data_18387 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18387 _Entry.PDB_ID 2LRN 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 18387 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 SER HA H 2 3.992 3.992 4.274 -0.282 18387 2 1 1 . 1 1 2 2 SER CA C 2 57.555 57.555 59.593 -2.038 18387 3 1 1 . 1 1 2 2 SER CB C 2 64.977 64.977 63.544 1.433 18387 4 1 1 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.546 -0.107 18387 5 1 1 . 1 1 3 3 LEU C C 3 176.631 176.631 175.432 1.199 18387 6 1 1 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.389 0.175 18387 7 1 1 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.015 -0.291 18387 8 1 1 . 1 1 4 4 ALA N N 4 125.483 125.483 123.525 1.958 18387 9 1 1 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.682 -0.303 18387 10 1 1 . 1 1 4 4 ALA C C 4 179.642 179.642 176.751 2.891 18387 11 1 1 . 1 1 4 4 ALA CA C 4 51.735 51.735 50.646 1.089 18387 12 1 1 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.343 -1.591 18387 13 1 1 . 1 1 4 4 ALA H H 4 8.483 8.483 8.045 0.438 18387 14 1 1 . 1 1 5 5 THR HA H 5 3.845 3.845 4.541 -0.696 18387 15 1 1 . 1 1 5 5 THR C C 5 175.487 175.487 176.176 -0.689 18387 16 1 1 . 1 1 5 5 THR CA C 5 64.531 64.531 62.484 2.047 18387 17 1 1 . 1 1 5 5 THR CB C 5 68.108 68.108 68.137 -0.029 18387 18 1 1 . 1 1 6 6 GLY N N 6 114.298 114.298 115.929 -1.631 18387 19 1 1 . 1 1 6 6 GLY C C 6 174.324 174.324 174.023 0.301 18387 20 1 1 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.738 0.097 18387 21 1 1 . 1 1 6 6 GLY H H 6 9.511 9.511 9.052 0.459 18387 22 1 1 . 1 1 7 7 SER N N 7 115.270 115.270 117.206 -1.936 18387 23 1 1 . 1 1 7 7 SER HA H 7 4.500 4.500 4.603 -0.103 18387 24 1 1 . 1 1 7 7 SER C C 7 173.315 173.315 174.465 -1.150 18387 25 1 1 . 1 1 7 7 SER CA C 7 58.915 58.915 58.593 0.323 18387 26 1 1 . 1 1 7 7 SER CB C 7 64.308 64.308 64.252 0.056 18387 27 1 1 . 1 1 7 7 SER H H 7 7.736 7.736 8.076 -0.340 18387 28 1 1 . 1 1 8 8 VAL N N 8 123.708 123.708 124.900 -1.192 18387 29 1 1 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.239 -0.407 18387 30 1 1 . 1 1 8 8 VAL C C 8 176.673 176.673 175.971 0.702 18387 31 1 1 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.193 1.480 18387 32 1 1 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.642 0.580 18387 33 1 1 . 1 1 8 8 VAL H H 8 8.632 8.632 8.439 0.193 18387 34 1 1 . 1 1 9 9 ALA N N 9 133.040 133.040 131.568 1.472 18387 35 1 1 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.757 -0.494 18387 36 1 1 . 1 1 9 9 ALA C C 9 175.404 175.404 174.989 0.415 18387 37 1 1 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.786 1.169 18387 38 1 1 . 1 1 9 9 ALA CB C 9 18.030 18.030 19.229 -1.199 18387 39 1 1 . 1 1 9 9 ALA H H 9 8.448 8.448 8.871 -0.423 18387 40 1 1 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.351 -0.020 18387 41 1 1 . 1 1 10 10 PRO C C 10 175.071 175.071 175.900 -0.829 18387 42 1 1 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.370 0.271 18387 43 1 1 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.234 0.090 18387 44 1 1 . 1 1 11 11 ALA N N 11 124.172 124.172 122.860 1.312 18387 45 1 1 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.446 -0.202 18387 46 1 1 . 1 1 11 11 ALA C C 11 177.688 177.688 177.466 0.222 18387 47 1 1 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.581 2.040 18387 48 1 1 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.965 -0.638 18387 49 1 1 . 1 1 11 11 ALA H H 11 8.221 8.221 8.197 0.024 18387 50 1 1 . 1 1 12 12 ILE N N 12 117.815 117.815 123.488 -5.673 18387 51 1 1 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.282 0.046 18387 52 1 1 . 1 1 12 12 ILE C C 12 175.013 175.013 175.408 -0.395 18387 53 1 1 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.948 1.218 18387 54 1 1 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.904 4.386 18387 55 1 1 . 1 1 12 12 ILE H H 12 7.693 7.693 8.476 -0.783 18387 56 1 1 . 1 1 13 13 THR N N 13 121.186 121.186 123.222 -2.036 18387 57 1 1 . 1 1 13 13 THR HA H 13 4.840 4.840 4.835 0.005 18387 58 1 1 . 1 1 13 13 THR C C 13 172.625 172.625 173.822 -1.197 18387 59 1 1 . 1 1 13 13 THR CA C 13 62.297 62.297 61.974 0.323 18387 60 1 1 . 1 1 13 13 THR CB C 13 71.585 71.585 69.013 2.571 18387 61 1 1 . 1 1 13 13 THR H H 13 8.363 8.363 8.898 -0.535 18387 62 1 1 . 1 1 14 14 GLY N N 14 110.785 110.785 112.656 -1.871 18387 63 1 1 . 1 1 14 14 GLY C C 14 170.040 170.040 172.225 -2.185 18387 64 1 1 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.185 1.205 18387 65 1 1 . 1 1 14 14 GLY H H 14 7.993 7.993 9.228 -1.235 18387 66 1 1 . 1 1 15 15 ILE N N 15 119.088 119.088 124.312 -5.224 18387 67 1 1 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.066 0.059 18387 68 1 1 . 1 1 15 15 ILE C C 15 176.359 176.359 176.352 0.007 18387 69 1 1 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.091 -2.477 18387 70 1 1 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.904 -0.265 18387 71 1 1 . 1 1 15 15 ILE H H 15 7.973 7.973 8.907 -0.934 18387 72 1 1 . 1 1 16 16 ASP N N 16 126.633 126.633 127.172 -0.539 18387 73 1 1 . 1 1 16 16 ASP HA H 16 5.849 5.849 4.996 0.853 18387 74 1 1 . 1 1 16 16 ASP C C 16 179.190 179.190 177.455 1.735 18387 75 1 1 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.239 -0.358 18387 76 1 1 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.790 -0.515 18387 77 1 1 . 1 1 16 16 ASP H H 16 9.335 9.335 8.852 0.483 18387 78 1 1 . 1 1 17 17 LEU N N 17 116.648 116.648 118.149 -1.501 18387 79 1 1 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.171 0.003 18387 80 1 1 . 1 1 17 17 LEU C C 17 178.432 178.432 179.107 -0.675 18387 81 1 1 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.648 0.333 18387 82 1 1 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.781 1.205 18387 83 1 1 . 1 1 17 17 LEU H H 17 8.071 8.071 8.791 -0.720 18387 84 1 1 . 1 1 18 18 LYS N N 18 117.401 117.401 118.243 -0.842 18387 85 1 1 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.219 0.290 18387 86 1 1 . 1 1 18 18 LYS C C 18 176.793 176.793 177.498 -0.705 18387 87 1 1 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.928 -2.493 18387 88 1 1 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.400 -0.337 18387 89 1 1 . 1 1 18 18 LYS H H 18 8.207 8.207 8.817 -0.610 18387 90 1 1 . 1 1 19 19 GLY N N 19 108.061 108.061 106.359 1.702 18387 91 1 1 . 1 1 19 19 GLY C C 19 174.649 174.649 173.842 0.807 18387 92 1 1 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.501 1.097 18387 93 1 1 . 1 1 19 19 GLY H H 19 8.099 8.099 8.469 -0.370 18387 94 1 1 . 1 1 20 20 ASN N N 20 121.012 121.012 120.206 0.806 18387 95 1 1 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.979 -0.074 18387 96 1 1 . 1 1 20 20 ASN C C 20 174.827 174.827 174.699 0.128 18387 97 1 1 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.611 -0.144 18387 98 1 1 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.895 -1.219 18387 99 1 1 . 1 1 20 20 ASN H H 20 8.945 8.945 9.369 -0.424 18387 100 1 1 . 1 1 21 21 SER N N 21 117.285 117.285 117.554 -0.269 18387 101 1 1 . 1 1 21 21 SER HA H 21 5.000 5.000 4.671 0.329 18387 102 1 1 . 1 1 21 21 SER C C 21 174.911 174.911 174.427 0.484 18387 103 1 1 . 1 1 21 21 SER CA C 21 58.730 58.730 58.504 0.226 18387 104 1 1 . 1 1 21 21 SER CB C 21 63.162 63.162 62.863 0.299 18387 105 1 1 . 1 1 21 21 SER H H 21 8.740 8.740 8.688 0.052 18387 106 1 1 . 1 1 22 22 VAL N N 22 128.665 128.665 127.931 0.734 18387 107 1 1 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.312 0.068 18387 108 1 1 . 1 1 22 22 VAL C C 22 176.276 176.276 175.344 0.932 18387 109 1 1 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.700 1.253 18387 110 1 1 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.680 1.902 18387 111 1 1 . 1 1 22 22 VAL H H 22 9.125 9.125 9.108 0.017 18387 112 1 1 . 1 1 23 23 SER N N 23 127.457 127.457 120.546 6.911 18387 113 1 1 . 1 1 23 23 SER HA H 23 5.878 5.878 5.865 0.013 18387 114 1 1 . 1 1 23 23 SER C C 23 174.436 174.436 175.587 -1.151 18387 115 1 1 . 1 1 23 23 SER CA C 23 57.101 57.101 56.416 0.685 18387 116 1 1 . 1 1 23 23 SER CB C 23 66.078 66.078 65.129 0.949 18387 117 1 1 . 1 1 23 23 SER H H 23 8.971 8.971 9.563 -0.592 18387 118 1 1 . 