691 0.044 25757 15137 1 18 . 1 1 147 147 GLY N N 147 110.157 110.157 110.239 -0.082 25757 15138 1 18 . 1 1 147 147 GLY C C 147 174.046 174.046 174.008 0.038 25757 15139 1 18 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.758 0.786 25757 15140 1 18 . 1 1 147 147 GLY H H 147 7.793 7.793 8.162 -0.369 25757 15141 1 18 . 1 1 150 150 THR HA H 150 4.239 4.239 4.380 -0.141 25757 15142 1 18 . 1 1 150 150 THR C C 150 174.397 174.397 174.587 -0.190 25757 15143 1 18 . 1 1 150 150 THR CA C 150 61.260 61.260 61.814 -0.554 25757 15144 1 18 . 1 1 150 150 THR CB C 150 70.358 70.358 69.411 0.947 25757 15145 1 18 . 1 1 151 151 ALA N N 151 126.304 126.304 123.776 2.528 25757 15146 1 18 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.857 -0.569 25757 15147 1 18 . 1 1 151 151 ALA C C 151 177.678 177.678 177.566 0.112 25757 15148 1 18 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.240 0.908 25757 15149 1 18 . 1 1 151 151 ALA CB C 151 19.419 19.419 20.167 -0.748 25757 15150 1 18 . 1 1 151 151 ALA H H 151 8.618 8.618 7.290 1.328 25757 15151 1 18 . 1 1 152 152 ALA N N 152 123.861 123.861 121.590 2.271 25757 15152 1 18 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.387 -0.269 25757 15153 1 18 . 1 1 152 152 ALA C C 152 178.823 178.823 178.344 0.479 25757 15154 1 18 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.592 1.902 25757 15155 1 18 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.034 0.723 25757 15156 1 18 . 1 1 152 152 ALA H H 152 8.354 8.354 8.713 -0.359 25757 15157 1 18 . 1 1 153 153 GLY N N 153 109.984 109.984 107.822 2.162 25757 15158 1 18 . 1 1 153 153 GLY C C 153 174.389 174.389 175.826 -1.437 25757 15159 1 18 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.090 -1.959 25757 15160 1 18 . 1 1 153 153 GLY H H 153 9.028 9.028 8.068 0.960 25757 15161 1 18 . 1 1 154 154 SER N N 154 113.934 113.934 118.066 -4.132 25757 15162 1 18 . 1 1 154 154 SER HA H 154 4.255 4.255 4.079 0.176 25757 15163 1 18 . 1 1 154 154 SER C C 154 177.929 177.929 176.933 0.996 25757 15164 1 18 . 1 1 154 154 SER CA C 154 59.379 59.379 62.309 -2.930 25757 15165 1 18 . 1 1 154 154 SER CB C 154 64.090 64.090 62.439 1.651 25757 15166 1 18 . 1 1 154 154 SER H H 154 7.962 7.962 8.101 -0.139 25757 15167 1 18 . 1 1 155 155 GLY N N 155 115.337 115.337 108.996 6.341 25757 15168 1 18 . 1 1 155 155 GLY C C 155 175.891 175.891 175.675 0.216 25757 15169 1 18 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.813 0.833 25757 15170 1 18 . 1 1 155 155 GLY H H 155 9.451 9.451 7.850 1.601 25757 15171 1 18 . 1 1 156 156 TRP N N 156 119.600 119.600 121.772 -2.172 25757 15172 1 18 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.334 -0.063 25757 15173 1 18 . 1 1 156 156 TRP C C 156 178.947 178.947 179.081 -0.134 25757 15174 1 18 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.127 0.037 25757 15175 1 18 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.185 0.418 25757 15176 1 18 . 1 1 156 156 TRP H H 156 8.542 8.542 7.386 1.156 25757 15177 1 18 . 1 1 157 157 ARG N N 157 118.583 118.583 119.986 -1.403 25757 15178 1 18 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.029 -0.047 25757 15179 1 18 . 1 1 157 157 ARG C C 157 177.894 177.894 178.213 -0.319 25757 15180 1 18 . 1 1 157 157 ARG CA C 157 59.338 59.338 60.158 -0.820 25757 15181 1 18 . 1 1 157 157 ARG CB C 157 30.057 30.057 30.251 -0.194 25757 15182 1 18 . 1 1 157 157 ARG H H 157 7.747 7.747 8.422 -0.675 25757 15183 1 18 . 1 1 158 158 LYS N N 158 117.033 117.033 119.741 -2.708 25757 15184 1 18 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.074 -0.131 25757 15185 1 18 . 1 1 158 158 LYS C C 158 176.973 176.973 179.005 -2.032 25757 15186 1 18 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.558 0.816 25757 15187 1 18 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.069 0.223 25757 15188 1 18 . 1 1 158 158 LYS H H 158 7.529 7.529 8.127 -0.598 25757 15189 1 18 . 1 1 159 159 ILE N N 159 116.553 116.553 121.257 -4.704 25757 15190 1 18 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.833 -0.289 25757 15191 1 18 . 1 1 159 159 ILE C C 159 176.894 176.894 177.293 -0.399 25757 15192 1 18 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.786 0.730 25757 15193 1 18 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.208 -0.404 25757 15194 1 18 . 1 1 159 159 ILE H H 159 7.348 7.348 8.343 -0.995 25757 15195 1 18 . 1 1 160 160 LYS N N 160 119.278 119.278 120.693 -1.415 25757 15196 1 18 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.415 -0.376 25757 15197 1 18 . 1 1 160 160 LYS C C 160 178.566 178.566 179.371 -0.805 25757 15198 1 18 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.412 0.962 25757 15199 1 18 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.476 0.342 25757 15200 1 18 . 1 1 160 160 LYS H H 160 8.225 8.225 8.026 0.199 25757 15201 1 18 . 1 1 161 161 LEU N N 161 117.056 117.056 119.802 -2.746 25757 15202 1 18 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.042 0.018 25757 15203 1 18 . 1 1 161 161 LEU C C 161 178.977 178.977 178.940 0.037 25757 15204 1 18 . 1 1 161 161 LEU CA C 161 58.024 58.024 58.387 -0.363 25757 15205 1 18 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.836 0.146 25757 15206 1 18 . 1 1 161 161 LEU H H 161 8.057 8.057 8.643 -0.586 25757 15207 1 18 . 1 1 162 162 ALA N N 162 121.814 121.814 122.380 -0.566 25757 15208 1 18 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.392 -0.300 25757 15209 1 18 . 1 1 162 162 ALA C C 162 178.374 178.374 179.598 -1.224 25757 15210 1 18 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.590 0.200 25757 15211 1 18 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.676 -0.351 25757 15212 1 18 . 1 1 162 162 ALA H H 162 8.170 8.170 8.338 -0.168 25757 15213 1 18 . 1 1 163 163 VAL N N 163 115.449 115.449 116.111 -0.662 25757 15214 1 18 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.871 -0.253 25757 15215 1 18 . 1 1 163 163 VAL C C 163 178.362 178.362 177.832 0.530 25757 15216 1 18 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.327 0.945 25757 15217 1 18 . 1 1 163 163 VAL CB C 163 32.037 32.037 30.837 1.200 25757 15218 1 18 . 1 1 163 163 VAL H H 163 8.499 8.499 8.186 0.313 25757 15219 1 18 . 1 1 164 164 ARG N N 164 115.775 115.775 119.381 -3.606 25757 15220 1 18 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.351 -0.154 25757 15221 1 18 . 1 1 164 164 ARG C C 164 178.938 178.938 179.494 -0.556 25757 15222 1 18 . 1 1 164 164 ARG CA C 164 57.683 57.683 57.919 -0.236 25757 15223 1 18 . 1 1 164 164 ARG CB C 164 29.834 29.834 29.845 -0.011 25757 15224 1 18 . 1 1 164 164 ARG H H 164 8.165 8.165 8.454 -0.289 25757 15225 1 18 . 1 1 165 165 GLY N N 165 105.570 105.570 108.309 -2.739 25757 15226 1 18 . 1 1 165 165 GLY C C 165 173.134 173.134 175.312 -2.178 25757 15227 1 18 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.831 -0.089 25757 15228 1 18 . 1 1 165 165 GLY H H 165 8.455 8.455 8.452 0.003 25757 15229 1 18 . 1 1 166 166 ALA N N 166 120.648 120.648 122.944 -2.296 25757 15230 1 18 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.179 0.163 25757 15231 1 18 . 1 1 166 166 ALA C C 166 176.155 176.155 178.364 -2.209 25757 15232 1 18 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.627 -1.854 25757 15233 1 18 . 1 1 166 166 ALA CB C 166 19.478 19.478 18.995 0.483 25757 15234 1 18 . 1 1 166 166 ALA H H 166 7.826 7.826 7.973 -0.147 25757 15235 1 18 . 1 1 167 167 GLN N N 167 117.315 117.315 119.329 -2.014 25757 15236 1 18 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.347 -0.070 25757 15237 1 18 . 1 1 167 167 GLN C C 167 175.571 175.571 174.936 0.635 25757 15238 1 18 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.179 1.748 25757 15239 1 18 . 1 1 167 167 GLN CB C 167 30.185 30.185 27.832 2.353 25757 15240 1 18 . 1 1 167 167 GLN H H 167 7.498 7.498 7.592 -0.094 25757 15241 1 18 . 1 1 168 168 ALA N N 168 126.706 126.706 126.077 0.629 25757 15242 1 18 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.198 0.081 25757 15243 1 18 . 1 1 168 168 ALA C C 168 177.227 177.227 177.777 -0.550 25757 15244 1 18 . 1 1 168 168 ALA CA C 168 52.066 52.066 52.696 -0.629 25757 15245 1 18 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.372 0.334 25757 15246 1 18 . 