1 1 24 24 LEU N N 24 126.734 126.734 123.210 3.524 18387 119 1 1 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.839 -0.372 18387 120 1 1 . 1 1 24 24 LEU C C 24 179.852 179.852 177.460 2.392 18387 121 1 1 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.337 0.866 18387 122 1 1 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.045 -0.067 18387 123 1 1 . 1 1 24 24 LEU H H 24 8.450 8.450 8.319 0.131 18387 124 1 1 . 1 1 25 25 ASN N N 25 115.642 115.642 114.340 1.302 18387 125 1 1 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.408 -0.166 18387 126 1 1 . 1 1 25 25 ASN C C 25 176.246 176.246 176.084 0.162 18387 127 1 1 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.388 -0.018 18387 128 1 1 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.423 1.348 18387 129 1 1 . 1 1 25 25 ASN H H 25 8.505 8.505 8.688 -0.183 18387 130 1 1 . 1 1 26 26 ASP N N 26 119.722 119.722 121.001 -1.279 18387 131 1 1 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.316 -0.111 18387 132 1 1 . 1 1 26 26 ASP C C 26 176.708 176.708 176.287 0.421 18387 133 1 1 . 1 1 26 26 ASP CA C 26 56.525 56.525 55.898 0.627 18387 134 1 1 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.334 -1.054 18387 135 1 1 . 1 1 26 26 ASP H H 26 7.731 7.731 7.454 0.277 18387 136 1 1 . 1 1 27 27 PHE N N 27 116.827 116.827 116.576 0.251 18387 137 1 1 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.594 -0.114 18387 138 1 1 . 1 1 27 27 PHE C C 27 174.227 174.227 175.257 -1.030 18387 139 1 1 . 1 1 27 27 PHE CA C 27 57.071 57.071 56.414 0.657 18387 140 1 1 . 1 1 27 27 PHE CB C 27 39.719 39.719 38.917 0.802 18387 141 1 1 . 1 1 27 27 PHE H H 27 7.390 7.390 7.318 0.072 18387 142 1 1 . 1 1 28 28 LYS N N 28 120.357 120.357 123.176 -2.819 18387 143 1 1 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.247 0.140 18387 144 1 1 . 1 1 28 28 LYS C C 28 177.845 177.845 176.201 1.644 18387 145 1 1 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.555 1.447 18387 146 1 1 . 1 1 28 28 LYS CB C 28 32.544 32.544 30.495 2.049 18387 147 1 1 . 1 1 28 28 LYS H H 28 6.883 6.883 7.525 -0.642 18387 148 1 1 . 1 1 29 29 GLY N N 29 112.653 112.653 108.036 4.617 18387 149 1 1 . 1 1 29 29 GLY C C 29 173.799 173.799 173.731 0.068 18387 150 1 1 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.136 -0.148 18387 151 1 1 . 1 1 29 29 GLY H H 29 8.930 8.930 8.348 0.582 18387 152 1 1 . 1 1 30 30 LYS N N 30 120.516 120.516 118.043 2.473 18387 153 1 1 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.584 0.051 18387 154 1 1 . 1 1 30 30 LYS C C 30 176.505 176.505 174.606 1.899 18387 155 1 1 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.955 0.225 18387 156 1 1 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.549 -1.692 18387 157 1 1 . 1 1 30 30 LYS H H 30 8.098 8.098 7.336 0.762 18387 158 1 1 . 1 1 31 31 TYR N N 31 117.383 117.383 119.742 -2.359 18387 159 1 1 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.638 0.016 18387 160 1 1 . 1 1 31 31 TYR C C 31 175.551 175.551 175.818 -0.267 18387 161 1 1 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.210 0.955 18387 162 1 1 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.535 2.658 18387 163 1 1 . 1 1 31 31 TYR H H 31 8.263 8.263 8.879 -0.616 18387 164 1 1 . 1 1 32 32 VAL N N 32 120.900 120.900 126.118 -5.218 18387 165 1 1 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.616 -0.177 18387 166 1 1 . 1 1 32 32 VAL C C 32 175.975 175.975 174.985 0.990 18387 167 1 1 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.467 -1.761 18387 168 1 1 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.346 3.161 18387 169 1 1 . 1 1 32 32 VAL H H 32 9.244 9.244 9.213 0.031 18387 170 1 1 . 1 1 33 33 LEU N N 33 130.058 130.058 130.540 -0.482 18387 171 1 1 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.943 0.230 18387 172 1 1 . 1 1 33 33 LEU C C 33 174.693 174.693 175.300 -0.607 18387 173 1 1 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.268 0.080 18387 174 1 1 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.302 2.019 18387 175 1 1 . 1 1 33 33 LEU H H 33 8.161 8.161 8.606 -0.445 18387 176 1 1 . 1 1 34 34 VAL N N 34 129.232 129.232 128.958 0.274 18387 177 1 1 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.485 0.497 18387 178 1 1 . 1 1 34 34 VAL C C 34 174.285 174.285 174.706 -0.421 18387 179 1 1 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.152 0.354 18387 180 1 1 . 1 1 34 34 VAL CB C 34 32.378 32.378 31.212 1.166 18387 181 1 1 . 1 1 34 34 VAL H H 34 9.296 9.296 8.634 0.662 18387 182 1 1 . 1 1 35 35 ASP N N 35 123.675 123.675 128.648 -4.973 18387 183 1 1 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.983 0.366 18387 184 1 1 . 1 1 35 35 ASP C C 35 174.258 174.258 174.789 -0.531 18387 185 1 1 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.301 -1.247 18387 186 1 1 . 1 1 35 35 ASP CB C 35 40.462 40.462 43.597 -3.135 18387 187 1 1 . 1 1 35 35 ASP H H 35 8.015 8.015 8.377 -0.362 18387 188 1 1 . 1 1 36 36 PHE N N 36 126.959 126.959 126.011 0.948 18387 189 1 1 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.350 0.585 18387 190 1 1 . 1 1 36 36 PHE C C 36 175.432 175.432 175.556 -0.124 18387 191 1 1 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.822 0.273 18387 192 1 1 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.154 -0.124 18387 193 1 1 . 1 1 36 36 PHE H H 36 9.171 9.171 8.616 0.555 18387 194 1 1 . 1 1 37 37 TRP N N 37 120.839 120.839 123.513 -2.674 18387 195 1 1 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.170 0.587 18387 196 1 1 . 1 1 37 37 TRP C C 37 172.412 172.412 173.532 -1.120 18387 197 1 1 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.605 0.304 18387 198 1 1 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.889 -0.209 18387 199 1 1 . 1 1 37 37 TRP H H 37 9.280 9.280 9.175 0.105 18387 200 1 1 . 1 1 38 38 PHE N N 38 109.215 109.215 111.752 -2.537 18387 201 1 1 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.663 -0.730 18387 202 1 1 . 1 1 38 38 PHE C C 38 176.141 176.141 175.026 1.115 18387 203 1 1 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.626 0.385 18387 204 1 1 . 1 1 38 38 PHE CB C 38 39.619 39.619 41.084 -1.465 18387 205 1 1 . 1 1 38 38 PHE H H 38 7.062 7.062 7.944 -0.882 18387 206 1 1 . 1 1 39 39 ALA N N 39 125.193 125.193 123.667 1.526 18387 207 1 1 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.300 -0.235 18387 208 1 1 . 1 1 39 39 ALA C C 39 179.349 179.349 178.461 0.888 18387 209 1 1 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.808 1.256 18387 210 1 1 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.908 0.989 18387 211 1 1 . 1 1 39 39 ALA H H 39 10.355 10.355 8.698 1.657 18387 212 1 1 . 1 1 40 40 GLY N N 40 103.437 103.437 104.244 -0.807 18387 213 1 1 . 1 1 40 40 GLY C C 40 172.732 172.732 174.143 -1.411 18387 214 1 1 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.763 0.173 18387 215 1 1 . 1 1 40 40 GLY H H 40 8.583 8.583 8.201 0.382 18387 216 1 1 . 1 1 41 41 CYS N N 41 124.859 124.859 121.095 3.764 18387 217 1 1 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.306 0.098 18387 218 1 1 . 1 1 41 41 CYS C C 41 176.620 176.620 175.509 1.111 18387 219 1 1 . 1 1 41 41 CYS CA C 41 58.375 58.375 58.171 0.204 18387 220 1 1 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.016 0.360 18387 221 1 1 . 1 1 41 41 CYS H H 41 6.946 6.946 7.518 -0.572 18387 222 1 1 . 1 1 42 42 SER HA H 42 4.040 4.040 4.374 -0.334 18387 223 1 1 . 1 1 42 42 SER CA C 42 61.552 61.552 61.485 0.067 18387 224 1 1 . 1 1 42 42 SER CB C 42 62.675 62.675 63.068 -0.393 18387 225 1 1 . 1 1 43 43 TRP N N 43 129.748 129.748 121.160 8.588 18387 226 1 1 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.614 -0.065 18387 227 1 1 . 1 1 43 43 TRP C C 43 180.400 180.400 177.245 3.155 18387 228 1 1 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.624 1.625 18387 229 1 1 . 1 1 43 43 TRP CB C 43 29.592 29.592 30.322 -0.730 18387 230 1 1 . 1 1 44 44 CYS N N 44 124.462 124.462 116.772 7.690 18387 231 1 1 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.046 0.205 18387 232 1 1 . 1 1 44 44 CYS C C 44 178.643 178.643 176.675 1.968 18387 233 1 1 . 1 1 44 44 CYS CA C 44 64.849 64.849 63.654 1.195 18387 234 1 1 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.173 2.249 18387 235 1 1 . 1 1 44 44 CYS H H 44 9.591 9.591 7.925 1.666 18387 236 1 1 . 1 1 45 45 ARG N N 45 117.248 117.248 116.821 0.427 18387 237 1 1 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.350 -0.174 18387 238 1 1 . 1 1 45 45 ARG C C 45 180.302 180.302 177.347 2.955 18387 239 1 1 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.795 -0.852 18387 240 1 1 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.605 -1.974 18387 241 1 1 . 1 1 45 45 ARG H H 45 7.955 7.955 7.902 0.053 18387 242 1 1 . 1 1 46 46 LYS N N 46 120.318 120.318 118.335 1.983 18387 243 1 1 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.105 0.167 18387 244 1 1 . 1 1 46 46 LYS C C 46 177.755 177.755 177.457 0.298 18387 245 1 1 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.656 1.113 18387 246 1 1 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.410 0.748 18387 247 1 1 . 1 1 46 46 LYS H H 46 8.129 8.129 7.604 0.525 18387 248 1 1 . 1 1 47 47 GLU N N 47 114.278 114.278 117.144 -2.866 18387 249 1 1 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.688 0.203 18387 250 1 1 . 1 1 47 47 GLU C C 47 178.701 178.701 177.940 0.761 18387 251 1 1 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.091 -0.537 18387 252 1 1 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.809 -0.043 18387 253 1 1 . 1 1 47 47 GLU H H 47 7.386 7.386 7.377 0.009 18387 254 1 1 . 1 1 48 48 THR N N 48 115.665 115.665 117.676 -2.011 18387 255 1 1 . 1 1 48 48 THR HA H 48 4.048 4.048 4.083 -0.035 18387 256 1 1 . 1 1 48 48 THR C C 48 172.392 172.392 174.316 -1.924 18387 257 1 1 . 1 1 48 48 THR CA C 48 69.426 69.426 69.322 0.104 18387 258 1 1 . 1 1 48 48 THR CB C 48 66.906 66.906 66.338 0.568 18387 259 1 1 . 1 1 48 48 THR H H 48 7.810 7.810 7.645 0.165 18387 260 1 1 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.124 0.165 18387 261 1 1 . 1 1 49 49 PRO C C 49 179.828 179.828 178.380 1.448 18387 262 1 1 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.340 0.259 18387 263 1 1 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.047 -0.013 18387 264 1 1 . 1 1 50 50 TYR N N 50 116.950 116.950 116.270 0.680 18387 265 1 1 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.301 -0.163 18387 266 1 1 . 1 1 50 50 TYR C C 50 179.488 179.488 178.821 0.667 18387 267 1 1 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.033 0.102 18387 268 1 1 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.519 0.782 18387 269 1 1 . 1 1 50 50 TYR H H 50 7.071 7.071 7.035 0.036 18387 270 1 1 . 1 1 51 51 LEU N N 51 123.989 123.989 119.613 4.376 18387 271 1 1 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.800 -0.130 18387 272 1 1 . 1 1 51 51 LEU C C 51 178.072 178.072 178.961 -0.889 18387 273 1 1 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.665 1.011 18387 274 1 1 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.139 1.478 18387 275 1 1 . 1 1 51 51 LEU H H 51 8.243 8.243 8.107 0.136 18387 276 1 1 . 1 1 52 52 LEU N N 52 119.857 119.857 120.625 -0.768 18387 277 1 1 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.373 -0.046 18387 278 1 1 . 1 1 52 52 LEU C C 52 178.704 178.704 178.359 0.345 18387 279 1 1 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.657 -0.082 18387 280 1 1 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.799 0.939 18387 281 1 1 . 1 1 52 52 LEU H H 52 9.085 9.085 8.526 0.559 18387 282 1 1 . 1 1 53 53 LYS N N 53 118.658 118.658 118.637 0.021 18387 283 1 1 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.012 0.097 18387 284 1 1 . 1 1 53 53 LYS C C 53 179.786 179.786 179.054 0.732 18387 285 1 1 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.868 -0.147 18387 286 1 1 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.330 0.829 18387 287 1 1 . 1 1 53 53 LYS H H 53 7.807 7.807 8.073 -0.266 18387 288 1 1 . 1 1 54 54 THR N N 54 116.869 116.869 116.432 0.437 18387 289 1 1 . 1 1 54 54 THR HA H 54 3.965 3.965 4.457 -0.492 18387 290 1 1 . 1 1 54 54 THR C C 54 175.328 175.328 176.817 -1.489 18387 291 1 1 . 1 1 54 54 THR CA C 54 67.683 67.683 67.080 0.603 18387 292 1 1 . 1 1 54 54 THR CB C 54 68.452 68.452 68.838 -0.386 18387 293 1 1 . 1 1 54 54 THR H H 54 7.771 7.771 8.226 -0.455 18387 294 1 1 . 1 1 55 55 TYR N N 55 122.202 122.202 122.943 -0.741 18387 295 1 1 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.272 -0.000 18387 296 1 1 . 1 1 55 55 TYR C C 55 176.809 176.809 177.527 -0.718 18387 297 1 1 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.108 0.629 18387 298 1 1 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.465 0.815 18387 299 1 1 . 1 1 55 55 TYR H H 55 9.145 9.145 8.782 0.363 18387 300 1 1 . 1 1 56 56 ASN N N 56 113.858 113.858 116.558 -2.700 18387 301 1 1 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.371 -0.108 18387 302 1 1 . 1 1 56 56 ASN C C 56 177.427 177.427 176.787 0.640 18387 303 1 1 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.312 -0.382 18387 304 1 1 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.686 -0.732 18387 305 1 1 . 1 1 56 56 ASN H H 56 8.850 8.850 8.112 0.738 18387 306 1 1 . 1 1 57 57 ALA N N 57 118.829 118.829 120.520 -1.691 18387 307 1 1 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.200 -0.136 18387 308 1 1 . 1 1 57 57 ALA C C 57 180.445 180.445 177.970 2.475 18387 309 1 1 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.888 0.463 18387 310 1 1 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.109 0.085 18387 311 1 1 . 1 1 57 57 ALA H H 57 7.436 7.436 7.520 -0.084 18387 312 1 1 . 1 1 58 58 PHE N N 58 112.082 112.082 115.986 -3.904 18387 313 1 1 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.588 0.333 18387 314 1 1 . 1 1 58 58 PHE C C 58 176.999 176.999 176.788 0.211 18387 315 1 1 . 1 1 58 58 PHE CA C 58 58.067 58.067 58.663 -0.596 18387 316 1 1 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.942 0.548 18387 317 1 1 . 1 1 58 58 PHE H H 58 7.480 7.480 7.889 -0.409 18387 318 1 1 . 1 1 59 59 LYS N N 59 120.666 120.666 121.381 -0.715 18387 319 1 1 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.308 0.495 18387 320 1 1 . 1 1 59 59 LYS C C 59 177.157 177.157 177.977 -0.820 18387 321 1 1 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.753 -0.672 18387 322 1 1 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.582 -1.014 18387 323 1 1 . 1 1 59 59 LYS H H 59 8.411 8.411 8.118 0.293 18387 324 1 1 . 1 1 60 60 ASP N N 60 118.908 118.908 118.583 0.325 18387 325 1 1 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.563 0.562 18387 326 1 1 . 1 1 60 60 ASP C C 60 176.889 176.889 178.047 -1.158 18387 327 1 1 . 1 1 60 60 ASP CA C 60 54.649 54.649 56.633 -1.984 18387 328 1 1 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.459 0.253 18387 329 1 1 . 1 1 60 60 ASP H H 60 8.574 8.574 8.586 -0.012 18387 330 1 1 . 1 1 61 61 LYS N N 61 121.021 121.021 118.867 2.154 18387 331 1 1 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.205 0.509 18387 332 1 1 . 1 1 61 61 LYS C C 61 175.968 175.968 177.740 -1.772 18387 333 1 1 . 1 1 61 61 LYS CA C 61 55.137 55.137 57.606 -2.469 18387 334 1 1 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.118 -0.040 18387 335 1 1 . 1 1 61 61 LYS H H 61 8.278 8.278 8.092 0.186 18387 336 1 1 . 1 1 62 62 GLY C C 62 173.837 173.837 172.627 1.210 18387 337 1 1 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.152 1.898 18387 338 1 1 . 1 1 63 63 PHE N N 63 120.476 120.476 120.813 -0.337 18387 339 1 1 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.685 0.348 18387 340 1 1 . 1 1 63 63 PHE C C 63 173.613 173.613 172.765 0.848 18387 341 1 1 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.373 -0.523 18387 342 1 1 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.084 -0.409 18387 343 1 1 . 1 1 63 63 PHE H H 63 7.413 7.413 8.035 -0.622 18387 344 1 1 . 1 1 64 64 THR N N 64 119.903 119.903 120.237 -0.334 18387 345 1 1 . 1 1 64 64 THR HA H 64 4.097 4.097 4.690 -0.593 18387 346 1 1 . 1 1 64 64 THR C C 64 170.397 170.397 172.339 -1.942 18387 347 1 1 . 1 1 64 64 THR CA C 64 60.261 60.261 61.781 -1.520 18387 348 1 1 . 1 1 64 64 THR CB C 64 69.507 69.507 72.234 -2.727 18387 349 1 1 . 1 1 64 64 THR H H 64 7.665 7.665 8.542 -0.877 18387 350 1 1 . 