1 1 168 168 ALA H H 168 8.534 8.534 7.749 0.785 25757 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 144 3.188 0.204 3.193 25757 2 1 1 "Average Difference" HA 137 0.275 0.024 0.275 25757 3 1 1 "Average Difference" C 148 0.877 -0.179 0.861 25757 4 1 1 "Average Difference" CA 150 1.025 -0.125 1.021 25757 5 1 1 "Average Difference" CB 136 0.914 0.025 0.917 25757 6 1 1 "Average Difference" HN 144 0.647 -0.105 0.641 25757 7 1 2 "Average Difference" N 144 3.057 0.298 3.054 25757 8 1 2 "Average Difference" HA 137 0.285 0.015 0.286 25757 9 1 2 "Average Difference" C 148 0.902 -0.139 0.894 25757 10 1 2 "Average Difference" CA 150 1.031 -0.163 1.022 25757 11 1 2 "Average Difference" CB 136 0.927 -0.025 0.930 25757 12 1 2 "Average Difference" HN 144 0.639 -0.089 0.635 25757 13 1 3 "Average Difference" N 144 3.110 0.196 3.115 25757 14 1 3 "Average Difference" HA 137 0.285 0.029 0.285 25757 15 1 3 "Average Difference" C 148 0.900 -0.228 0.873 25757 16 1 3 "Average Difference" CA 150 1.030 -0.195 1.015 25757 17 1 3 "Average Difference" CB 136 0.911 0.022 0.914 25757 18 1 3 "Average Difference" HN 144 0.658 -0.110 0.651 25757 19 1 4 "Average Difference" N 144 3.198 0.415 3.182 25757 20 1 4 "Average Difference" HA 137 0.266 0.019 0.266 25757 21 1 4 "Average Difference" C 148 0.881 -0.170 0.867 25757 22 1 4 "Average Difference" CA 150 1.031 -0.169 1.021 25757 23 1 4 "Average Difference" CB 136 0.924 -0.027 0.927 25757 24 1 4 "Average Difference" HN 144 0.618 -0.105 0.611 25757 25 1 5 "Average Difference" N 144 3.206 0.135 3.215 25757 26 1 5 "Average Difference" HA 137 0.259 0.035 0.258 25757 27 1 5 "Average Difference" C 148 0.888 -0.155 0.877 25757 28 1 5 "Average Difference" CA 150 1.013 -0.165 1.003 25757 29 1 5 "Average Difference" CB 136 0.974 0.022 0.978 25757 30 1 5 "Average Difference" HN 144 0.636 -0.105 0.630 25757 31 1 6 "Average Difference" N 144 3.122 0.291 3.119 25757 32 1 6 "Average Difference" HA 137 0.283 0.002 0.284 25757 33 1 6 "Average Difference" C 148 0.877 -0.166 0.864 25757 34 1 6 "Average Difference" CA 150 1.053 -0.148 1.046 25757 35 1 6 "Average Difference" CB 136 0.938 -0.043 0.940 25757 36 1 6 "Average Difference" HN 144 0.646 -0.123 0.637 25757 37 1 7 "Average Difference" N 144 3.298 0.291 3.297 25757 38 1 7 "Average Difference" HA 137 0.282 0.004 0.283 25757 39 1 7 "Average Difference" C 148 0.924 -0.193 0.906 25757 40 1 7 "Average Difference" CA 150 1.053 -0.193 1.039 25757 41 1 7 "Average Difference" CB 136 0.942 -0.041 0.945 25757 42 1 7 "Average Difference" HN 144 0.630 -0.054 0.630 25757 43 1 8 "Average Difference" N 144 3.248 0.334 3.242 25757 44 1 8 "Average Difference" HA 137 0.277 0.003 0.278 25757 45 1 8 "Average Difference" C 148 0.891 -0.230 0.864 25757 46 1 8 "Average Difference" CA 150 1.095 -0.174 1.085 25757 47 1 8 "Average Difference" CB 136 0.956 -0.018 0.959 25757 48 1 8 "Average Difference" HN 144 0.629 -0.130 0.618 25757 49 1 9 "Average Difference" N 144 3.217 0.308 3.214 25757 50 1 9 "Average Difference" HA 137 0.286 0.018 0.286 25757 51 1 9 "Average Difference" C 148 0.938 -0.233 0.912 25757 52 1 9 "Average Difference" CA 150 1.045 -0.174 1.034 25757 53 1 9 "Average Difference" CB 136 0.988 0.043 0.990 25757 54 1 9 "Average Difference" HN 144 0.634 -0.121 0.625 25757 55 1 10 "Average Difference" N 144 3.266 0.253 3.267 25757 56 1 10 "Average Difference" HA 137 0.270 0.018 0.270 25757 57 1 10 "Average Difference" C 148 0.870 -0.155 0.859 25757 58 1 10 "Average Difference" CA 150 1.062 -0.114 1.059 25757 59 1 10 "Average Difference" CB 136 0.907 -0.023 0.910 25757 60 1 10 "Average Difference" HN 144 0.638 -0.106 0.631 25757 61 1 11 "Average Difference" N 144 3.130 0.294 3.127 25757 62 1 11 "Average Difference" HA 137 0.281 0.012 0.281 25757 63 1 11 "Average Difference" C 148 0.912 -0.176 0.898 25757 64 1 11 "Average Difference" CA 150 1.034 -0.184 1.021 25757 65 1 11 "Average Difference" CB 136 0.878 -0.026 0.881 25757 66 1 11 "Average Difference" HN 144 0.636 -0.122 0.626 25757 67 1 12 "Average Difference" N 144 3.112 0.239 3.114 25757 68 1 12 "Average Difference" HA 137 0.273 0.018 0.274 25757 69 1 12 "Average Difference" C 148 0.873 -0.158 0.861 25757 70 1 12 "Average Difference" CA 150 1.016 -0.185 1.002 25757 71 1 12 "Average Difference" CB 136 0.962 -0.025 0.965 25757 72 1 12 "Average Difference" HN 144 0.635 -0.127 0.624 25757 73 1 13 "Average Difference" N 144 3.202 0.109 3.212 25757 74 1 13 "Average Difference" HA 137 0.271 0.006 0.272 25757 75 1 13 "Average Difference" C 148 0.846 -0.155 0.835 25757 76 1 13 "Average Difference" CA 150 1.040 -0.152 1.032 25757 77 1 13 "Average Difference" CB 136 0.986 -0.045 0.989 25757 78 1 13 "Average Difference" HN 144 0.635 -0.129 0.624 25757 79 1 14 "Average Difference" N 144 3.215 0.214 3.219 25757 80 1 14 "Average Difference" HA 137 0.266 0.027 0.265 25757 81 1 14 "Average Difference" C 148 0.925 -0.193 0.908 25757 82 1 14 "Average Difference" CA 150 1.050 -0.164 1.041 25757 83 1 14 "Average Difference" CB 136 0.962 -0.039 0.965 25757 84 1 14 "Average Difference" HN 144 0.653 -0.139 0.641 25757 85 1 15 "Average Difference" N 144 3.327 0.307 3.325 25757 86 1 15 "Average Difference" HA 137 0.264 0.023 0.264 25757 87 1 15 "Average Difference" C 148 0.956 -0.210 0.936 25757 88 1 15 "Average Difference" CA 150 1.047 -0.155 1.039 25757 89 1 15 "Average Difference" CB 136 0.974 -0.021 0.978 25757 90 1 15 "Average Difference" HN 144 0.645 -0.091 0.641 25757 91 1 16 "Average Difference" N 144 3.266 0.214 3.270 25757 92 1 16 "Average Difference" HA 137 0.286 0.007 0.287 25757 93 1 16 "Average Difference" C 148 0.947 -0.257 0.915 25757 94 1 16 "Average Difference" CA 150 1.048 -0.192 1.034 25757 95 1 16 "Average Difference" CB 136 0.981 -0.048 0.984 25757 96 1 16 "Average Difference" HN 144 0.604 -0.142 0.589 25757 97 1 17 "Average Difference" N 144 3.235 0.421 3.219 25757 98 1 17 "Average Difference" HA 137 0.289 0.007 0.290 25757 99 1 17 "Average Difference" C 148 0.893 -0.165 0.880 25757 100 1 17 "Average Difference" CA 150 1.089 -0.154 1.081 25757 101 1 17 "Average Difference" CB 136 0.959 -0.034 0.962 25757 102 1 17 "Average Difference" HN 144 0.627 -0.145 0.613 25757 103 1 18 "Average Difference" N 144 3.264 0.295 3.262 25757 104 1 18 "Average Difference" HA 137 0.282 0.020 0.283 25757 105 1 18 "Average Difference" C 148 0.887 -0.136 0.880 25757 106 1 18 "Average Difference" CA 150 1.085 -0.169 1.076 25757 107 1 18 "Average Difference" CB 136 1.029 -0.058 1.031 25757 108 1 18 "Average Difference" HN 144 0.624 -0.115 0.615 25757 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 25757 _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 9 9 ILE N N 9 116.733 116.733 121.165 -4.432 25757 2 1 . 1 1 9 9 ILE HA H 9 3.757 3.757 4.065 -0.308 25757 3 1 . 1 1 9 9 ILE C C 9 177.828 177.828 177.333 0.495 25757 4 1 . 1 1 9 9 ILE CA C 9 65.604 65.604 62.400 3.204 25757 5 1 . 1 1 9 9 ILE CB C 9 37.598 37.598 37.414 0.184 25757 6 1 . 1 1 9 9 ILE H H 9 7.366 7.366 8.171 -0.805 25757 7 1 . 1 1 10 10 ALA N N 10 121.080 121.080 123.214 -2.134 25757 8 1 . 1 1 10 10 ALA HA H 10 4.075 4.075 3.997 0.078 25757 9 1 . 1 1 10 10 ALA C C 10 180.921 180.921 179.297 1.624 25757 10 1 . 1 1 10 10 ALA CA C 10 55.603 55.603 55.302 0.301 25757 11 1 . 1 1 10 10 ALA CB C 10 17.984 17.984 17.851 0.133 25757 12 1 . 1 1 10 10 ALA H H 10 8.039 8.039 8.335 -0.296 25757 13 1 . 1 1 11 11 GLU N N 11 119.580 119.580 118.736 0.844 25757 14 1 . 1 1 11 11 GLU HA H 11 4.089 4.089 3.934 0.155 25757 15 1 . 1 1 11 11 GLU C C 11 179.561 179.561 178.962 0.599 25757 16 1 . 1 1 11 11 GLU CA C 11 59.885 59.885 59.242 0.643 25757 17 1 . 1 1 11 11 GLU CB C 11 29.463 29.463 28.983 0.480 25757 18 1 . 1 1 11 11 GLU H H 11 7.741 7.741 8.055 -0.314 25757 19 1 . 1 1 12 12 PHE N N 12 118.509 118.509 117.979 0.530 25757 20 1 . 1 1 12 12 PHE HA H 12 4.826 4.826 4.361 0.465 25757 21 1 . 1 1 12 12 PHE C C 12 179.000 179.000 178.394 0.606 25757 22 1 . 1 1 12 12 PHE CA C 12 60.164 60.164 59.945 0.219 25757 23 1 . 1 1 12 12 PHE CB C 12 38.110 38.110 38.009 0.101 25757 24 1 . 1 1 12 12 PHE H H 12 8.470 8.470 7.162 1.308 25757 25 1 . 1 1 13 13 LYS N N 13 123.523 123.523 119.821 3.702 25757 26 1 . 1 1 13 13 LYS HA H 13 4.026 4.026 4.112 -0.086 25757 27 1 . 1 1 13 13 LYS C C 13 179.260 179.260 179.187 0.073 25757 28 1 . 1 1 13 13 LYS CA C 13 60.164 60.164 59.771 0.393 25757 29 1 . 1 1 13 13 LYS CB C 13 31.833 31.833 32.070 -0.237 25757 30 1 . 1 1 13 13 LYS H H 13 9.171 9.171 8.469 0.702 25757 31 1 . 1 1 14 14 GLU N N 14 120.415 120.415 118.891 1.524 25757 32 1 . 1 1 14 14 GLU HA H 14 4.095 4.095 4.155 -0.060 25757 33 1 . 1 1 14 14 GLU C C 14 179.851 179.851 178.980 0.871 25757 34 1 . 1 1 14 14 GLU CA C 14 59.586 59.586 59.205 0.381 25757 35 1 . 1 1 14 14 GLU CB C 14 29.561 29.561 29.451 0.110 25757 36 1 . 1 1 14 14 GLU H H 14 7.822 7.822 8.246 -0.424 25757 37 1 . 1 1 15 15 ALA N N 15 122.143 122.143 122.688 -0.545 25757 38 1 . 1 1 15 15 ALA HA H 15 4.130 4.130 4.150 -0.020 25757 39 1 . 1 1 15 15 ALA C C 15 178.222 178.222 179.475 -1.253 25757 40 1 . 1 1 15 15 ALA CA C 15 55.190 55.190 55.166 0.024 25757 41 1 . 