1 1 65 65 ILE N N 65 117.277 117.277 126.737 -9.460 18387 351 1 1 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.139 0.337 18387 352 1 1 . 1 1 65 65 ILE C C 65 173.056 173.056 173.882 -0.826 18387 353 1 1 . 1 1 65 65 ILE CA C 65 59.708 59.708 61.236 -1.528 18387 354 1 1 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.400 1.445 18387 355 1 1 . 1 1 65 65 ILE H H 65 7.321 7.321 9.199 -1.878 18387 356 1 1 . 1 1 66 66 TYR N N 66 131.968 131.968 130.317 1.651 18387 357 1 1 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.002 0.245 18387 358 1 1 . 1 1 66 66 TYR C C 66 174.074 174.074 175.001 -0.927 18387 359 1 1 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.951 -0.986 18387 360 1 1 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.257 1.860 18387 361 1 1 . 1 1 66 66 TYR H H 66 9.038 9.038 9.010 0.028 18387 362 1 1 . 1 1 67 67 GLY N N 67 114.364 114.364 115.888 -1.524 18387 363 1 1 . 1 1 67 67 GLY C C 67 172.461 172.461 172.798 -0.337 18387 364 1 1 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.398 0.602 18387 365 1 1 . 1 1 67 67 GLY H H 67 9.188 9.188 9.144 0.044 18387 366 1 1 . 1 1 68 68 VAL N N 68 126.938 126.938 121.039 5.899 18387 367 1 1 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.833 -0.697 18387 368 1 1 . 1 1 68 68 VAL C C 68 173.822 173.822 174.037 -0.215 18387 369 1 1 . 1 1 68 68 VAL CA C 68 61.498 61.498 60.011 1.487 18387 370 1 1 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.307 1.251 18387 371 1 1 . 1 1 68 68 VAL H H 68 9.309 9.309 9.072 0.237 18387 372 1 1 . 1 1 69 69 SER N N 69 118.813 118.813 121.230 -2.417 18387 373 1 1 . 1 1 69 69 SER HA H 69 5.527 5.527 5.362 0.165 18387 374 1 1 . 1 1 69 69 SER C C 69 175.753 175.753 172.922 2.831 18387 375 1 1 . 1 1 69 69 SER CA C 69 54.407 54.407 56.271 -1.864 18387 376 1 1 . 1 1 69 69 SER CB C 69 63.630 63.630 65.731 -2.101 18387 377 1 1 . 1 1 69 69 SER H H 69 8.124 8.124 8.793 -0.669 18387 378 1 1 . 1 1 70 70 THR N N 70 113.861 113.861 121.210 -7.349 18387 379 1 1 . 1 1 70 70 THR HA H 70 4.381 4.381 4.375 0.006 18387 380 1 1 . 1 1 70 70 THR C C 70 175.001 175.001 173.101 1.900 18387 381 1 1 . 1 1 70 70 THR CA C 70 60.259 60.259 60.715 -0.456 18387 382 1 1 . 1 1 70 70 THR CB C 70 67.291 67.291 68.532 -1.241 18387 383 1 1 . 1 1 70 70 THR H H 70 7.656 7.656 8.506 -0.850 18387 384 1 1 . 1 1 71 71 ASP N N 71 125.133 125.133 122.143 2.990 18387 385 1 1 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.474 -0.404 18387 386 1 1 . 1 1 71 71 ASP C C 71 175.685 175.685 177.683 -1.998 18387 387 1 1 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.499 3.113 18387 388 1 1 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.349 0.020 18387 389 1 1 . 1 1 71 71 ASP H H 71 8.931 8.931 7.931 1.000 18387 390 1 1 . 1 1 72 72 ARG N N 72 118.814 118.814 119.061 -0.247 18387 391 1 1 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.109 0.086 18387 392 1 1 . 1 1 72 72 ARG C C 72 177.300 177.300 176.789 0.511 18387 393 1 1 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.996 -1.187 18387 394 1 1 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.014 1.097 18387 395 1 1 . 1 1 72 72 ARG H H 72 8.057 8.057 8.542 -0.485 18387 396 1 1 . 1 1 73 73 ARG N N 73 118.174 118.174 116.920 1.254 18387 397 1 1 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.646 0.108 18387 398 1 1 . 1 1 73 73 ARG C C 73 176.503 176.503 176.116 0.387 18387 399 1 1 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.438 0.098 18387 400 1 1 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.381 -2.353 18387 401 1 1 . 1 1 73 73 ARG H H 73 8.639 8.639 7.427 1.212 18387 402 1 1 . 1 1 74 74 GLU N N 74 127.609 127.609 122.577 5.032 18387 403 1 1 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.250 -0.171 18387 404 1 1 . 1 1 74 74 GLU C C 74 178.107 178.107 178.123 -0.016 18387 405 1 1 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.820 -0.035 18387 406 1 1 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.927 0.171 18387 407 1 1 . 1 1 74 74 GLU H H 74 9.129 9.129 8.890 0.239 18387 408 1 1 . 1 1 75 75 GLU N N 75 117.874 117.874 119.586 -1.712 18387 409 1 1 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.111 -0.011 18387 410 1 1 . 1 1 75 75 GLU C C 75 178.993 178.993 178.711 0.282 18387 411 1 1 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.010 0.117 18387 412 1 1 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.955 0.336 18387 413 1 1 . 1 1 75 75 GLU H H 75 9.745 9.745 8.883 0.862 18387 414 1 1 . 1 1 76 76 ASP N N 76 119.182 119.182 119.194 -0.012 18387 415 1 1 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.530 -0.164 18387 416 1 1 . 1 1 76 76 ASP C C 76 178.107 178.107 178.040 0.067 18387 417 1 1 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.759 -0.786 18387 418 1 1 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.589 -0.069 18387 419 1 1 . 1 1 76 76 ASP H H 76 7.004 7.004 8.502 -1.498 18387 420 1 1 . 1 1 77 77 TRP N N 77 123.008 123.008 123.525 -0.517 18387 421 1 1 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.221 -0.072 18387 422 1 1 . 1 1 77 77 TRP C C 77 176.236 176.236 177.737 -1.501 18387 423 1 1 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.283 -0.800 18387 424 1 1 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.204 -0.669 18387 425 1 1 . 1 1 77 77 TRP H H 77 7.112 7.112 7.971 -0.859 18387 426 1 1 . 1 1 78 78 LYS N N 78 115.727 115.727 118.529 -2.802 18387 427 1 1 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.421 -0.176 18387 428 1 1 . 1 1 78 78 LYS C C 78 179.426 179.426 178.801 0.625 18387 429 1 1 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.333 1.099 18387 430 1 1 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.830 0.915 18387 431 1 1 . 1 1 78 78 LYS H H 78 8.431 8.431 8.488 -0.057 18387 432 1 1 . 1 1 79 79 LYS N N 79 118.321 118.321 119.648 -1.327 18387 433 1 1 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.940 0.080 18387 434 1 1 . 1 1 79 79 LYS C C 79 178.239 178.239 178.553 -0.314 18387 435 1 1 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.412 -0.345 18387 436 1 1 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.495 -0.032 18387 437 1 1 . 1 1 79 79 LYS H H 79 7.690 7.690 8.052 -0.362 18387 438 1 1 . 1 1 80 80 ALA N N 80 120.679 120.679 122.062 -1.383 18387 439 1 1 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.350 -0.195 18387 440 1 1 . 1 1 80 80 ALA C C 80 178.811 178.811 179.933 -1.122 18387 441 1 1 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.971 0.116 18387 442 1 1 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.478 0.280 18387 443 1 1 . 1 1 80 80 ALA H H 80 7.560 7.560 8.211 -0.651 18387 444 1 1 . 1 1 81 81 ILE N N 81 118.019 118.019 118.964 -0.945 18387 445 1 1 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.589 -0.187 18387 446 1 1 . 1 1 81 81 ILE C C 81 178.113 178.113 178.347 -0.234 18387 447 1 1 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.483 0.037 18387 448 1 1 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.583 0.621 18387 449 1 1 . 1 1 81 81 ILE H H 81 7.514 7.514 7.870 -0.356 18387 450 1 1 . 1 1 82 82 GLU N N 82 117.252 117.252 119.948 -2.696 18387 451 1 1 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.970 0.124 18387 452 1 1 . 1 1 82 82 GLU C C 82 179.558 179.558 178.230 1.328 18387 453 1 1 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.708 -0.128 18387 454 1 1 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.334 0.049 18387 455 1 1 . 1 1 82 82 GLU H H 82 7.401 7.401 7.584 -0.183 18387 456 1 1 . 1 1 83 83 GLU N N 83 119.340 119.340 119.136 0.204 18387 457 1 1 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.018 -0.120 18387 458 1 1 . 1 1 83 83 GLU C C 83 178.740 178.740 178.569 0.171 18387 459 1 1 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.682 0.317 18387 460 1 1 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.972 -0.052 18387 461 1 1 . 1 1 83 83 GLU H H 83 8.191 8.191 8.061 0.130 18387 462 1 1 . 1 1 84 84 ASP N N 84 118.449 118.449 115.624 2.825 18387 463 1 1 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.403 -0.129 18387 464 1 1 . 1 1 84 84 ASP C C 84 175.597 175.597 175.824 -0.227 18387 465 1 1 . 