1 1 15 15 ALA CB C 15 18.502 18.502 18.693 -0.191 25757 42 1 . 1 1 15 15 ALA H H 15 8.244 8.244 8.226 0.018 25757 43 1 . 1 1 16 16 PHE N N 16 119.809 119.809 118.009 1.800 25757 44 1 . 1 1 16 16 PHE HA H 16 4.012 4.012 4.261 -0.249 25757 45 1 . 1 1 16 16 PHE C C 16 177.444 177.444 177.135 0.309 25757 46 1 . 1 1 16 16 PHE CA C 16 62.064 62.064 60.241 1.823 25757 47 1 . 1 1 16 16 PHE CB C 16 39.432 39.432 39.737 -0.305 25757 48 1 . 1 1 16 16 PHE H H 16 8.891 8.891 8.423 0.468 25757 49 1 . 1 1 17 17 SER N N 17 112.631 112.631 116.126 -3.495 25757 50 1 . 1 1 17 17 SER HA H 17 4.034 4.034 4.079 -0.045 25757 51 1 . 1 1 17 17 SER C C 17 174.675 174.675 176.203 -1.528 25757 52 1 . 1 1 17 17 SER CA C 17 61.507 61.507 61.706 -0.199 25757 53 1 . 1 1 17 17 SER CB C 17 63.414 63.414 63.437 -0.023 25757 54 1 . 1 1 17 17 SER H H 17 7.910 7.910 8.342 -0.432 25757 55 1 . 1 1 18 18 LEU N N 18 120.614 120.614 118.156 2.458 25757 56 1 . 1 1 18 18 LEU HA H 18 4.012 4.012 4.233 -0.221 25757 57 1 . 1 1 18 18 LEU C C 18 177.366 177.366 177.676 -0.310 25757 58 1 . 1 1 18 18 LEU CA C 18 57.386 57.386 57.235 0.151 25757 59 1 . 1 1 18 18 LEU CB C 18 41.595 41.595 41.847 -0.252 25757 60 1 . 1 1 18 18 LEU H H 18 7.423 7.423 7.863 -0.440 25757 61 1 . 1 1 19 19 PHE N N 19 114.602 114.602 117.023 -2.421 25757 62 1 . 1 1 19 19 PHE C C 19 176.961 176.961 176.045 0.916 25757 63 1 . 1 1 19 19 PHE CA C 19 59.484 59.484 59.624 -0.140 25757 64 1 . 1 1 19 19 PHE CB C 19 40.769 40.769 39.427 1.342 25757 65 1 . 1 1 19 19 PHE H H 19 7.254 7.254 7.253 0.001 25757 66 1 . 1 1 22 22 ASP HA H 22 4.575 4.575 4.614 -0.039 25757 67 1 . 1 1 22 22 ASP CA C 22 52.648 52.648 54.076 -1.428 25757 68 1 . 1 1 22 22 ASP CB C 22 40.010 40.010 40.816 -0.806 25757 69 1 . 1 1 23 23 GLY N N 23 108.244 108.244 108.922 -0.678 25757 70 1 . 1 1 23 23 GLY C C 23 175.188 175.188 174.990 0.197 25757 71 1 . 1 1 23 23 GLY CA C 23 47.403 47.403 46.166 1.237 25757 72 1 . 1 1 23 23 GLY H H 23 7.555 7.555 8.098 -0.543 25757 73 1 . 1 1 24 24 ASP N N 24 120.667 120.667 119.811 0.856 25757 74 1 . 1 1 24 24 ASP HA H 24 4.469 4.469 4.557 -0.088 25757 75 1 . 1 1 24 24 ASP C C 24 177.457 177.457 177.775 -0.318 25757 76 1 . 1 1 24 24 ASP CA C 24 53.792 53.792 53.477 0.315 25757 77 1 . 1 1 24 24 ASP CB C 24 40.516 40.516 41.401 -0.885 25757 78 1 . 1 1 24 24 ASP H H 24 8.397 8.397 8.208 0.189 25757 79 1 . 1 1 25 25 GLY N N 25 112.989 112.989 108.631 4.358 25757 80 1 . 1 1 25 25 GLY C C 25 173.639 173.639 173.407 0.232 25757 81 1 . 1 1 25 25 GLY CA C 25 45.501 45.501 45.159 0.343 25757 82 1 . 1 1 25 25 GLY H H 25 10.592 10.592 8.290 2.302 25757 83 1 . 1 1 26 26 THR N N 26 112.948 112.948 113.014 -0.066 25757 84 1 . 1 1 26 26 THR HA H 26 5.282 5.282 5.031 0.251 25757 85 1 . 1 1 26 26 THR C C 26 172.853 172.853 172.682 0.171 25757 86 1 . 1 1 26 26 THR CA C 26 59.817 59.817 61.261 -1.444 25757 87 1 . 1 1 26 26 THR CB C 26 72.465 72.465 71.320 1.145 25757 88 1 . 1 1 26 26 THR H H 26 8.121 8.121 8.146 -0.025 25757 89 1 . 1 1 27 27 ILE N N 27 127.195 127.195 123.278 3.917 25757 90 1 . 1 1 27 27 ILE HA H 27 4.913 4.913 4.712 0.201 25757 91 1 . 1 1 27 27 ILE C C 27 176.091 176.091 174.941 1.150 25757 92 1 . 1 1 27 27 ILE CA C 27 60.765 60.765 60.051 0.714 25757 93 1 . 1 1 27 27 ILE CB C 27 39.705 39.705 41.545 -1.840 25757 94 1 . 1 1 27 27 ILE H H 27 9.867 9.867 8.584 1.283 25757 95 1 . 1 1 28 28 THR N N 28 116.655 116.655 120.219 -3.564 25757 96 1 . 1 1 28 28 THR HA H 28 4.790 4.790 4.806 -0.016 25757 97 1 . 1 1 28 28 THR C C 28 176.696 176.696 176.303 0.393 25757 98 1 . 1 1 28 28 THR CA C 28 59.590 59.590 60.275 -0.685 25757 99 1 . 1 1 28 28 THR CB C 28 72.457 72.457 70.775 1.682 25757 100 1 . 1 1 28 28 THR H H 28 8.457 8.457 8.434 0.023 25757 101 1 . 1 1 29 29 THR N N 29 111.878 111.878 117.042 -5.164 25757 102 1 . 1 1 29 29 THR HA H 29 4.188 4.188 3.944 0.244 25757 103 1 . 1 1 29 29 THR C C 29 177.399 177.399 176.317 1.081 25757 104 1 . 1 1 29 29 THR CA C 29 66.386 66.386 66.657 -0.271 25757 105 1 . 1 1 29 29 THR CB C 29 67.726 67.726 68.389 -0.663 25757 106 1 . 1 1 29 29 THR H H 29 9.211 9.211 8.915 0.296 25757 107 1 . 1 1 30 30 LYS N N 30 121.140 121.140 121.309 -0.169 25757 108 1 . 1 1 30 30 LYS HA H 30 4.077 4.077 3.941 0.136 25757 109 1 . 1 1 30 30 LYS C C 30 179.793 179.793 178.765 1.028 25757 110 1 . 1 1 30 30 LYS CA C 30 59.292 59.292 59.649 -0.357 25757 111 1 . 1 1 30 30 LYS CB C 30 32.447 32.447 31.873 0.573 25757 112 1 . 1 1 30 30 LYS H H 30 7.580 7.580 7.917 -0.337 25757 113 1 . 1 1 31 31 GLU N N 31 121.865 121.865 119.600 2.264 25757 114 1 . 1 1 31 31 GLU HA H 31 3.994 3.994 3.966 0.029 25757 115 1 . 1 1 31 31 GLU C C 31 179.355 179.355 178.872 0.483 25757 116 1 . 1 1 31 31 GLU CA C 31 59.633 59.633 59.761 -0.128 25757 117 1 . 1 1 31 31 GLU CB C 31 29.852 29.852 29.444 0.408 25757 118 1 . 1 1 31 31 GLU H H 31 7.708 7.708 7.743 -0.035 25757 119 1 . 1 1 32 32 LEU N N 32 120.597 120.597 118.221 2.376 25757 120 1 . 1 1 32 32 LEU HA H 32 4.116 4.116 3.980 0.136 25757 121 1 . 1 1 32 32 LEU C C 32 178.885 178.885 178.989 -0.103 25757 122 1 . 1 1 32 32 LEU CA C 32 58.361 58.361 58.274 0.087 25757 123 1 . 1 1 32 32 LEU CB C 32 43.036 43.036 41.125 1.911 25757 124 1 . 1 1 32 32 LEU H H 32 8.688 8.688 7.737 0.951 25757 125 1 . 1 1 33 33 GLY N N 33 104.837 104.837 107.395 -2.558 25757 126 1 . 1 1 33 33 GLY C C 33 175.123 175.123 175.902 -0.779 25757 127 1 . 1 1 33 33 GLY CA C 33 48.247 48.247 47.558 0.689 25757 128 1 . 1 1 33 33 GLY H H 33 8.694 8.694 8.544 0.150 25757 129 1 . 1 1 34 34 THR N N 34 117.631 117.631 118.910 -1.279 25757 130 1 . 1 1 34 34 THR HA H 34 3.899 3.899 3.948 -0.049 25757 131 1 . 1 1 34 34 THR C C 34 176.951 176.951 176.731 0.220 25757 132 1 . 1 1 34 34 THR CA C 34 67.234 67.234 66.636 0.598 25757 133 1 . 1 1 34 34 THR CB C 34 68.863 68.863 68.581 0.282 25757 134 1 . 1 1 34 34 THR H H 34 7.960 7.960 7.953 0.007 25757 135 1 . 1 1 35 35 VAL N N 35 121.659 121.659 121.783 -0.124 25757 136 1 . 1 1 35 35 VAL HA H 35 3.517 3.517 3.599 -0.082 25757 137 1 . 1 1 35 35 VAL C C 35 178.265 178.265 177.624 0.641 25757 138 1 . 1 1 35 35 VAL CA C 35 66.675 66.675 66.525 0.150 25757 139 1 . 1 1 35 35 VAL CB C 35 31.293 31.293 31.222 0.071 25757 140 1 . 1 1 35 35 VAL H H 35 7.358 7.358 8.142 -0.784 25757 141 1 . 1 1 36 36 MET N N 36 117.456 117.456 116.286 1.170 25757 142 1 . 1 1 36 36 MET C C 36 179.088 179.088 178.370 0.718 25757 143 1 . 1 1 36 36 MET CA C 36 60.477 60.477 58.372 2.105 25757 144 1 . 1 1 36 36 MET CB C 36 32.443 32.443 32.521 -0.078 25757 145 1 . 1 1 36 36 MET H H 36 8.194 8.194 8.086 0.108 25757 146 1 . 1 1 37 37 ARG CA C 37 59.147 59.147 58.713 0.434 25757 147 1 . 1 1 37 37 ARG CB C 37 30.350 30.350 30.078 0.272 25757 148 1 . 1 1 38 38 SER HA H 38 4.085 4.085 4.319 -0.234 25757 149 1 . 1 1 38 38 SER C C 38 173.788 173.788 174.785 -0.997 25757 150 1 . 1 1 38 38 SER CA C 38 61.617 61.617 60.580 1.038 25757 151 1 . 1 1 38 38 SER CB C 38 62.943 62.943 63.072 -0.129 25757 152 1 . 1 1 39 39 LEU N N 39 119.003 119.003 119.662 -0.659 25757 153 1 . 1 1 39 39 LEU HA H 39 4.494 4.494 4.464 0.030 25757 154 1 . 1 1 39 39 LEU C C 39 176.470 176.470 177.135 -0.666 25757 155 1 . 1 1 39 39 LEU CA C 39 53.679 53.679 53.372 0.308 25757 156 1 . 1 1 39 39 LEU CB C 39 41.514 41.514 40.539 0.975 25757 157 1 . 1 1 39 39 LEU H H 39 7.230 7.230 7.332 -0.102 25757 158 1 . 1 1 40 40 GLY N N 40 105.026 105.026 106.778 -1.752 25757 159 1 . 1 1 40 40 GLY C C 40 174.322 174.322 174.438 -0.116 25757 160 1 . 1 1 40 40 GLY CA C 40 46.215 46.215 45.242 0.973 25757 161 1 . 1 1 40 40 GLY H H 40 7.698 7.698 7.835 -0.137 25757 162 1 . 1 1 41 41 GLN N N 41 117.929 117.929 119.369 -1.440 25757 163 1 . 1 1 41 41 GLN C C 41 174.557 174.557 174.796 -0.239 25757 164 1 . 1 1 41 41 GLN CB C 41 30.844 30.844 30.506 0.338 25757 165 1 . 1 1 41 41 GLN H H 41 7.866 7.866 7.682 0.184 25757 166 1 . 1 1 43 43 PRO HA H 43 4.736 4.736 4.558 0.178 25757 167 1 . 1 1 43 43 PRO C C 43 177.805 177.805 176.238 1.567 25757 168 1 . 1 1 43 43 PRO CA C 43 62.505 62.505 62.935 -0.430 25757 169 1 . 1 1 43 43 PRO CB C 43 32.162 32.162 32.605 -0.443 25757 170 1 . 1 1 44 44 THR N N 44 113.167 113.167 114.440 -1.273 25757 171 1 . 1 1 44 44 THR HA H 44 4.684 4.684 4.555 0.129 25757 172 1 . 1 1 44 44 THR C C 44 175.139 175.139 175.723 -0.584 25757 173 1 . 1 1 44 44 THR CA C 44 60.556 60.556 59.307 1.249 25757 174 1 . 1 1 44 44 THR CB C 44 71.064 71.064 71.126 -0.062 25757 175 1 . 1 1 44 44 THR H H 44 8.798 8.798 7.833 0.965 25757 176 1 . 1 1 45 45 GLU N N 45 120.673 120.673 121.186 -0.513 25757 177 1 . 1 1 45 45 GLU HA H 45 3.991 3.991 3.971 0.020 25757 178 1 . 1 1 45 45 GLU C C 45 178.940 178.940 178.506 0.434 25757 179 1 . 