1 1 84 84 ASP CA C 84 55.047 55.047 55.559 -0.512 18387 466 1 1 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.168 -1.272 18387 467 1 1 . 1 1 84 84 ASP H H 84 8.252 8.252 8.175 0.077 18387 468 1 1 . 1 1 85 85 LYS N N 85 116.410 116.410 115.721 0.689 18387 469 1 1 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.426 -0.253 18387 470 1 1 . 1 1 85 85 LYS C C 85 176.856 176.856 175.049 1.807 18387 471 1 1 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.297 -0.325 18387 472 1 1 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.218 -0.350 18387 473 1 1 . 1 1 85 85 LYS H H 85 7.890 7.890 7.614 0.276 18387 474 1 1 . 1 1 86 86 SER N N 86 112.295 112.295 113.597 -1.302 18387 475 1 1 . 1 1 86 86 SER HA H 86 3.139 3.139 3.749 -0.610 18387 476 1 1 . 1 1 86 86 SER C C 86 175.805 175.805 173.101 2.704 18387 477 1 1 . 1 1 86 86 SER CA C 86 53.637 53.637 56.968 -3.331 18387 478 1 1 . 1 1 86 86 SER CB C 86 60.736 60.736 61.258 -0.522 18387 479 1 1 . 1 1 86 86 SER H H 86 7.327 7.327 7.160 0.167 18387 480 1 1 . 1 1 87 87 TYR N N 87 120.962 120.962 126.079 -5.117 18387 481 1 1 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.180 0.125 18387 482 1 1 . 1 1 87 87 TYR C C 87 177.064 177.064 174.346 2.718 18387 483 1 1 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.927 -0.704 18387 484 1 1 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.682 -0.329 18387 485 1 1 . 1 1 87 87 TYR H H 87 6.933 6.933 7.583 -0.650 18387 486 1 1 . 1 1 88 88 TRP N N 88 118.597 118.597 121.443 -2.846 18387 487 1 1 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.338 0.513 18387 488 1 1 . 1 1 88 88 TRP C C 88 175.456 175.456 174.545 0.911 18387 489 1 1 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.993 1.243 18387 490 1 1 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.098 -3.371 18387 491 1 1 . 1 1 88 88 TRP H H 88 6.552 6.552 7.306 -0.754 18387 492 1 1 . 1 1 89 89 ASN N N 89 118.067 118.067 120.368 -2.301 18387 493 1 1 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.735 0.314 18387 494 1 1 . 1 1 89 89 ASN C C 89 173.773 173.773 174.745 -0.972 18387 495 1 1 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.777 1.679 18387 496 1 1 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.312 1.885 18387 497 1 1 . 1 1 89 89 ASN H H 89 7.864 7.864 8.393 -0.529 18387 498 1 1 . 1 1 90 90 GLN N N 90 125.392 125.392 121.583 3.809 18387 499 1 1 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.172 0.325 18387 500 1 1 . 1 1 90 90 GLN C C 90 176.491 176.491 175.866 0.625 18387 501 1 1 . 1 1 90 90 GLN CA C 90 55.460 55.460 55.248 0.211 18387 502 1 1 . 1 1 90 90 GLN CB C 90 31.227 31.227 30.293 0.934 18387 503 1 1 . 1 1 90 90 GLN H H 90 7.904 7.904 8.129 -0.225 18387 504 1 1 . 1 1 91 91 VAL N N 91 114.434 114.434 118.228 -3.794 18387 505 1 1 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.876 0.604 18387 506 1 1 . 1 1 91 91 VAL C C 91 174.248 174.248 173.334 0.914 18387 507 1 1 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.735 -0.729 18387 508 1 1 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.034 1.604 18387 509 1 1 . 1 1 91 91 VAL H H 91 9.585 9.585 9.187 0.398 18387 510 1 1 . 1 1 92 92 LEU N N 92 126.910 126.910 125.940 0.970 18387 511 1 1 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.319 -0.250 18387 512 1 1 . 1 1 92 92 LEU C C 92 177.696 177.696 175.910 1.786 18387 513 1 1 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.112 0.732 18387 514 1 1 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.115 0.832 18387 515 1 1 . 1 1 92 92 LEU H H 92 8.941 8.941 8.420 0.521 18387 516 1 1 . 1 1 93 93 LEU N N 93 125.673 125.673 129.176 -3.503 18387 517 1 1 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.208 0.192 18387 518 1 1 . 1 1 93 93 LEU C C 93 177.291 177.291 176.884 0.407 18387 519 1 1 . 1 1 93 93 LEU CA C 93 54.951 54.951 54.845 0.106 18387 520 1 1 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.382 1.797 18387 521 1 1 . 1 1 93 93 LEU H H 93 8.038 8.038 8.938 -0.900 18387 522 1 1 . 1 1 94 94 GLN N N 94 122.206 122.206 125.792 -3.586 18387 523 1 1 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.058 0.179 18387 524 1 1 . 1 1 94 94 GLN C C 94 178.246 178.246 176.336 1.910 18387 525 1 1 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.670 -0.895 18387 526 1 1 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.169 0.086 18387 527 1 1 . 1 1 94 94 GLN H H 94 9.298 9.298 8.149 1.149 18387 528 1 1 . 1 1 95 95 LYS N N 95 122.668 122.668 123.228 -0.560 18387 529 1 1 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.045 -0.079 18387 530 1 1 . 1 1 95 95 LYS C C 95 178.787 178.787 177.899 0.888 18387 531 1 1 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.918 1.154 18387 532 1 1 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.096 0.369 18387 533 1 1 . 1 1 95 95 LYS H H 95 8.645 8.645 8.799 -0.154 18387 534 1 1 . 1 1 96 96 ASP N N 96 116.775 116.775 118.666 -1.891 18387 535 1 1 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.573 0.007 18387 536 1 1 . 1 1 96 96 ASP C C 96 176.220 176.220 177.944 -1.724 18387 537 1 1 . 1 1 96 96 ASP CA C 96 56.346 56.346 57.194 -0.848 18387 538 1 1 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.375 0.182 18387 539 1 1 . 1 1 96 96 ASP H H 96 8.606 8.606 8.235 0.371 18387 540 1 1 . 1 1 97 97 ASP N N 97 118.213 118.213 121.201 -2.988 18387 541 1 1 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.397 0.530 18387 542 1 1 . 1 1 97 97 ASP C C 97 176.954 176.954 178.082 -1.128 18387 543 1 1 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.090 -1.731 18387 544 1 1 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.742 1.582 18387 545 1 1 . 1 1 97 97 ASP H H 97 7.988 7.988 8.205 -0.217 18387 546 1 1 . 1 1 98 98 VAL N N 98 118.907 118.907 119.436 -0.529 18387 547 1 1 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.545 -0.129 18387 548 1 1 . 1 1 98 98 VAL C C 98 176.470 176.470 177.857 -1.387 18387 549 1 1 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.860 0.918 18387 550 1 1 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.556 0.835 18387 551 1 1 . 1 1 98 98 VAL H H 98 7.098 7.098 8.543 -1.445 18387 552 1 1 . 1 1 99 99 LYS N N 99 117.909 117.909 118.936 -1.027 18387 553 1 1 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.891 0.052 18387 554 1 1 . 1 1 99 99 LYS C C 99 178.762 178.762 178.658 0.104 18387 555 1 1 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.877 0.268 18387 556 1 1 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.886 0.126 18387 557 1 1 . 1 1 99 99 LYS H H 99 8.304 8.304 7.411 0.893 18387 558 1 1 . 1 1 100 100 ASP N N 100 117.843 117.843 119.544 -1.701 18387 559 1 1 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.377 0.101 18387 560 1 1 . 1 1 100 100 ASP C C 100 179.694 179.694 178.453 1.241 18387 561 1 1 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.130 0.396 18387 562 1 1 . 1 1 100 100 ASP CB C 100 40.828 40.828 41.092 -0.264 18387 563 1 1 . 1 1 100 100 ASP H H 100 8.024 8.024 7.468 0.556 18387 564 1 1 . 1 1 101 101 VAL N N 101 122.202 122.202 120.253 1.949 18387 565 1 1 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.678 0.317 18387 566 1 1 . 1 1 101 101 VAL C C 101 178.533 178.533 178.407 0.126 18387 567 1 1 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.718 0.284 18387 568 1 1 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.584 0.453 18387 569 1 1 . 1 1 101 101 VAL H H 101 8.205 8.205 8.329 -0.124 18387 570 1 1 . 1 1 102 102 LEU N N 102 118.798 118.798 119.318 -0.520 18387 571 1 1 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.853 -0.073 18387 572 1 1 . 1 1 102 102 LEU C C 102 180.254 180.254 178.853 1.401 18387 573 1 1 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.258 0.683 18387 574 1 1 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.490 -1.051 18387 575 1 1 . 1 1 102 102 LEU H H 102 8.422 8.422 8.416 0.006 18387 576 1 1 . 1 1 103 103 GLU N N 103 116.915 116.915 120.164 -3.249 18387 577 1 1 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.899 0.236 18387 578 1 1 . 1 1 103 103 GLU C C 103 180.910 180.910 179.551 1.359 18387 579 1 1 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.431 -0.028 18387 580 1 1 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.650 0.081 18387 581 1 1 . 1 1 103 103 GLU H H 103 8.262 8.262 7.955 0.307 18387 582 1 1 . 1 1 104 104 SER N N 104 117.866 117.866 116.117 1.749 18387 583 1 1 . 1 1 104 104 SER HA H 104 4.216 4.216 4.133 0.083 18387 584 1 1 . 1 1 104 104 SER C C 104 175.455 175.455 176.291 -0.836 18387 585 1 1 . 1 1 104 104 SER CA C 104 62.019 62.019 61.437 0.582 18387 586 1 1 . 1 1 104 104 SER CB C 104 62.891 62.891 63.090 -0.199 18387 587 1 1 . 1 1 104 104 SER H H 104 8.544 8.544 8.215 0.329 18387 588 1 1 . 1 1 105 105 TYR N N 105 117.278 117.278 118.362 -1.084 18387 589 1 1 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.412 -0.140 18387 590 1 1 . 1 1 105 105 TYR C C 105 174.750 174.750 175.596 -0.846 18387 591 1 1 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.642 1.218 18387 592 1 1 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.921 1.790 18387 593 1 1 . 1 1 105 105 TYR H H 105 7.691 7.691 7.695 -0.004 18387 594 1 1 . 1 1 106 106 CYS N N 106 116.897 116.897 118.218 -1.321 18387 595 1 1 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.057 -0.162 18387 596 1 1 . 1 1 106 106 CYS C C 106 174.056 174.056 173.298 0.758 18387 597 1 1 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.125 -0.515 18387 598 1 1 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.604 -0.572 18387 599 1 1 . 1 1 106 106 CYS H H 106 7.862 7.862 8.245 -0.383 18387 600 1 1 . 1 1 107 107 ILE N N 107 118.885 118.885 121.915 -3.030 18387 601 1 1 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.017 -0.678 18387 602 1 1 . 1 1 107 107 ILE C C 107 176.793 176.793 175.144 1.649 18387 603 1 1 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.214 2.531 18387 604 1 1 . 1 1 107 107 ILE CB C 107 38.079 38.079 36.417 1.662 18387 605 1 1 . 1 1 107 107 ILE H H 107 7.707 7.707 7.976 -0.269 18387 606 1 1 . 1 1 108 108 VAL N N 108 123.983 123.983 121.011 2.972 18387 607 1 1 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.310 -0.036 18387 608 1 1 . 1 1 108 108 VAL C C 108 175.476 175.476 174.942 0.534 18387 609 1 1 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.683 -0.059 18387 610 1 1 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.597 0.411 18387 611 1 1 . 1 1 108 108 VAL H H 108 8.656 8.656 8.272 0.384 18387 612 1 1 . 1 1 109 109 GLY N N 109 110.120 110.120 108.103 2.017 18387 613 1 1 . 1 1 109 109 GLY C C 109 169.982 169.982 172.221 -2.239 18387 614 1 1 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.117 -0.514 18387 615 1 1 . 1 1 109 109 GLY H H 109 7.500 7.500 7.371 0.129 18387 616 1 1 . 1 1 110 110 PHE N N 110 115.276 115.276 118.162 -2.886 18387 617 1 1 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.089 -0.315 18387 618 1 1 . 1 1 110 110 PHE C C 110 174.361 174.361 174.289 0.072 18387 619 1 1 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.975 -0.288 18387 620 1 1 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.570 1.381 18387 621 1 1 . 1 1 110 110 PHE H H 110 8.203 8.203 8.309 -0.106 18387 622 1 1 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.137 0.222 18387 623 1 1 . 1 1 111 111 PRO C C 111 175.691 175.691 175.515 0.176 18387 624 1 1 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.681 0.476 18387 625 1 1 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.745 1.559 18387 626 1 1 . 1 1 112 112 HIS N N 112 123.708 123.708 117.148 6.560 18387 627 1 1 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.854 0.109 18387 628 1 1 . 1 1 112 112 HIS C C 112 173.649 173.649 173.171 0.478 18387 629 1 1 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.264 0.810 18387 630 1 1 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.633 -0.436 18387 631 1 1 . 1 1 112 112 HIS H H 112 8.952 8.952 8.574 0.378 18387 632 1 1 . 1 1 113 113 ILE N N 113 128.596 128.596 126.121 2.475 18387 633 1 1 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.984 0.713 18387 634 1 1 . 1 1 113 113 ILE C C 113 176.130 176.130 174.059 2.071 18387 635 1 1 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.032 0.963 18387 636 1 1 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.831 -2.776 18387 637 1 1 . 1 1 113 113 ILE H H 113 8.808 8.808 8.524 0.284 18387 638 1 1 . 1 1 114 114 ILE N N 114 119.668 119.668 121.223 -1.555 18387 639 1 1 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.727 0.246 18387 640 1 1 . 1 1 114 114 ILE C C 114 173.186 173.186 173.356 -0.170 18387 641 1 1 . 1 1 114 114 ILE CA C 114 58.730 58.730 59.107 -0.377 18387 642 1 1 . 1 1 114 114 ILE CB C 114 42.540 42.540 41.872 0.668 18387 643 1 1 . 1 1 114 114 ILE H H 114 8.721 8.721 8.672 0.049 18387 644 1 1 . 1 1 115 115 LEU N N 115 122.770 122.770 125.694 -2.924 18387 645 1 1 . 1 1 115 115 LEU HA H 115 5.275 5.275 4.777 0.498 18387 646 1 1 . 1 1 115 115 LEU C C 115 173.601 173.601 174.830 -1.229 18387 647 1 1 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.615 0.167 18387 648 1 1 . 1 1 115 115 LEU CB C 115 46.134 46.134 43.799 2.335 18387 649 1 1 . 1 1 115 115 LEU H H 115 8.665 8.665 8.913 -0.248 18387 650 1 1 . 1 1 116 116 VAL N N 116 130.411 130.411 127.285 3.126 18387 651 1 1 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.975 -0.117 18387 652 1 1 . 1 1 116 116 VAL C C 116 174.565 174.565 175.425 -0.860 18387 653 1 1 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.726 0.078 18387 654 1 1 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.944 -0.029 18387 655 1 1 . 1 1 116 116 VAL H H 116 9.472 9.472 9.091 0.381 18387 656 1 1 . 1 1 117 117 ASP N N 117 127.896 127.896 126.364 1.532 18387 657 1 1 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.756 -0.364 18387 658 1 1 . 1 1 117 117 ASP C C 117 176.567 176.567 176.083 0.484 18387 659 1 1 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.651 0.949 18387 660 1 1 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.939 -0.355 18387 661 1 1 . 1 1 117 117 ASP H H 117 9.429 9.429 8.833 0.596 18387 662 1 1 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.310 -0.116 18387 663 1 1 . 1 1 118 118 PRO C C 118 177.534 177.534 177.507 0.027 18387 664 1 1 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.744 0.421 18387 665 1 1 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.567 1.246 18387 666 1 1 . 1 1 119 119 GLU N N 119 114.015 114.015 117.140 -3.125 18387 667 1 1 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.328 0.011 18387 668 1 1 . 1 1 119 119 GLU C C 119 176.722 176.722 176.715 0.007 18387 669 1 1 . 1 1 119 119 GLU CA C 119 55.639 55.639 55.762 -0.123 18387 670 1 1 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.952 0.625 18387 671 1 1 . 1 1 119 119 GLU H H 119 7.733 7.733 8.742 -1.009 18387 672 1 1 . 1 1 120 120 GLY N N 120 108.218 108.218 108.549 -0.331 18387 673 1 1 . 1 1 120 120 GLY C C 120 174.110 174.110 173.487 0.623 18387 674 1 1 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.732 -0.336 18387 675 1 1 . 1 1 120 120 GLY H H 120 8.588 8.588 8.326 0.262 18387 676 1 1 . 1 1 121 121 LYS N N 121 121.778 121.778 119.097 2.681 18387 677 1 1 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.107 -0.248 18387 678 1 1 . 1 1 121 121 LYS C C 121 176.458 176.458 175.927 0.531 18387 679 1 1 . 1 1 121 121 LYS CA C 121 54.962 54.962 53.977 0.985 18387 680 1 1 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.175 -1.723 18387 681 1 1 . 1 1 121 121 LYS H H 121 8.600 8.600 8.538 0.062 18387 682 1 1 . 1 1 122 122 ILE N N 122 122.058 122.058 125.899 -3.841 18387 683 1 1 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.259 0.013 18387 684 1 1 . 1 1 122 122 ILE C C 122 177.084 177.084 176.785 0.299 18387 685 1 1 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.648 0.171 18387 686 1 1 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.437 2.211 18387 687 1 1 . 1 1 122 122 ILE H H 122 9.006 9.006 9.140 -0.134 18387 688 1 1 . 1 1 123 123 VAL N N 123 120.561 120.561 130.389 -9.828 18387 689 1 1 . 1 1 123 123 VAL HA H 123 4.755 4.755 3.861 0.894 18387 690 1 1 . 1 1 123 123 VAL C C 123 175.584 175.584 175.761 -0.177 18387 691 1 1 . 1 1 123 123 VAL CA C 123 61.151 61.151 65.309 -4.158 18387 692 1 1 . 1 1 123 123 VAL CB C 123 33.401 33.401 31.975 1.426 18387 693 1 1 . 