1 1 45 45 GLU CA C 45 59.901 59.901 60.011 -0.110 25757 180 1 . 1 1 45 45 GLU CB C 45 29.029 29.029 29.225 -0.196 25757 181 1 . 1 1 45 45 GLU H H 45 8.812 8.812 8.972 -0.160 25757 182 1 . 1 1 46 46 ALA N N 46 120.576 120.576 121.292 -0.716 25757 183 1 . 1 1 46 46 ALA HA H 46 3.967 3.967 4.082 -0.115 25757 184 1 . 1 1 46 46 ALA C C 46 180.290 180.290 179.848 0.442 25757 185 1 . 1 1 46 46 ALA CA C 46 54.919 54.919 55.147 -0.228 25757 186 1 . 1 1 46 46 ALA CB C 46 18.161 18.161 18.161 0.000 25757 187 1 . 1 1 46 46 ALA H H 46 8.276 8.276 8.314 -0.038 25757 188 1 . 1 1 47 47 GLU N N 47 116.104 116.104 119.080 -2.976 25757 189 1 . 1 1 47 47 GLU HA H 47 4.000 4.000 4.029 -0.029 25757 190 1 . 1 1 47 47 GLU C C 47 180.224 180.224 179.042 1.182 25757 191 1 . 1 1 47 47 GLU CA C 47 58.931 58.931 59.370 -0.439 25757 192 1 . 1 1 47 47 GLU CB C 47 29.989 29.989 29.293 0.696 25757 193 1 . 1 1 47 47 GLU H H 47 7.425 7.425 7.807 -0.382 25757 194 1 . 1 1 48 48 LEU N N 48 120.425 120.425 119.766 0.659 25757 195 1 . 1 1 48 48 LEU HA H 48 4.050 4.050 3.900 0.150 25757 196 1 . 1 1 48 48 LEU C C 48 178.551 178.551 179.172 -0.621 25757 197 1 . 1 1 48 48 LEU CA C 48 57.839 57.839 58.279 -0.440 25757 198 1 . 1 1 48 48 LEU CB C 48 42.569 42.569 41.331 1.238 25757 199 1 . 1 1 48 48 LEU H H 48 8.121 8.121 7.883 0.238 25757 200 1 . 1 1 49 49 GLN N N 49 118.372 118.372 118.238 0.134 25757 201 1 . 1 1 49 49 GLN HA H 49 3.762 3.762 3.883 -0.121 25757 202 1 . 1 1 49 49 GLN C C 49 178.567 178.567 178.412 0.155 25757 203 1 . 1 1 49 49 GLN CA C 49 58.863 58.863 59.060 -0.197 25757 204 1 . 1 1 49 49 GLN CB C 49 28.242 28.242 28.229 0.013 25757 205 1 . 1 1 49 49 GLN H H 49 8.302 8.302 8.283 0.019 25757 206 1 . 1 1 50 50 ASP N N 50 119.992 119.992 120.533 -0.541 25757 207 1 . 1 1 50 50 ASP HA H 50 4.360 4.360 4.351 0.009 25757 208 1 . 1 1 50 50 ASP C C 50 178.600 178.600 178.474 0.126 25757 209 1 . 1 1 50 50 ASP CA C 50 57.703 57.703 57.137 0.566 25757 210 1 . 1 1 50 50 ASP CB C 50 40.467 40.467 40.787 -0.320 25757 211 1 . 1 1 50 50 ASP H H 50 8.150 8.150 8.217 -0.067 25757 212 1 . 1 1 51 51 MET N N 51 119.238 119.238 119.216 0.022 25757 213 1 . 1 1 51 51 MET HA H 51 3.981 3.981 4.009 -0.028 25757 214 1 . 1 1 51 51 MET C C 51 179.006 179.006 178.751 0.255 25757 215 1 . 1 1 51 51 MET CA C 51 59.443 59.443 59.002 0.441 25757 216 1 . 1 1 51 51 MET CB C 51 33.380 33.380 32.537 0.843 25757 217 1 . 1 1 51 51 MET H H 51 7.844 7.844 8.017 -0.173 25757 218 1 . 1 1 52 52 ILE N N 52 118.161 118.161 118.395 -0.234 25757 219 1 . 1 1 52 52 ILE HA H 52 3.478 3.478 3.637 -0.160 25757 220 1 . 1 1 52 52 ILE C C 52 177.847 177.847 178.714 -0.867 25757 221 1 . 1 1 52 52 ILE CA C 52 64.995 64.995 64.495 0.500 25757 222 1 . 1 1 52 52 ILE CB C 52 37.123 37.123 36.581 0.542 25757 223 1 . 1 1 52 52 ILE H H 52 7.686 7.686 8.294 -0.608 25757 224 1 . 1 1 53 53 ASN N N 53 117.884 117.884 117.543 0.341 25757 225 1 . 1 1 53 53 ASN HA H 53 4.365 4.365 4.449 -0.085 25757 226 1 . 1 1 53 53 ASN C C 53 177.515 177.515 177.405 0.110 25757 227 1 . 1 1 53 53 ASN CA C 53 56.207 56.207 55.772 0.435 25757 228 1 . 1 1 53 53 ASN CB C 53 38.078 38.078 38.516 -0.438 25757 229 1 . 1 1 53 53 ASN H H 53 8.713 8.713 8.356 0.357 25757 230 1 . 1 1 54 54 GLU N N 54 116.178 116.178 117.974 -1.796 25757 231 1 . 1 1 54 54 GLU HA H 54 3.989 3.989 4.279 -0.290 25757 232 1 . 1 1 54 54 GLU C C 54 177.557 177.557 177.210 0.347 25757 233 1 . 1 1 54 54 GLU CA C 54 58.990 58.990 57.817 1.173 25757 234 1 . 1 1 54 54 GLU CB C 54 30.463 30.463 30.438 0.025 25757 235 1 . 1 1 54 54 GLU H H 54 7.530 7.530 8.025 -0.495 25757 236 1 . 1 1 55 55 VAL N N 55 107.164 107.164 111.107 -3.943 25757 237 1 . 1 1 55 55 VAL HA H 55 4.522 4.522 4.347 0.175 25757 238 1 . 1 1 55 55 VAL C C 55 175.602 175.602 174.387 1.215 25757 239 1 . 1 1 55 55 VAL CA C 55 60.352 60.352 60.624 -0.272 25757 240 1 . 1 1 55 55 VAL CB C 55 32.603 32.603 32.084 0.519 25757 241 1 . 1 1 55 55 VAL H H 55 7.175 7.175 7.533 -0.358 25757 242 1 . 1 1 56 56 ASP N N 56 122.126 122.126 120.706 1.420 25757 243 1 . 1 1 56 56 ASP HA H 56 4.599 4.599 5.075 -0.476 25757 244 1 . 1 1 56 56 ASP C C 56 176.182 176.182 175.887 0.295 25757 245 1 . 1 1 56 56 ASP CA C 56 53.806 53.806 53.429 0.377 25757 246 1 . 1 1 56 56 ASP CB C 56 40.270 40.270 42.143 -1.873 25757 247 1 . 1 1 56 56 ASP H H 56 7.569 7.569 7.446 0.123 25757 248 1 . 1 1 57 57 ALA N N 57 103.782 103.782 128.649 -24.867 25757 249 1 . 1 1 57 57 ALA HA H 57 4.180 4.180 4.259 -0.079 25757 250 1 . 1 1 57 57 ALA C C 57 178.584 178.584 178.058 0.526 25757 251 1 . 1 1 57 57 ALA CA C 57 54.344 54.344 53.498 0.846 25757 252 1 . 1 1 57 57 ALA CB C 57 19.524 19.524 19.610 -0.086 25757 253 1 . 1 1 57 57 ALA H H 57 8.515 8.515 8.687 -0.172 25757 254 1 . 1 1 58 58 ASP N N 58 113.602 113.602 118.481 -4.879 25757 255 1 . 1 1 58 58 ASP HA H 58 4.586 4.586 4.584 0.002 25757 256 1 . 1 1 58 58 ASP C C 58 177.756 177.756 177.141 0.615 25757 257 1 . 1 1 58 58 ASP CA C 58 52.762 52.762 54.437 -1.675 25757 258 1 . 1 1 58 58 ASP CB C 58 39.678 39.678 41.340 -1.662 25757 259 1 . 1 1 58 58 ASP H H 58 8.130 8.130 8.087 0.043 25757 260 1 . 1 1 59 59 GLY N N 59 109.195 109.195 109.000 0.195 25757 261 1 . 1 1 59 59 GLY C C 59 175.139 175.139 174.665 0.474 25757 262 1 . 1 1 59 59 GLY CA C 59 47.264 47.264 45.253 2.011 25757 263 1 . 1 1 59 59 GLY H H 59 7.694 7.694 8.448 -0.754 25757 264 1 . 1 1 60 60 ASN HA H 60 4.605 4.605 4.757 -0.152 25757 265 1 . 1 1 61 61 GLY N N 61 113.316 113.316 109.714 3.602 25757 266 1 . 1 1 61 61 GLY C C 61 173.234 173.234 173.092 0.142 25757 267 1 . 1 1 61 61 GLY CA C 61 45.698 45.698 45.608 0.089 25757 268 1 . 1 1 61 61 GLY H H 61 10.633 10.633 8.569 2.064 25757 269 1 . 1 1 62 62 THR N N 62 108.892 108.892 110.105 -1.213 25757 270 1 . 1 1 62 62 THR HA H 62 4.736 4.736 4.843 -0.107 25757 271 1 . 1 1 62 62 THR C C 62 173.091 173.091 173.046 0.045 25757 272 1 . 1 1 62 62 THR CA C 62 59.617 59.617 59.779 -0.162 25757 273 1 . 1 1 62 62 THR CB C 62 72.004 72.004 72.231 -0.227 25757 274 1 . 1 1 62 62 THR H H 62 7.673 7.673 7.852 -0.179 25757 275 1 . 1 1 63 63 ILE N N 63 123.324 123.324 123.292 0.032 25757 276 1 . 1 1 63 63 ILE HA H 63 5.129 5.129 4.759 0.370 25757 277 1 . 1 1 63 63 ILE C C 63 175.652 175.652 175.180 0.472 25757 278 1 . 1 1 63 63 ILE CA C 63 60.486 60.486 60.366 0.120 25757 279 1 . 1 1 63 63 ILE CB C 63 39.957 39.957 40.536 -0.579 25757 280 1 . 1 1 63 63 ILE H H 63 8.907 8.907 8.687 0.220 25757 281 1 . 1 1 64 64 ASP N N 64 128.253 128.253 127.624 0.629 25757 282 1 . 1 1 64 64 ASP HA H 64 5.321 5.321 4.899 0.422 25757 283 1 . 1 1 64 64 ASP C C 64 176.431 176.431 177.448 -1.017 25757 284 1 . 1 1 64 64 ASP CA C 64 52.331 52.331 53.388 -1.057 25757 285 1 . 1 1 64 64 ASP CB C 64 42.053 42.053 42.633 -0.580 25757 286 1 . 1 1 64 64 ASP H H 64 8.864 8.864 9.027 -0.163 25757 287 1 . 1 1 65 65 PHE N N 65 118.583 118.583 120.605 -2.022 25757 288 1 . 1 1 65 65 PHE HA H 65 3.860 3.860 4.227 -0.367 25757 289 1 . 1 1 65 65 PHE C C 65 173.458 173.458 174.770 -1.312 25757 290 1 . 1 1 65 65 PHE CA C 65 63.799 63.799 62.474 1.325 25757 291 1 . 1 1 65 65 PHE CB C 65 35.880 35.880 36.890 -1.010 25757 292 1 . 1 1 65 65 PHE H H 65 8.962 8.962 8.874 0.088 25757 293 1 . 1 1 66 66 PRO HA H 66 4.118 4.118 3.968 0.150 25757 294 1 . 1 1 66 66 PRO C C 66 180.038 180.038 178.481 1.557 25757 295 1 . 1 1 66 66 PRO CA C 66 66.690 66.690 65.132 1.558 25757 296 1 . 1 1 66 66 PRO CB C 66 30.677 30.677 30.961 -0.284 25757 297 1 . 1 1 67 67 GLU N N 67 118.402 118.402 119.362 -0.960 25757 298 1 . 1 1 67 67 GLU C C 67 178.737 178.737 178.640 0.097 25757 299 1 . 1 1 67 67 GLU CA C 67 59.008 59.008 59.745 -0.737 25757 300 1 . 1 1 67 67 GLU CB C 67 29.685 29.685 29.232 0.453 25757 301 1 . 1 1 67 67 GLU H H 67 7.953 7.953 8.239 -0.286 25757 302 1 . 1 1 68 68 PHE N N 68 123.421 123.421 120.145 3.276 25757 303 1 . 1 1 68 68 PHE HA H 68 3.972 3.972 4.133 -0.161 25757 304 1 . 1 1 68 68 PHE C C 68 177.184 177.184 177.237 -0.053 25757 305 1 . 1 1 68 68 PHE CA C 68 61.338 61.338 61.172 0.166 25757 306 1 . 1 1 68 68 PHE CB C 68 39.969 39.969 39.058 0.910 25757 307 1 . 1 1 68 68 PHE H H 68 8.928 8.928 7.600 1.328 25757 308 1 . 1 1 69 69 LEU N N 69 119.284 119.284 119.196 0.088 25757 309 1 . 1 1 69 69 LEU HA H 69 3.335 3.335 3.593 -0.258 25757 310 1 . 1 1 69 69 LEU C C 69 178.987 178.987 178.531 0.456 25757 311 1 . 1 1 69 69 LEU CA C 69 57.862 57.862 58.541 -0.679 25757 312 1 . 1 1 69 69 LEU CB C 69 40.832 40.832 41.313 -0.481 25757 313 1 . 1 1 69 69 LEU H H 69 8.374 8.374 7.624 0.750 25757 314 1 . 1 1 70 70 THR N N 70 116.017 116.017 114.515 1.502 25757 315 1 . 1 1 70 70 THR HA H 70 4.338 4.338 3.777 0.561 25757 316 1 . 1 1 70 70 THR C C 70 176.169 176.169 176.570 -0.401 25757 317 1 . 1 1 70 70 THR CA C 70 66.700 66.700 66.445 0.255 25757 318 1 . 1 1 70 70 THR CB C 70 68.379 68.379 68.594 -0.215 25757 319 1 . 1 1 70 70 THR H H 70 7.493 7.493 7.959 -0.466 25757 320 1 . 1 1 71 71 MET N N 71 121.915 121.915 121.724 0.192 25757 321 1 . 1 1 71 71 MET HA H 71 3.718 3.718 3.968 -0.250 25757 322 1 . 1 1 71 71 MET C C 71 178.190 178.190 177.655 0.535 25757 323 1 . 1 1 71 71 MET CA C 71 59.335 59.335 58.672 0.663 25757 324 1 . 1 1 71 71 MET CB C 71 33.894 33.894 32.268 1.626 25757 325 1 . 1 1 71 71 MET H H 71 7.924 7.924 7.910 0.014 25757 326 1 . 1 1 72 72 MET N N 72 116.973 116.973 117.174 -0.201 25757 327 1 . 1 1 72 72 MET HA H 72 3.968 3.968 4.078 -0.110 25757 328 1 . 1 1 72 72 MET C C 72 178.211 178.211 178.304 -0.093 25757 329 1 . 1 1 72 72 MET CA C 72 56.059 56.059 58.377 -2.318 25757 330 1 . 1 1 72 72 MET CB C 72 31.639 31.639 32.435 -0.796 25757 331 1 . 1 1 72 72 MET H H 72 8.276 8.276 7.817 0.459 25757 332 1 . 1 1 73 73 ALA N N 73 122.499 122.499 121.862 0.637 25757 333 1 . 1 1 73 73 ALA HA H 73 3.950 3.950 3.893 0.057 25757 334 1 . 1 1 73 73 ALA C C 73 180.231 180.231 179.367 0.864 25757 335 1 . 1 1 73 73 ALA CA C 73 54.953 54.953 54.882 0.071 25757 336 1 . 1 1 73 73 ALA CB C 73 18.032 18.032 17.757 0.275 25757 337 1 . 1 1 73 73 ALA H H 73 8.240 8.240 8.204 0.036 25757 338 1 . 1 1 74 74 ARG N N 74 116.098 116.098 118.552 -2.454 25757 339 1 . 1 1 74 74 ARG HA H 74 3.992 3.992 4.001 -0.009 25757 340 1 . 1 1 74 74 ARG C C 74 178.567 178.567 178.452 0.115 25757 341 1 . 1 1 74 74 ARG CA C 74 58.825 58.825 58.802 0.023 25757 342 1 . 1 1 74 74 ARG CB C 74 30.075 30.075 29.955 0.120 25757 343 1 . 1 1 74 74 ARG H H 74 7.420 7.420 7.878 -0.458 25757 344 1 . 1 1 75 75 LYS N N 75 119.046 119.046 119.496 -0.450 25757 345 1 . 1 1 75 75 LYS HA H 75 4.043 4.043 4.150 -0.107 25757 346 1 . 1 1 75 75 LYS C C 75 179.045 179.045 178.643 0.402 25757 347 1 . 1 1 75 75 LYS CA C 75 57.889 57.889 58.297 -0.408 25757 348 1 . 1 1 75 75 LYS CB C 75 31.766 31.766 31.990 -0.224 25757 349 1 . 1 1 75 75 LYS H H 75 7.862 7.862 8.040 -0.178 25757 350 1 . 1 1 76 76 MET N N 76 116.772 116.772 119.262 -2.490 25757 351 1 . 1 1 76 76 MET H H 76 8.099 8.099 7.998 0.101 25757 352 1 . 1 1 78 78 ASP HA H 78 4.634 4.634 4.634 -0.000 25757 353 1 . 1 1 78 78 ASP C C 78 176.395 176.395 176.509 -0.114 25757 354 1 . 1 1 78 78 ASP CA C 78 54.644 54.644 54.267 0.377 25757 355 1 . 1 1 78 78 ASP CB C 78 41.474 41.474 41.440 0.034 25757 356 1 . 1 1 79 79 THR N N 79 113.904 113.904 115.111 -1.207 25757 357 1 . 1 1 79 79 THR HA H 79 4.215 4.215 4.184 0.031 25757 358 1 . 1 1 79 79 THR C C 79 174.204 174.204 174.552 -0.348 25757 359 1 . 1 1 79 79 THR CA C 79 62.264 62.264 63.613 -1.349 25757 360 1 . 1 1 79 79 THR CB C 79 69.884 69.884 69.285 0.599 25757 361 1 . 1 1 79 79 THR H H 79 8.039 8.039 8.283 -0.244 25757 362 1 . 1 1 80 80 ASP N N 80 123.572 123.572 121.833 1.739 25757 363 1 . 1 1 80 80 ASP HA H 80 4.720 4.720 4.746 -0.026 25757 364 1 . 1 1 80 80 ASP C C 80 176.221 176.221 176.081 0.140 25757 365 1 . 1 1 80 80 ASP CA C 80 54.315 54.315 54.457 -0.142 25757 366 1 . 1 1 80 80 ASP CB C 80 41.427 41.427 41.144 0.283 25757 367 1 . 1 1 80 80 ASP H H 80 8.441 8.441 8.101 0.340 25757 368 1 . 1 1 81 81 SER N N 81 117.879 117.879 117.925 -0.046 25757 369 1 . 1 1 81 81 SER HA H 81 3.925 3.925 4.504 -0.579 25757 370 1 . 1 1 81 81 SER C C 81 175.264 175.264 175.679 -0.415 25757 371 1 . 1 1 81 81 SER CA C 81 58.860 58.860 59.367 -0.507 25757 372 1 . 1 1 81 81 SER CB C 81 63.790 63.790 63.912 -0.122 25757 373 1 . 1 1 81 81 SER H H 81 8.503 8.503 8.456 0.047 25757 374 1 . 1 1 82 82 GLU N N 82 123.206 123.206 122.201 1.005 25757 375 1 . 1 1 82 82 GLU HA H 82 4.058 4.058 4.000 0.058 25757 376 1 . 1 1 82 82 GLU C C 82 178.378 178.378 178.438 -0.060 25757 377 1 . 1 1 82 82 GLU CA C 82 59.586 59.586 59.942 -0.356 25757 378 1 . 1 1 82 82 GLU CB C 82 29.603 29.603 29.220 0.383 25757 379 1 . 1 1 82 82 GLU H H 82 8.563 8.563 8.753 -0.190 25757 380 1 . 1 1 83 83 GLU N N 83 119.262 119.262 118.869 0.393 25757 381 1 . 1 1 83 83 GLU HA H 83 3.957 3.957 3.965 -0.008 25757 382 1 . 1 1 83 83 GLU C C 83 178.606 178.606 178.867 -0.261 25757 383 1 . 1 1 83 83 GLU CA C 83 59.669 59.669 59.771 -0.102 25757 384 1 . 1 1 83 83 GLU CB C 83 29.355 29.355 29.084 0.271 25757 385 1 . 1 1 83 83 GLU H H 83 7.728 7.728 8.462 -0.734 25757 386 1 . 1 1 84 84 GLU N N 84 118.432 118.432 119.450 -1.018 25757 387 1 . 1 1 84 84 GLU HA H 84 4.107 4.107 4.082 0.025 25757 388 1 . 1 1 84 84 GLU C C 84 179.436 179.436 179.140 0.296 25757 389 1 . 1 1 84 84 GLU CA C 84 59.503 59.503 59.236 0.267 25757 390 1 . 1 1 84 84 GLU CB C 84 29.107 29.107 29.236 -0.129 25757 391 1 . 1 1 84 84 GLU H H 84 8.346 8.346 8.182 0.164 25757 392 1 . 1 1 85 85 ILE N N 85 120.925 120.925 120.530 0.395 25757 393 1 . 1 1 85 85 ILE HA H 85 3.748 3.748 3.817 -0.069 25757 394 1 . 1 1 85 85 ILE C C 85 177.661 177.661 178.253 -0.592 25757 395 1 . 1 1 85 85 ILE CA C 85 65.490 65.490 65.046 0.444 25757 396 1 . 1 1 85 85 ILE CB C 85 37.431 37.431 37.371 0.060 25757 397 1 . 1 1 85 85 ILE H H 85 7.821 7.821 8.303 -0.481 25757 398 1 . 1 1 86 86 ARG N N 86 121.916 121.916 118.946 2.970 25757 399 1 . 1 1 86 86 ARG HA H 86 4.136 4.136 3.899 0.237 25757 400 1 . 1 1 86 86 ARG C C 86 179.208 179.208 178.789 0.419 25757 401 1 . 1 1 86 86 ARG CA C 86 60.371 60.371 59.565 0.806 25757 402 1 . 1 1 86 86 ARG CB C 86 30.098 30.098 29.698 0.400 25757 403 1 . 1 1 86 86 ARG H H 86 8.432 8.432 8.249 0.183 25757 404 1 . 1 1 87 87 GLU N N 87 118.261 118.261 119.067 -0.806 25757 405 1 . 1 1 87 87 GLU HA H 87 4.112 4.112 3.937 0.175 25757 406 1 . 1 1 87 87 GLU C C 87 178.516 178.516 178.568 -0.051 25757 407 1 . 1 1 87 87 GLU CA C 87 59.025 59.025 59.225 -0.200 25757 408 1 . 1 1 87 87 GLU CB C 87 29.170 29.170 29.189 -0.018 25757 409 1 . 1 1 87 87 GLU H H 87 8.225 8.225 8.177 0.048 25757 410 1 . 1 1 88 88 ALA N N 88 121.009 121.009 122.575 -1.566 25757 411 1 . 1 1 88 88 ALA HA H 88 3.827 3.827 3.499 0.328 25757 412 1 . 1 1 88 88 ALA C C 88 177.947 177.947 178.269 -0.322 25757 413 1 . 1 1 88 88 ALA CA C 88 54.861 54.861 54.940 -0.079 25757 414 1 . 1 1 88 88 ALA CB C 88 17.955 17.955 18.298 -0.343 25757 415 1 . 1 1 88 88 ALA H H 88 7.789 7.789 7.948 -0.159 25757 416 1 . 1 1 89 89 PHE N N 89 117.164 117.164 118.557 -1.393 25757 417 1 . 1 1 89 89 PHE C C 89 176.134 176.134 177.361 -1.227 25757 418 1 . 1 1 89 89 PHE CA C 89 62.650 62.650 60.524 2.126 25757 419 1 . 1 1 89 89 PHE CB C 89 38.893 38.893 38.910 -0.017 25757 420 1 . 1 1 89 89 PHE H H 89 8.337 8.337 7.561 0.776 25757 421 1 . 1 1 90 90 ARG N N 90 114.900 114.900 117.880 -2.980 25757 422 1 . 1 1 90 90 ARG HA H 90 3.914 3.914 3.911 0.003 25757 423 1 . 1 1 90 90 ARG C C 90 178.296 178.296 177.388 0.908 25757 424 1 . 1 1 90 90 ARG CA C 90 59.079 59.079 58.376 0.703 25757 425 1 . 1 1 90 90 ARG CB C 90 30.093 30.093 30.409 -0.316 25757 426 1 . 1 1 90 90 ARG H H 90 7.681 7.681 7.764 -0.083 25757 427 1 . 1 1 91 91 VAL N N 91 116.927 116.927 115.267 1.660 25757 428 1 . 1 1 91 91 VAL HA H 91 3.607 3.607 3.889 -0.282 25757 429 1 . 1 1 91 91 VAL C C 91 177.964 177.964 177.158 0.806 25757 430 1 . 1 1 91 91 VAL CA C 91 64.960 64.960 64.224 0.736 25757 431 1 . 1 1 91 91 VAL CB C 91 31.619 31.619 31.516 0.103 25757 432 1 . 1 1 91 91 VAL H H 91 7.405 7.405 7.526 -0.121 25757 433 1 . 1 1 92 92 PHE N N 92 119.026 119.026 117.254 1.772 25757 434 1 . 1 1 92 92 PHE HA H 92 4.362 4.362 4.331 0.031 25757 435 1 . 1 1 92 92 PHE C C 92 177.639 177.639 176.153 1.486 25757 436 1 . 1 1 92 92 PHE CA C 92 57.721 57.721 58.343 -0.622 25757 437 1 . 1 1 92 92 PHE CB C 92 38.427 38.427 38.745 -0.318 25757 438 1 . 1 1 92 92 PHE H H 92 7.886 7.886 7.497 0.389 25757 439 1 . 1 1 93 93 ASP N N 93 118.238 118.238 118.870 -0.632 25757 440 1 . 1 1 93 93 ASP HA H 93 4.462 4.462 4.889 -0.427 25757 441 1 . 1 1 93 93 ASP C C 93 176.979 176.979 176.636 0.343 25757 442 1 . 1 1 93 93 ASP CA C 93 52.148 52.148 53.126 -0.979 25757 443 1 . 1 1 93 93 ASP CB C 93 38.149 38.149 39.829 -1.680 25757 444 1 . 1 1 93 93 ASP H H 93 8.009 8.009 7.427 0.582 25757 445 1 . 1 1 94 94 LYS N N 94 125.792 125.792 125.354 0.438 25757 446 1 . 1 1 94 94 LYS C C 94 178.213 178.213 177.708 0.505 25757 447 1 . 1 1 94 94 LYS CA C 94 59.318 59.318 58.847 0.471 25757 448 1 . 1 1 94 94 LYS CB C 94 31.028 31.028 32.545 -1.517 25757 449 1 . 1 1 94 94 LYS H H 94 7.428 7.428 8.148 -0.720 25757 450 1 . 1 1 95 95 ASP N N 95 113.833 113.833 115.959 -2.126 25757 451 1 . 1 1 95 95 ASP C C 95 177.718 177.718 177.121 0.597 25757 452 1 . 1 1 95 95 ASP CA C 95 52.945 52.945 54.210 -1.265 25757 453 1 . 1 1 95 95 ASP CB C 95 39.743 39.743 40.745 -1.002 25757 454 1 . 