1 1 123 123 VAL H H 123 9.054 9.054 8.651 0.403 18387 694 1 1 . 1 1 124 124 ALA N N 124 121.102 121.102 118.281 2.821 18387 695 1 1 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.640 0.017 18387 696 1 1 . 1 1 124 124 ALA C C 124 174.832 174.832 174.702 0.130 18387 697 1 1 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.526 0.934 18387 698 1 1 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.120 1.710 18387 699 1 1 . 1 1 124 124 ALA H H 124 7.793 7.793 7.536 0.257 18387 700 1 1 . 1 1 125 125 LYS N N 125 117.637 117.637 117.861 -0.224 18387 701 1 1 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.671 0.362 18387 702 1 1 . 1 1 125 125 LYS C C 125 173.417 173.417 175.555 -2.138 18387 703 1 1 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.556 -0.415 18387 704 1 1 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.277 1.374 18387 705 1 1 . 1 1 125 125 LYS H H 125 8.872 8.872 8.170 0.702 18387 706 1 1 . 1 1 126 126 GLU N N 126 115.236 115.236 114.858 0.378 18387 707 1 1 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.869 0.129 18387 708 1 1 . 1 1 126 126 GLU C C 126 175.998 175.998 176.178 -0.180 18387 709 1 1 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.328 -0.366 18387 710 1 1 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.668 -1.233 18387 711 1 1 . 1 1 126 126 GLU H H 126 7.941 7.941 8.516 -0.575 18387 712 1 1 . 1 1 127 127 LEU N N 127 118.584 118.584 119.291 -0.707 18387 713 1 1 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.073 0.309 18387 714 1 1 . 1 1 127 127 LEU C C 127 176.766 176.766 176.817 -0.051 18387 715 1 1 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.733 -1.123 18387 716 1 1 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.071 1.892 18387 717 1 1 . 1 1 127 127 LEU H H 127 7.300 7.300 7.734 -0.434 18387 718 1 1 . 1 1 128 128 ARG N N 128 118.625 118.625 121.967 -3.342 18387 719 1 1 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.576 -0.101 18387 720 1 1 . 1 1 128 128 ARG C C 128 177.113 177.113 176.882 0.231 18387 721 1 1 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.852 -0.463 18387 722 1 1 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.813 1.798 18387 723 1 1 . 1 1 128 128 ARG H H 128 7.929 7.929 8.099 -0.170 18387 724 1 1 . 1 1 129 129 GLY N N 129 114.010 114.010 111.873 2.137 18387 725 1 1 . 1 1 129 129 GLY C C 129 175.931 175.931 174.609 1.322 18387 726 1 1 . 1 1 129 129 GLY CA C 129 45.461 45.461 45.921 -0.460 18387 727 1 1 . 1 1 129 129 GLY H H 129 10.649 10.649 9.426 1.223 18387 728 1 1 . 1 1 130 130 ASP N N 130 123.975 123.975 122.882 1.093 18387 729 1 1 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.387 0.145 18387 730 1 1 . 1 1 130 130 ASP C C 130 177.507 177.507 177.346 0.161 18387 731 1 1 . 1 1 130 130 ASP CA C 130 57.372 57.372 55.944 1.428 18387 732 1 1 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.496 0.407 18387 733 1 1 . 1 1 130 130 ASP H H 130 8.540 8.540 8.100 0.440 18387 734 1 1 . 1 1 131 131 ASP N N 131 116.806 116.806 121.316 -4.510 18387 735 1 1 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.393 0.177 18387 736 1 1 . 1 1 131 131 ASP C C 131 179.038 179.038 178.222 0.816 18387 737 1 1 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.276 -0.292 18387 738 1 1 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.807 0.127 18387 739 1 1 . 1 1 131 131 ASP H H 131 7.907 7.907 8.065 -0.158 18387 740 1 1 . 1 1 132 132 LEU N N 132 123.869 123.869 118.436 5.433 18387 741 1 1 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.013 -0.222 18387 742 1 1 . 1 1 132 132 LEU C C 132 176.343 176.343 178.415 -2.072 18387 743 1 1 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.613 1.171 18387 744 1 1 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.623 1.145 18387 745 1 1 . 1 1 132 132 LEU H H 132 7.542 7.542 7.481 0.061 18387 746 1 1 . 1 1 133 133 TYR N N 133 120.042 120.042 119.799 0.243 18387 747 1 1 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.039 -0.043 18387 748 1 1 . 1 1 133 133 TYR C C 133 177.426 177.426 177.392 0.034 18387 749 1 1 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.983 0.151 18387 750 1 1 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.565 0.011 18387 751 1 1 . 1 1 133 133 TYR H H 133 7.384 7.384 7.419 -0.035 18387 752 1 1 . 1 1 134 134 ASN N N 134 114.936 114.936 117.058 -2.122 18387 753 1 1 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.551 -0.148 18387 754 1 1 . 1 1 134 134 ASN C C 134 178.703 178.703 178.083 0.620 18387 755 1 1 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.811 -1.002 18387 756 1 1 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.465 -0.258 18387 757 1 1 . 1 1 134 134 ASN H H 134 8.399 8.399 8.651 -0.252 18387 758 1 1 . 1 1 135 135 THR N N 135 117.387 117.387 116.928 0.459 18387 759 1 1 . 1 1 135 135 THR HA H 135 3.920 3.920 4.162 -0.242 18387 760 1 1 . 1 1 135 135 THR C C 135 175.323 175.323 176.112 -0.789 18387 761 1 1 . 1 1 135 135 THR CA C 135 67.402 67.402 66.573 0.829 18387 762 1 1 . 1 1 135 135 THR CB C 135 68.111 68.111 68.676 -0.565 18387 763 1 1 . 1 1 135 135 THR H H 135 8.265 8.265 8.617 -0.352 18387 764 1 1 . 1 1 136 136 VAL N N 136 121.207 121.207 121.079 0.128 18387 765 1 1 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.334 -0.319 18387 766 1 1 . 1 1 136 136 VAL C C 136 176.457 176.457 177.546 -1.089 18387 767 1 1 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.099 2.173 18387 768 1 1 . 1 1 136 136 VAL CB C 136 30.941 30.941 29.808 1.133 18387 769 1 1 . 1 1 136 136 VAL H H 136 7.595 7.595 7.380 0.214 18387 770 1 1 . 1 1 137 137 GLU N N 137 118.266 118.266 119.938 -1.672 18387 771 1 1 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.143 -1.461 18387 772 1 1 . 1 1 137 137 GLU C C 137 177.482 177.482 179.278 -1.796 18387 773 1 1 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.352 0.578 18387 774 1 1 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.345 0.437 18387 775 1 1 . 1 1 137 137 GLU H H 137 8.114 8.114 8.214 -0.100 18387 776 1 1 . 1 1 138 138 LYS N N 138 116.431 116.431 119.747 -3.316 18387 777 1 1 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.886 -0.118 18387 778 1 1 . 1 1 138 138 LYS C C 138 179.193 179.193 178.676 0.517 18387 779 1 1 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.427 -0.387 18387 780 1 1 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.383 -0.224 18387 781 1 1 . 1 1 138 138 LYS H H 138 7.133 7.133 8.187 -1.054 18387 782 1 1 . 1 1 139 139 PHE N N 139 116.336 116.336 116.709 -0.373 18387 783 1 1 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.243 -0.233 18387 784 1 1 . 1 1 139 139 PHE C C 139 177.855 177.855 178.292 -0.437 18387 785 1 1 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.934 0.450 18387 786 1 1 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.083 0.269 18387 787 1 1 . 1 1 139 139 PHE H H 139 7.338 7.338 7.755 -0.417 18387 788 1 1 . 1 1 140 140 VAL N N 140 116.491 116.491 117.576 -1.085 18387 789 1 1 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.728 -0.204 18387 790 1 1 . 1 1 140 140 VAL C C 140 177.747 177.747 177.255 0.492 18387 791 1 1 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.163 0.079 18387 792 1 1 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.507 -0.117 18387 793 1 1 . 1 1 140 140 VAL H H 140 8.332 8.332 8.492 -0.160 18387 794 1 1 . 1 1 141 141 ASN N N 141 116.956 116.956 118.138 -1.182 18387 795 1 1 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.547 0.279 18387 796 1 1 . 1 1 141 141 ASN C C 141 176.997 176.997 175.949 1.048 18387 797 1 1 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.416 -1.738 18387 798 1 1 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.089 -0.641 18387 799 1 1 . 1 1 141 141 ASN H H 141 7.862 7.862 7.756 0.106 18387 800 1 1 . 1 1 142 142 GLY N N 142 107.938 107.938 104.589 3.349 18387 801 1 1 . 1 1 142 142 GLY C C 142 174.336 174.336 172.531 1.805 18387 802 1 1 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.196 0.789 18387 803 1 1 . 1 1 142 142 GLY H H 142 7.466 7.466 7.726 -0.260 18387 804 1 1 . 1 1 143 143 ALA N N 143 123.441 123.441 120.585 2.856 18387 805 1 1 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.078 0.263 18387 806 1 1 . 