1 1 95 95 ASP H H 95 8.159 8.159 8.020 0.139 25757 455 1 . 1 1 96 96 GLY N N 96 109.414 109.414 108.264 1.150 25757 456 1 . 1 1 96 96 GLY C C 96 175.093 175.093 175.206 -0.113 25757 457 1 . 1 1 96 96 GLY CA C 96 47.254 47.254 45.860 1.394 25757 458 1 . 1 1 96 96 GLY H H 96 7.848 7.848 7.970 -0.122 25757 459 1 . 1 1 97 97 ASN N N 97 119.590 119.590 118.319 1.271 25757 460 1 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.539 0.073 25757 461 1 . 1 1 97 97 ASN C C 97 175.937 175.937 176.549 -0.612 25757 462 1 . 1 1 97 97 ASN CA C 97 52.888 52.888 53.504 -0.616 25757 463 1 . 1 1 97 97 ASN CB C 97 38.320 38.320 39.362 -1.042 25757 464 1 . 1 1 97 97 ASN H H 97 8.338 8.338 8.516 -0.178 25757 465 1 . 1 1 98 98 GLY N N 98 112.940 112.940 107.841 5.099 25757 466 1 . 1 1 98 98 GLY C C 98 172.429 172.429 172.638 -0.209 25757 467 1 . 1 1 98 98 GLY CA C 98 45.092 45.092 45.023 0.069 25757 468 1 . 1 1 98 98 GLY H H 98 10.695 10.695 8.825 1.870 25757 469 1 . 1 1 99 99 TYR N N 99 115.544 115.544 117.993 -2.449 25757 470 1 . 1 1 99 99 TYR HA H 99 5.087 5.087 5.318 -0.231 25757 471 1 . 1 1 99 99 TYR C C 99 174.859 174.859 174.738 0.121 25757 472 1 . 1 1 99 99 TYR CA C 99 56.018 56.018 57.126 -1.108 25757 473 1 . 1 1 99 99 TYR CB C 99 43.353 43.353 42.159 1.194 25757 474 1 . 1 1 99 99 TYR H H 99 7.597 7.597 8.318 -0.721 25757 475 1 . 1 1 100 100 ILE N N 100 127.078 127.078 124.512 2.566 25757 476 1 . 1 1 100 100 ILE HA H 100 4.789 4.789 4.704 0.085 25757 477 1 . 1 1 100 100 ILE C C 100 175.387 175.387 175.966 -0.579 25757 478 1 . 1 1 100 100 ILE CA C 100 61.006 61.006 60.887 0.119 25757 479 1 . 1 1 100 100 ILE CB C 100 38.790 38.790 39.781 -0.991 25757 480 1 . 1 1 100 100 ILE H H 100 10.267 10.267 9.262 1.005 25757 481 1 . 1 1 101 101 SER N N 101 124.102 124.102 122.594 1.508 25757 482 1 . 1 1 101 101 SER HA H 101 4.417 4.417 5.197 -0.780 25757 483 1 . 1 1 101 101 SER C C 101 175.360 175.360 175.325 0.035 25757 484 1 . 1 1 101 101 SER CA C 101 56.036 56.036 56.615 -0.579 25757 485 1 . 1 1 101 101 SER CB C 101 66.896 66.896 65.538 1.359 25757 486 1 . 1 1 101 101 SER H H 101 8.985 8.985 8.469 0.516 25757 487 1 . 1 1 102 102 ALA N N 102 122.780 122.780 124.757 -1.977 25757 488 1 . 1 1 102 102 ALA HA H 102 3.744 3.744 3.970 -0.226 25757 489 1 . 1 1 102 102 ALA C C 102 179.175 179.175 178.533 0.642 25757 490 1 . 1 1 102 102 ALA CA C 102 56.290 56.290 55.374 0.916 25757 491 1 . 1 1 102 102 ALA CB C 102 18.027 18.027 18.352 -0.325 25757 492 1 . 1 1 102 102 ALA H H 102 9.269 9.269 9.075 0.194 25757 493 1 . 1 1 103 103 ALA N N 103 118.513 118.513 121.132 -2.619 25757 494 1 . 1 1 103 103 ALA HA H 103 4.011 4.011 3.816 0.195 25757 495 1 . 1 1 103 103 ALA C C 103 181.521 181.521 179.258 2.262 25757 496 1 . 1 1 103 103 ALA CA C 103 55.354 55.354 55.133 0.221 25757 497 1 . 1 1 103 103 ALA CB C 103 18.291 18.291 18.217 0.074 25757 498 1 . 1 1 103 103 ALA H H 103 8.321 8.321 8.275 0.046 25757 499 1 . 1 1 104 104 GLU N N 104 119.550 119.550 119.177 0.373 25757 500 1 . 1 1 104 104 GLU HA H 104 4.006 4.006 4.046 -0.040 25757 501 1 . 1 1 104 104 GLU C C 104 179.750 179.750 179.107 0.643 25757 502 1 . 1 1 104 104 GLU CA C 104 59.169 59.169 59.516 -0.347 25757 503 1 . 1 1 104 104 GLU CB C 104 29.215 29.215 29.193 0.022 25757 504 1 . 1 1 104 104 GLU H H 104 7.867 7.867 8.268 -0.401 25757 505 1 . 1 1 105 105 LEU N N 105 122.688 122.688 120.478 2.210 25757 506 1 . 1 1 105 105 LEU HA H 105 3.918 3.918 3.857 0.061 25757 507 1 . 1 1 105 105 LEU C C 105 178.233 178.233 178.413 -0.180 25757 508 1 . 1 1 105 105 LEU CA C 105 57.734 57.734 58.130 -0.396 25757 509 1 . 1 1 105 105 LEU CB C 105 42.020 42.020 41.702 0.318 25757 510 1 . 1 1 105 105 LEU H H 105 8.746 8.746 7.955 0.792 25757 511 1 . 1 1 106 106 ARG N N 106 118.835 118.835 118.167 0.668 25757 512 1 . 1 1 106 106 ARG HA H 106 3.650 3.650 3.782 -0.132 25757 513 1 . 1 1 106 106 ARG C C 106 178.742 178.742 178.702 0.040 25757 514 1 . 1 1 106 106 ARG CA C 106 59.963 59.963 59.579 0.384 25757 515 1 . 1 1 106 106 ARG CB C 106 30.046 30.046 29.533 0.513 25757 516 1 . 1 1 106 106 ARG H H 106 8.684 8.684 8.172 0.512 25757 517 1 . 1 1 107 107 HIS N N 107 119.258 119.258 118.856 0.402 25757 518 1 . 1 1 107 107 HIS HA H 107 4.267 4.267 4.388 -0.121 25757 519 1 . 1 1 107 107 HIS C C 107 177.244 177.244 178.023 -0.779 25757 520 1 . 1 1 107 107 HIS CA C 107 60.152 60.152 58.729 1.423 25757 521 1 . 1 1 107 107 HIS CB C 107 30.575 30.575 29.760 0.815 25757 522 1 . 1 1 107 107 HIS H H 107 7.691 7.691 8.148 -0.457 25757 523 1 . 1 1 108 108 VAL N N 108 118.996 118.996 121.259 -2.263 25757 524 1 . 1 1 108 108 VAL HA H 108 3.438 3.438 3.750 -0.312 25757 525 1 . 1 1 108 108 VAL C C 108 177.998 177.998 178.237 -0.238 25757 526 1 . 1 1 108 108 VAL CA C 108 66.431 66.431 66.683 -0.252 25757 527 1 . 1 1 108 108 VAL CB C 108 31.424 31.424 31.705 -0.281 25757 528 1 . 1 1 108 108 VAL H H 108 7.599 7.599 8.192 -0.593 25757 529 1 . 1 1 109 109 MET N N 109 114.880 114.880 117.849 -2.969 25757 530 1 . 1 1 109 109 MET C C 109 179.119 179.119 178.131 0.988 25757 531 1 . 1 1 109 109 MET CA C 109 56.979 56.979 58.638 -1.659 25757 532 1 . 1 1 109 109 MET CB C 109 29.253 29.253 32.545 -3.292 25757 533 1 . 1 1 109 109 MET H H 109 7.911 7.911 8.205 -0.294 25757 534 1 . 1 1 110 110 THR N N 110 116.943 116.943 115.560 1.383 25757 535 1 . 1 1 110 110 THR HA H 110 4.229 4.229 4.110 0.119 25757 536 1 . 1 1 110 110 THR C C 110 178.506 178.506 176.973 1.533 25757 537 1 . 1 1 110 110 THR CA C 110 66.573 66.573 66.076 0.497 25757 538 1 . 1 1 110 110 THR CB C 110 68.575 68.575 68.584 -0.009 25757 539 1 . 1 1 110 110 THR H H 110 8.353 8.353 8.153 0.200 25757 540 1 . 1 1 111 111 ASN N N 111 123.829 123.829 120.232 3.597 25757 541 1 . 1 1 111 111 ASN HA H 111 4.362 4.362 4.430 -0.068 25757 542 1 . 1 1 111 111 ASN C C 111 177.197 177.197 177.129 0.068 25757 543 1 . 1 1 111 111 ASN CA C 111 55.959 55.959 55.877 0.082 25757 544 1 . 1 1 111 111 ASN CB C 111 37.223 37.223 38.394 -1.171 25757 545 1 . 1 1 111 111 ASN H H 111 8.053 8.053 8.166 -0.113 25757 546 1 . 1 1 112 112 LEU N N 112 119.036 119.036 116.899 2.137 25757 547 1 . 1 1 112 112 LEU HA H 112 4.170 4.170 4.115 0.055 25757 548 1 . 1 1 112 112 LEU C C 112 176.377 176.377 177.335 -0.958 25757 549 1 . 1 1 112 112 LEU CA C 112 55.505 55.505 56.219 -0.714 25757 550 1 . 1 1 112 112 LEU CB C 112 42.360 42.360 42.400 -0.040 25757 551 1 . 1 1 112 112 LEU H H 112 7.794 7.794 7.576 0.218 25757 552 1 . 1 1 113 113 GLY N N 113 106.045 106.045 104.815 1.230 25757 553 1 . 1 1 113 113 GLY C C 113 174.248 174.248 174.133 0.115 25757 554 1 . 1 1 113 113 GLY CA C 113 45.307 45.307 44.554 0.753 25757 555 1 . 1 1 113 113 GLY H H 113 7.741 7.741 7.663 0.078 25757 556 1 . 1 1 114 114 GLU N N 114 120.556 120.556 121.435 -0.879 25757 557 1 . 1 1 114 114 GLU HA H 114 4.310 4.310 4.294 0.016 25757 558 1 . 1 1 114 114 GLU C C 114 174.993 174.993 175.894 -0.901 25757 559 1 . 1 1 114 114 GLU CA C 114 54.637 54.637 55.459 -0.822 25757 560 1 . 1 1 114 114 GLU CB C 114 31.217 31.217 30.115 1.102 25757 561 1 . 1 1 114 114 GLU H H 114 7.980 7.980 7.897 0.083 25757 562 1 . 1 1 115 115 LYS N N 115 124.986 124.986 125.813 -0.827 25757 563 1 . 1 1 115 115 LYS HA H 115 4.334 4.334 4.277 0.058 25757 564 1 . 1 1 115 115 LYS C C 115 175.285 175.285 175.694 -0.409 25757 565 1 . 1 1 115 115 LYS CA C 115 55.581 55.581 56.554 -0.973 25757 566 1 . 1 1 115 115 LYS CB C 115 31.973 31.973 32.692 -0.719 25757 567 1 . 1 1 115 115 LYS H H 115 8.613 8.613 8.359 0.254 25757 568 1 . 1 1 116 116 LEU N N 116 125.243 125.243 123.252 1.991 25757 569 1 . 1 1 116 116 LEU HA H 116 4.688 4.688 4.776 -0.088 25757 570 1 . 1 1 116 116 LEU C C 116 178.365 178.365 176.002 2.363 25757 571 1 . 1 1 116 116 LEU CA C 116 54.348 54.348 53.606 0.742 25757 572 1 . 1 1 116 116 LEU CB C 116 44.289 44.289 44.104 0.185 25757 573 1 . 1 1 116 116 LEU H H 116 8.066 8.066 8.222 -0.156 25757 574 1 . 1 1 117 117 THR N N 117 114.324 114.324 113.184 1.140 25757 575 1 . 1 1 117 117 THR HA H 117 4.713 4.713 4.578 0.135 25757 576 1 . 1 1 117 117 THR C C 117 175.539 175.539 174.752 0.787 25757 577 1 . 1 1 117 117 THR CA C 117 60.756 60.756 60.195 0.561 25757 578 1 . 1 1 117 117 THR CB C 117 71.144 71.144 71.143 0.001 25757 579 1 . 1 1 117 117 THR H H 117 9.228 9.228 8.051 1.177 25757 580 1 . 1 1 118 118 ASP N N 118 121.016 121.016 122.157 -1.141 25757 581 1 . 1 1 118 118 ASP HA H 118 4.155 4.155 4.277 -0.122 25757 582 1 . 1 1 118 118 ASP H H 118 8.919 8.919 8.759 0.160 25757 583 1 . 1 1 119 119 GLU N N 119 121.016 121.016 118.608 2.408 25757 584 1 . 1 1 119 119 GLU C C 119 179.204 179.204 178.683 0.521 25757 585 1 . 1 1 119 119 GLU CA C 119 58.070 58.070 59.222 -1.152 25757 586 1 . 1 1 119 119 GLU CB C 119 29.044 29.044 29.336 -0.291 25757 587 1 . 1 1 119 119 GLU H H 119 8.919 8.919 8.516 0.403 25757 588 1 . 1 1 120 120 GLU N N 120 120.566 120.566 120.139 0.427 25757 589 1 . 1 1 120 120 GLU HA H 120 4.001 4.001 3.987 0.014 25757 590 1 . 1 1 120 120 GLU C C 120 180.329 180.329 178.853 1.476 25757 591 1 . 1 1 120 120 GLU CA C 120 59.091 59.091 59.218 -0.127 25757 592 1 . 1 1 120 120 GLU CB C 120 30.638 30.638 29.256 1.383 25757 593 1 . 1 1 120 120 GLU H H 120 7.732 7.732 7.583 0.149 25757 594 1 . 1 1 121 121 VAL N N 121 121.875 121.875 119.308 2.567 25757 595 1 . 1 1 121 121 VAL HA H 121 3.465 3.465 3.537 -0.072 25757 596 1 . 1 1 121 121 VAL C C 121 177.477 177.477 178.109 -0.632 25757 597 1 . 1 1 121 121 VAL CA C 121 67.171 67.171 66.564 0.607 25757 598 1 . 1 1 121 121 VAL CB C 121 31.434 31.434 31.302 0.132 25757 599 1 . 1 1 121 121 VAL H H 121 8.104 8.104 7.484 0.620 25757 600 1 . 1 1 122 122 ASP N N 122 120.566 120.566 119.212 1.354 25757 601 1 . 1 1 122 122 ASP HA H 122 4.335 4.335 4.288 0.047 25757 602 1 . 1 1 122 122 ASP C C 122 179.298 179.298 178.531 0.767 25757 603 1 . 1 1 122 122 ASP CA C 122 57.839 57.839 57.584 0.255 25757 604 1 . 1 1 122 122 ASP CB C 122 40.312 40.312 40.722 -0.410 25757 605 1 . 1 1 122 122 ASP H H 122 8.089 8.089 8.183 -0.094 25757 606 1 . 1 1 123 123 GLU N N 123 119.821 119.821 120.079 -0.258 25757 607 1 . 1 1 123 123 GLU HA H 123 4.049 4.049 4.035 0.014 25757 608 1 . 1 1 123 123 GLU C C 123 178.749 178.749 178.951 -0.202 25757 609 1 . 1 1 123 123 GLU CA C 123 59.318 59.318 59.180 0.138 25757 610 1 . 1 1 123 123 GLU CB C 123 29.386 29.386 29.595 -0.210 25757 611 1 . 1 1 123 123 GLU H H 123 8.105 8.105 7.995 0.110 25757 612 1 . 1 1 124 124 MET N N 124 119.288 119.288 118.735 0.553 25757 613 1 . 1 1 124 124 MET C C 124 180.865 180.865 178.916 1.949 25757 614 1 . 1 1 124 124 MET CA C 124 60.684 60.684 59.259 1.425 25757 615 1 . 1 1 124 124 MET CB C 124 33.141 33.141 32.198 0.944 25757 616 1 . 1 1 124 124 MET H H 124 7.726 7.726 8.080 -0.354 25757 617 1 . 1 1 125 125 ILE HA H 125 3.729 3.729 4.019 -0.290 25757 618 1 . 1 1 125 125 ILE C C 125 177.341 177.341 178.069 -0.728 25757 619 1 . 1 1 125 125 ILE CA C 125 63.801 63.801 63.668 0.133 25757 620 1 . 1 1 125 125 ILE CB C 125 35.565 35.565 36.883 -1.318 25757 621 1 . 1 1 126 126 ARG N N 126 118.555 118.555 119.629 -1.074 25757 622 1 . 1 1 126 126 ARG C C 126 179.164 179.164 178.134 1.030 25757 623 1 . 1 1 126 126 ARG CA C 126 59.924 59.924 59.175 0.749 25757 624 1 . 1 1 126 126 ARG CB C 126 29.865 29.865 30.083 -0.218 25757 625 1 . 1 1 126 126 ARG H H 126 8.380 8.380 8.058 0.322 25757 626 1 . 1 1 127 127 GLU HA H 127 3.925 3.925 4.344 -0.419 25757 627 1 . 1 1 127 127 GLU CA C 127 59.057 59.057 57.795 1.262 25757 628 1 . 1 1 127 127 GLU CB C 127 30.828 30.828 30.204 0.624 25757 629 1 . 1 1 128 128 ALA N N 128 116.764 116.764 120.284 -3.520 25757 630 1 . 1 1 128 128 ALA HA H 128 4.417 4.417 4.166 0.251 25757 631 1 . 1 1 128 128 ALA C C 128 177.885 177.885 176.935 0.950 25757 632 1 . 1 1 128 128 ALA CA C 128 51.955 51.955 52.871 -0.915 25757 633 1 . 1 1 128 128 ALA CB C 128 22.567 22.567 19.673 2.894 25757 634 1 . 1 1 128 128 ALA H H 128 7.152 7.152 7.880 -0.728 25757 635 1 . 1 1 129 129 ASP N N 129 117.762 117.762 118.009 -0.247 25757 636 1 . 1 1 129 129 ASP HA H 129 4.477 4.477 5.124 -0.647 25757 637 1 . 1 1 129 129 ASP C C 129 175.935 175.935 176.674 -0.739 25757 638 1 . 1 1 129 129 ASP CA C 129 54.515 54.515 52.382 2.133 25757 639 1 . 1 1 129 129 ASP CB C 129 40.745 40.745 41.751 -1.006 25757 640 1 . 1 1 129 129 ASP H H 129 8.007 8.007 7.847 0.160 25757 641 1 . 1 1 130 130 ILE N N 130 128.249 128.249 123.385 4.864 25757 642 1 . 1 1 130 130 ILE HA H 130 3.864 3.864 3.959 -0.095 25757 643 1 . 1 1 130 130 ILE C C 130 177.764 177.764 176.913 0.851 25757 644 1 . 1 1 130 130 ILE CA C 130 63.548 63.548 63.261 0.287 25757 645 1 . 1 1 130 130 ILE CB C 130 38.648 38.648 37.943 0.705 25757 646 1 . 1 1 130 130 ILE H H 130 8.412 8.412 8.330 0.082 25757 647 1 . 1 1 131 131 ASP N N 131 116.430 116.430 118.037 -1.607 25757 648 1 . 1 1 131 131 ASP HA H 131 4.534 4.534 4.655 -0.121 25757 649 1 . 1 1 131 131 ASP C C 131 178.313 178.313 176.911 1.402 25757 650 1 . 1 1 131 131 ASP CA C 131 53.884 53.884 54.661 -0.777 25757 651 1 . 1 1 131 131 ASP CB C 131 39.962 39.962 41.087 -1.125 25757 652 1 . 1 1 131 131 ASP H H 131 8.254 8.254 8.166 0.088 25757 653 1 . 1 1 132 132 GLY N N 132 108.460 108.460 109.052 -0.593 25757 654 1 . 1 1 132 132 GLY C C 132 175.211 175.211 174.704 0.507 25757 655 1 . 1 1 132 132 GLY CA C 132 47.603 47.603 45.969 1.634 25757 656 1 . 1 1 132 132 GLY H H 132 7.547 7.547 7.935 -0.388 25757 657 1 . 1 1 133 133 ASP N N 133 120.909 120.909 119.336 1.573 25757 658 1 . 1 1 133 133 ASP HA H 133 4.463 4.463 4.573 -0.111 25757 659 1 . 1 1 133 133 ASP C C 133 177.691 177.691 177.492 0.199 25757 660 1 . 1 1 133 133 ASP CA C 133 53.814 53.814 52.975 0.839 25757 661 1 . 1 1 133 133 ASP CB C 133 40.298 40.298 40.855 -0.557 25757 662 1 . 1 1 133 133 ASP H H 133 8.339 8.339 8.386 -0.047 25757 663 1 . 1 1 134 134 GLY N N 134 112.704 112.704 107.938 4.766 25757 664 1 . 1 1 134 134 GLY C C 134 172.722 172.722 173.533 -0.811 25757 665 1 . 1 1 134 134 GLY CA C 134 46.037 46.037 45.327 0.710 25757 666 1 . 1 1 134 134 GLY H H 134 10.396 10.396 8.123 2.272 25757 667 1 . 1 1 135 135 GLN N N 135 114.799 114.799 118.463 -3.664 25757 668 1 . 1 1 135 135 GLN HA H 135 4.864 4.864 5.147 -0.283 25757 669 1 . 1 1 135 135 GLN C C 135 174.760 174.760 175.046 -0.286 25757 670 1 . 1 1 135 135 GLN CA C 135 53.321 53.321 54.414 -1.094 25757 671 1 . 1 1 135 135 GLN CB C 135 32.065 32.065 32.879 -0.814 25757 672 1 . 1 1 135 135 GLN H H 135 7.975 7.975 8.538 -0.563 25757 673 1 . 1 1 136 136 VAL N N 136 125.364 125.364 125.523 -0.159 25757 674 1 . 1 1 136 136 VAL HA H 136 5.208 5.208 4.651 0.557 25757 675 1 . 1 1 136 136 VAL C C 136 175.831 175.831 175.490 0.341 25757 676 1 . 1 1 136 136 VAL CA C 136 61.817 61.817 61.335 0.482 25757 677 1 . 1 1 136 136 VAL CB C 136 33.674 33.674 32.862 0.812 25757 678 1 . 1 1 136 136 VAL H H 136 9.169 9.169 9.120 0.049 25757 679 1 . 1 1 137 137 ASN N N 137 129.155 129.155 125.531 3.624 25757 680 1 . 1 1 137 137 ASN C C 137 174.737 174.737 175.650 -0.913 25757 681 1 . 1 1 137 137 ASN CA C 137 51.351 51.351 51.229 0.122 25757 682 1 . 1 1 137 137 ASN CB C 137 38.323 38.323 41.325 -3.002 25757 683 1 . 1 1 137 137 ASN H H 137 9.652 9.652 8.592 1.060 25757 684 1 . 1 1 138 138 TYR N N 138 118.504 118.504 122.468 -3.964 25757 685 1 . 1 1 138 138 TYR HA H 138 3.279 3.279 3.610 -0.331 25757 686 1 . 1 1 138 138 TYR C C 138 176.174 176.174 177.182 -1.008 25757 687 1 . 1 1 138 138 TYR CA C 138 62.574 62.574 61.674 0.900 25757 688 1 . 1 1 138 138 TYR CB C 138 37.730 37.730 38.184 -0.454 25757 689 1 . 1 1 138 138 TYR H H 138 8.460 8.460 8.632 -0.172 25757 690 1 . 1 1 139 139 GLU N N 139 118.644 118.644 117.874 0.770 25757 691 1 . 1 1 139 139 GLU HA H 139 3.548 3.548 3.757 -0.209 25757 692 1 . 1 1 139 139 GLU C C 139 180.265 180.265 178.514 1.750 25757 693 1 . 1 1 139 139 GLU CA C 139 60.486 60.486 59.911 0.575 25757 694 1 . 1 1 139 139 GLU CB C 139 28.991 28.991 28.911 0.080 25757 695 1 . 1 1 139 139 GLU H H 139 8.136 8.136 8.370 -0.235 25757 696 1 . 1 1 140 140 GLU N N 140 120.030 120.030 117.031 2.999 25757 697 1 . 1 1 140 140 GLU HA H 140 3.888 3.888 4.057 -0.169 25757 698 1 . 1 1 140 140 GLU C C 140 179.627 179.627 177.987 1.640 25757 699 1 . 1 1 140 140 GLU CA C 140 58.677 58.677 58.014 0.663 25757 700 1 . 1 1 140 140 GLU CB C 140 29.727 29.727 29.224 0.503 25757 701 1 . 1 1 140 140 GLU H H 140 8.798 8.798 8.219 0.579 25757 702 1 . 1 1 141 141 PHE N N 141 123.154 123.154 121.973 1.181 25757 703 1 . 1 1 141 141 PHE HA H 141 3.697 3.697 3.891 -0.194 25757 704 1 . 1 1 141 141 PHE C C 141 176.952 176.952 177.669 -0.717 25757 705 1 . 1 1 141 141 PHE CA C 141 62.052 62.052 60.865 1.187 25757 706 1 . 1 1 141 141 PHE CB C 141 40.131 40.131 39.441 0.690 25757 707 1 . 1 1 141 141 PHE H H 141 8.633 8.633 7.961 0.672 25757 708 1 . 1 1 142 142 VAL N N 142 120.046 120.046 116.345 3.701 25757 709 1 . 1 1 142 142 VAL HA H 142 2.956 2.956 3.598 -0.642 25757 710 1 . 1 1 142 142 VAL C C 142 179.627 179.627 177.485 2.141 25757 711 1 . 1 1 142 142 VAL CA C 142 67.243 67.243 65.225 2.018 25757 712 1 . 1 1 142 142 VAL CB C 142 31.140 31.140 30.859 0.281 25757 713 1 . 1 1 142 142 VAL H H 142 8.894 8.894 8.046 0.848 25757 714 1 . 1 1 143 143 GLN N N 143 118.996 118.996 119.784 -0.788 25757 715 1 . 1 1 143 143 GLN HA H 143 3.776 3.776 4.011 -0.235 25757 716 1 . 1 1 143 143 GLN C C 143 178.443 178.443 177.915 0.528 25757 717 1 . 1 1 143 143 GLN CA C 143 59.129 59.129 58.161 0.968 25757 718 1 . 1 1 143 143 GLN CB C 143 27.743 27.743 28.241 -0.498 25757 719 1 . 1 1 143 143 GLN H H 143 7.627 7.627 7.501 0.126 25757 720 1 . 1 1 144 144 MET N N 144 116.361 116.361 118.255 -1.894 25757 721 1 . 1 1 144 144 MET HA H 144 4.169 4.169 4.089 0.080 25757 722 1 . 1 1 144 144 MET C C 144 178.418 178.418 176.677 1.741 25757 723 1 . 1 1 144 144 MET CA C 144 56.137 56.137 57.715 -1.578 25757 724 1 . 1 1 144 144 MET CB C 144 31.095 31.095 32.270 -1.175 25757 725 1 . 1 1 144 144 MET H H 144 7.179 7.179 7.371 -0.192 25757 726 1 . 1 1 145 145 MET N N 145 115.373 115.373 115.493 -0.120 25757 727 1 . 1 1 145 145 MET HA H 145 4.334 4.334 4.538 -0.204 25757 728 1 . 1 1 145 145 MET C C 145 177.217 177.217 176.053 1.164 25757 729 1 . 1 1 145 145 MET CA C 145 55.296 55.296 55.250 0.046 25757 730 1 . 1 1 145 145 MET CB C 145 34.458 34.458 33.393 1.065 25757 731 1 . 1 1 145 145 MET H H 145 7.776 7.776 7.516 0.260 25757 732 1 . 1 1 146 146 THR N N 146 107.988 107.988 112.217 -4.229 25757 733 1 . 1 1 146 146 THR HA H 146 4.239 4.239 4.428 -0.189 25757 734 1 . 1 1 146 146 THR C C 146 175.378 175.378 174.886 0.492 25757 735 1 . 1 1 146 146 THR CA C 146 61.625 61.625 61.574 0.051 25757 736 1 . 1 1 146 146 THR CB C 146 70.817 70.817 68.415 2.402 25757 737 1 . 1 1 146 146 THR H H 146 7.736 7.736 7.646 0.090 25757 738 1 . 1 1 147 147 GLY N N 147 110.157 110.157 110.098 0.059 25757 739 1 . 1 1 147 147 GLY C C 147 174.046 174.046 174.054 -0.008 25757 740 1 . 1 1 147 147 GLY CA C 147 45.544 45.544 44.744 0.800 25757 741 1 . 1 1 147 147 GLY H H 147 7.793 7.793 7.977 -0.184 25757 742 1 . 1 1 150 150 THR HA H 150 4.239 4.239 4.380 -0.141 25757 743 1 . 1 1 150 150 THR C C 150 174.397 174.397 174.380 0.017 25757 744 1 . 1 1 150 150 THR CA C 150 61.260 61.260 62.042 -0.782 25757 745 1 . 1 1 150 150 THR CB C 150 70.358 70.358 69.383 0.975 25757 746 1 . 1 1 151 151 ALA N N 151 126.304 126.304 123.762 2.542 25757 747 1 . 1 1 151 151 ALA HA H 151 4.288 4.288 4.530 -0.242 25757 748 1 . 1 1 151 151 ALA C C 151 177.678 177.678 177.465 0.212 25757 749 1 . 1 1 151 151 ALA CA C 151 52.148 52.148 51.525 0.623 25757 750 1 . 1 1 151 151 ALA CB C 151 19.419 19.419 19.997 -0.578 25757 751 1 . 1 1 151 151 ALA H H 151 8.618 8.618 7.352 1.266 25757 752 1 . 1 1 152 152 ALA N N 152 123.861 123.861 121.477 2.384 25757 753 1 . 1 1 152 152 ALA HA H 152 4.118 4.118 4.361 -0.243 25757 754 1 . 1 1 152 152 ALA C C 152 178.823 178.823 178.348 0.475 25757 755 1 . 1 1 152 152 ALA CA C 152 53.494 53.494 51.539 1.955 25757 756 1 . 1 1 152 152 ALA CB C 152 18.757 18.757 18.197 0.560 25757 757 1 . 1 1 152 152 ALA H H 152 8.354 8.354 8.679 -0.325 25757 758 1 . 1 1 153 153 GLY N N 153 109.984 109.984 107.534 2.450 25757 759 1 . 1 1 153 153 GLY C C 153 174.389 174.389 175.702 -1.313 25757 760 1 . 1 1 153 153 GLY CA C 153 45.131 45.131 47.122 -1.991 25757 761 1 . 1 1 153 153 GLY H H 153 9.028 9.028 8.190 0.838 25757 762 1 . 1 1 154 154 SER N N 154 113.934 113.934 118.105 -4.171 25757 763 1 . 1 1 154 154 SER HA H 154 4.255 4.255 4.020 0.235 25757 764 1 . 1 1 154 154 SER C C 154 177.929 177.929 176.726 1.202 25757 765 1 . 1 1 154 154 SER CA C 154 59.379 59.379 62.044 -2.665 25757 766 1 . 1 1 154 154 SER CB C 154 64.090 64.090 62.576 1.514 25757 767 1 . 1 1 154 154 SER H H 154 7.962 7.962 8.123 -0.161 25757 768 1 . 1 1 155 155 GLY N N 155 115.337 115.337 109.184 6.153 25757 769 1 . 1 1 155 155 GLY C C 155 175.891 175.891 175.570 0.321 25757 770 1 . 1 1 155 155 GLY CA C 155 47.646 47.646 46.751 0.895 25757 771 1 . 1 1 155 155 GLY H H 155 9.451 9.451 7.751 1.700 25757 772 1 . 1 1 156 156 TRP N N 156 119.600 119.600 121.922 -2.322 25757 773 1 . 1 1 156 156 TRP HA H 156 4.271 4.271 4.288 -0.017 25757 774 1 . 1 1 156 156 TRP C C 156 178.947 178.947 178.949 -0.002 25757 775 1 . 1 1 156 156 TRP CA C 156 60.164 60.164 60.239 -0.075 25757 776 1 . 1 1 156 156 TRP CB C 156 29.603 29.603 29.106 0.497 25757 777 1 . 1 1 156 156 TRP H H 156 8.542 8.542 7.348 1.194 25757 778 1 . 1 1 157 157 ARG N N 157 118.583 118.583 119.668 -1.085 25757 779 1 . 1 1 157 157 ARG HA H 157 3.982 3.982 4.025 -0.043 25757 780 1 . 1 1 157 157 ARG C C 157 177.894 177.894 178.344 -0.450 25757 781 1 . 1 1 157 157 ARG CA C 157 59.338 59.338 59.558 -0.220 25757 782 1 . 1 1 157 157 ARG CB C 157 30.057 30.057 29.923 0.134 25757 783 1 . 1 1 157 157 ARG H H 157 7.747 7.747 8.518 -0.771 25757 784 1 . 1 1 158 158 LYS N N 158 117.033 117.033 120.288 -3.255 25757 785 1 . 1 1 158 158 LYS HA H 158 3.943 3.943 4.052 -0.109 25757 786 1 . 1 1 158 158 LYS C C 158 176.973 176.973 178.963 -1.990 25757 787 1 . 1 1 158 158 LYS CA C 158 60.374 60.374 59.863 0.510 25757 788 1 . 1 1 158 158 LYS CB C 158 32.291 32.291 32.154 0.137 25757 789 1 . 1 1 158 158 LYS H H 158 7.529 7.529 8.031 -0.502 25757 790 1 . 1 1 159 159 ILE N N 159 116.553 116.553 120.364 -3.811 25757 791 1 . 1 1 159 159 ILE HA H 159 3.544 3.544 3.757 -0.213 25757 792 1 . 1 1 159 159 ILE C C 159 176.894 176.894 177.190 -0.296 25757 793 1 . 1 1 159 159 ILE CA C 159 65.516 65.516 64.976 0.540 25757 794 1 . 1 1 159 159 ILE CB C 159 37.804 37.804 38.025 -0.221 25757 795 1 . 1 1 159 159 ILE H H 159 7.348 7.348 8.228 -0.880 25757 796 1 . 1 1 160 160 LYS N N 160 119.278 119.278 120.344 -1.066 25757 797 1 . 1 1 160 160 LYS HA H 160 4.039 4.039 4.339 -0.299 25757 798 1 . 1 1 160 160 LYS C C 160 178.566 178.566 179.254 -0.688 25757 799 1 . 1 1 160 160 LYS CA C 160 60.374 60.374 59.796 0.578 25757 800 1 . 1 1 160 160 LYS CB C 160 32.818 32.818 32.442 0.376 25757 801 1 . 1 1 160 160 LYS H H 160 8.225 8.225 8.087 0.138 25757 802 1 . 1 1 161 161 LEU N N 161 117.056 117.056 120.108 -3.052 25757 803 1 . 1 1 161 161 LEU HA H 161 4.060 4.060 4.141 -0.081 25757 804 1 . 1 1 161 161 LEU C C 161 178.977 178.977 178.927 0.050 25757 805 1 . 1 1 161 161 LEU CA C 161 58.024 58.024 57.991 0.033 25757 806 1 . 1 1 161 161 LEU CB C 161 41.982 41.982 41.763 0.219 25757 807 1 . 1 1 161 161 LEU H H 161 8.057 8.057 8.402 -0.345 25757 808 1 . 1 1 162 162 ALA N N 162 121.814 121.814 122.169 -0.355 25757 809 1 . 1 1 162 162 ALA HA H 162 4.092 4.092 4.157 -0.065 25757 810 1 . 1 1 162 162 ALA C C 162 178.374 178.374 179.715 -1.341 25757 811 1 . 1 1 162 162 ALA CA C 162 55.790 55.790 55.301 0.489 25757 812 1 . 1 1 162 162 ALA CB C 162 18.325 18.325 18.627 -0.302 25757 813 1 . 1 1 162 162 ALA H H 162 8.170 8.170 8.262 -0.092 25757 814 1 . 1 1 163 163 VAL N N 163 115.449 115.449 116.122 -0.673 25757 815 1 . 1 1 163 163 VAL HA H 163 3.618 3.618 3.848 -0.230 25757 816 1 . 1 1 163 163 VAL C C 163 178.362 178.362 177.661 0.702 25757 817 1 . 1 1 163 163 VAL CA C 163 66.272 66.272 65.488 0.784 25757 818 1 . 1 1 163 163 VAL CB C 163 32.037 32.037 31.235 0.802 25757 819 1 . 1 1 163 163 VAL H H 163 8.499 8.499 8.173 0.326 25757 820 1 . 1 1 164 164 ARG N N 164 115.775 115.775 120.228 -4.453 25757 821 1 . 1 1 164 164 ARG HA H 164 4.197 4.197 4.289 -0.092 25757 822 1 . 1 1 164 164 ARG C C 164 178.938 178.938 178.430 0.508 25757 823 1 . 1 1 164 164 ARG CA C 164 57.683 57.683 58.763 -1.080 25757 824 1 . 1 1 164 164 ARG CB C 164 29.834 29.834 30.264 -0.430 25757 825 1 . 1 1 164 164 ARG H H 164 8.165 8.165 8.285 -0.120 25757 826 1 . 1 1 165 165 GLY N N 165 105.570 105.570 106.636 -1.066 25757 827 1 . 1 1 165 165 GLY C C 165 173.134 173.134 175.221 -2.087 25757 828 1 . 1 1 165 165 GLY CA C 165 46.742 46.742 46.004 0.738 25757 829 1 . 1 1 165 165 GLY H H 165 8.455 8.455 8.216 0.239 25757 830 1 . 1 1 166 166 ALA N N 166 120.648 120.648 123.025 -2.377 25757 831 1 . 1 1 166 166 ALA HA H 166 4.342 4.342 4.315 0.027 25757 832 1 . 1 1 166 166 ALA C C 166 176.155 176.155 177.712 -1.557 25757 833 1 . 1 1 166 166 ALA CA C 166 51.773 51.773 53.942 -2.169 25757 834 1 . 1 1 166 166 ALA CB C 166 19.478 19.478 19.125 0.353 25757 835 1 . 1 1 166 166 ALA H H 166 7.826 7.826 7.976 -0.150 25757 836 1 . 1 1 167 167 GLN N N 167 117.315 117.315 117.208 0.107 25757 837 1 . 1 1 167 167 GLN HA H 167 4.277 4.277 4.436 -0.159 25757 838 1 . 1 1 167 167 GLN C C 167 175.571 175.571 175.209 0.362 25757 839 1 . 1 1 167 167 GLN CA C 167 55.927 55.927 54.786 1.141 25757 840 1 . 1 1 167 167 GLN CB C 167 30.185 30.185 29.914 0.271 25757 841 1 . 1 1 167 167 GLN H H 167 7.498 7.498 7.603 -0.105 25757 842 1 . 1 1 168 168 ALA N N 168 126.706 126.706 126.640 0.066 25757 843 1 . 1 1 168 168 ALA HA H 168 4.279 4.279 4.223 0.056 25757 844 1 . 1 1 168 168 ALA C C 168 177.227 177.227 177.330 -0.103 25757 845 1 . 1 1 168 168 ALA CA C 168 52.066 52.066 53.163 -1.097 25757 846 1 . 1 1 168 168 ALA CB C 168 19.706 19.706 19.487 0.219 25757 847 1 . 1 1 168 168 ALA H H 168 8.534 8.534 8.425 0.109 25757 stop_ save_