1 1 143 143 ALA C C 143 178.212 178.212 177.153 1.059 18387 807 1 1 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.419 -0.593 18387 808 1 1 . 1 1 143 143 ALA CB C 143 19.244 19.244 17.949 1.295 18387 809 1 1 . 1 1 143 143 ALA H H 143 7.950 7.950 8.721 -0.771 18387 810 1 1 . 1 1 144 144 LYS N N 144 120.149 120.149 116.815 3.334 18387 811 1 1 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.457 -0.162 18387 812 1 1 . 1 1 144 144 LYS C C 144 176.945 176.945 176.468 0.477 18387 813 1 1 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.252 0.267 18387 814 1 1 . 1 1 144 144 LYS CB C 144 33.030 33.030 33.115 -0.085 18387 815 1 1 . 1 1 144 144 LYS H H 144 8.187 8.187 8.215 -0.028 18387 816 1 1 . 1 1 145 145 GLU N N 145 120.992 120.992 119.719 1.273 18387 817 1 1 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.300 -0.005 18387 818 1 1 . 1 1 145 145 GLU C C 145 177.116 177.116 177.805 -0.689 18387 819 1 1 . 1 1 145 145 GLU CA C 145 56.903 56.903 57.175 -0.272 18387 820 1 1 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.376 0.866 18387 821 1 1 . 1 1 145 145 GLU H H 145 8.363 8.363 8.282 0.081 18387 822 1 1 . 1 1 146 146 GLY N N 146 109.467 109.467 106.304 3.163 18387 823 1 1 . 1 1 146 146 GLY C C 146 174.108 174.108 172.949 1.159 18387 824 1 1 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.148 0.254 18387 825 1 1 . 1 1 146 146 GLY H H 146 8.371 8.371 8.295 0.076 18387 826 1 1 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.571 0.038 18387 827 1 1 . 1 1 151 151 HIS C C 151 174.258 174.258 174.189 0.069 18387 828 1 1 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.537 -0.372 18387 829 1 1 . 1 1 151 151 HIS CB C 151 30.833 30.833 31.772 -0.939 18387 830 1 2 . 1 1 2 2 SER HA H 2 3.992 3.992 4.834 -0.842 18387 831 1 2 . 1 1 2 2 SER CA C 2 57.555 57.555 57.403 0.152 18387 832 1 2 . 1 1 2 2 SER CB C 2 64.977 64.977 64.928 0.049 18387 833 1 2 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.694 -0.255 18387 834 1 2 . 1 1 3 3 LEU C C 3 176.631 176.631 175.165 1.466 18387 835 1 2 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.363 0.201 18387 836 1 2 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.458 0.266 18387 837 1 2 . 1 1 4 4 ALA N N 4 125.483 125.483 119.305 6.178 18387 838 1 2 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.690 -0.311 18387 839 1 2 . 1 1 4 4 ALA C C 4 179.642 179.642 176.213 3.429 18387 840 1 2 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.331 0.404 18387 841 1 2 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.026 -1.274 18387 842 1 2 . 1 1 4 4 ALA H H 4 8.483 8.483 7.905 0.578 18387 843 1 2 . 1 1 5 5 THR HA H 5 3.845 3.845 4.427 -0.582 18387 844 1 2 . 1 1 5 5 THR C C 5 175.487 175.487 176.269 -0.782 18387 845 1 2 . 1 1 5 5 THR CA C 5 64.531 64.531 63.504 1.027 18387 846 1 2 . 1 1 5 5 THR CB C 5 68.108 68.108 68.673 -0.565 18387 847 1 2 . 1 1 6 6 GLY N N 6 114.298 114.298 115.575 -1.277 18387 848 1 2 . 1 1 6 6 GLY C C 6 174.324 174.324 174.333 -0.009 18387 849 1 2 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.128 -0.293 18387 850 1 2 . 1 1 6 6 GLY H H 6 9.511 9.511 9.137 0.374 18387 851 1 2 . 1 1 7 7 SER N N 7 115.270 115.270 117.841 -2.571 18387 852 1 2 . 1 1 7 7 SER HA H 7 4.500 4.500 4.613 -0.113 18387 853 1 2 . 1 1 7 7 SER C C 7 173.315 173.315 173.753 -0.438 18387 854 1 2 . 1 1 7 7 SER CA C 7 58.915 58.915 57.945 0.970 18387 855 1 2 . 1 1 7 7 SER CB C 7 64.308 64.308 64.701 -0.393 18387 856 1 2 . 1 1 7 7 SER H H 7 7.736 7.736 7.850 -0.114 18387 857 1 2 . 1 1 8 8 VAL N N 8 123.708 123.708 122.780 0.928 18387 858 1 2 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.120 -0.288 18387 859 1 2 . 1 1 8 8 VAL C C 8 176.673 176.673 175.776 0.897 18387 860 1 2 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.499 2.174 18387 861 1 2 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.953 -0.731 18387 862 1 2 . 1 1 8 8 VAL H H 8 8.632 8.632 8.285 0.347 18387 863 1 2 . 1 1 9 9 ALA N N 9 133.040 133.040 131.858 1.182 18387 864 1 2 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.658 -0.395 18387 865 1 2 . 1 1 9 9 ALA C C 9 175.404 175.404 175.578 -0.174 18387 866 1 2 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.963 0.992 18387 867 1 2 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.624 -0.594 18387 868 1 2 . 1 1 9 9 ALA H H 9 8.448 8.448 8.813 -0.365 18387 869 1 2 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.366 -0.035 18387 870 1 2 . 1 1 10 10 PRO C C 10 175.071 175.071 176.021 -0.950 18387 871 1 2 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.310 0.331 18387 872 1 2 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.378 -0.054 18387 873 1 2 . 1 1 11 11 ALA N N 11 124.172 124.172 125.850 -1.678 18387 874 1 2 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.255 -0.011 18387 875 1 2 . 1 1 11 11 ALA C C 11 177.688 177.688 177.279 0.409 18387 876 1 2 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.843 1.778 18387 877 1 2 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.963 0.364 18387 878 1 2 . 1 1 11 11 ALA H H 11 8.221 8.221 8.284 -0.063 18387 879 1 2 . 1 1 12 12 ILE N N 12 117.815 117.815 125.072 -7.257 18387 880 1 2 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.276 0.052 18387 881 1 2 . 1 1 12 12 ILE C C 12 175.013 175.013 175.630 -0.617 18387 882 1 2 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.605 1.562 18387 883 1 2 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.365 5.925 18387 884 1 2 . 1 1 12 12 ILE H H 12 7.693 7.693 7.940 -0.247 18387 885 1 2 . 1 1 13 13 THR N N 13 121.186 121.186 123.139 -1.953 18387 886 1 2 . 1 1 13 13 THR HA H 13 4.840 4.840 5.047 -0.207 18387 887 1 2 . 1 1 13 13 THR C C 13 172.625 172.625 173.855 -1.230 18387 888 1 2 . 1 1 13 13 THR CA C 13 62.297 62.297 61.205 1.093 18387 889 1 2 . 1 1 13 13 THR CB C 13 71.585 71.585 70.300 1.285 18387 890 1 2 . 1 1 13 13 THR H H 13 8.363 8.363 8.713 -0.350 18387 891 1 2 . 1 1 14 14 GLY N N 14 110.785 110.785 112.032 -1.247 18387 892 1 2 . 1 1 14 14 GLY C C 14 170.040 170.040 172.138 -2.098 18387 893 1 2 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.968 1.423 18387 894 1 2 . 1 1 14 14 GLY H H 14 7.993 7.993 8.755 -0.762 18387 895 1 2 . 1 1 15 15 ILE N N 15 119.088 119.088 119.473 -0.385 18387 896 1 2 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.268 -0.143 18387 897 1 2 . 1 1 15 15 ILE C C 15 176.359 176.359 175.686 0.673 18387 898 1 2 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.259 -1.645 18387 899 1 2 . 1 1 15 15 ILE CB C 15 38.639 38.639 39.695 -1.056 18387 900 1 2 . 1 1 15 15 ILE H H 15 7.973 7.973 8.416 -0.443 18387 901 1 2 . 1 1 16 16 ASP N N 16 126.633 126.633 126.077 0.556 18387 902 1 2 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.515 0.334 18387 903 1 2 . 1 1 16 16 ASP C C 16 179.190 179.190 178.066 1.124 18387 904 1 2 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.248 0.632 18387 905 1 2 . 1 1 16 16 ASP CB C 16 42.275 42.275 43.234 -0.959 18387 906 1 2 . 1 1 16 16 ASP H H 16 9.335 9.335 8.862 0.473 18387 907 1 2 . 1 1 17 17 LEU N N 17 116.648 116.648 119.026 -2.378 18387 908 1 2 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.159 0.015 18387 909 1 2 . 1 1 17 17 LEU C C 17 178.432 178.432 178.017 0.415 18387 910 1 2 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.280 0.701 18387 911 1 2 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.952 1.034 18387 912 1 2 . 1 1 17 17 LEU H H 17 8.071 8.071 8.900 -0.829 18387 913 1 2 . 1 1 18 18 LYS N N 18 117.401 117.401 116.285 1.116 18387 914 1 2 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.258 0.251 18387 915 1 2 . 1 1 18 18 LYS C C 18 176.793 176.793 177.432 -0.639 18387 916 1 2 . 1 1 18 18 LYS CA C 18 55.435 55.435 56.496 -1.061 18387 917 1 2 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.959 0.104 18387 918 1 2 . 1 1 18 18 LYS H H 18 8.207 8.207 8.563 -0.356 18387 919 1 2 . 1 1 19 19 GLY N N 19 108.061 108.061 107.441 0.620 18387 920 1 2 . 1 1 19 19 GLY C C 19 174.649 174.649 174.040 0.609 18387 921 1 2 . 1 1 19 19 GLY CA C 19 45.597 45.597 45.221 0.376 18387 922 1 2 . 1 1 19 19 GLY H H 19 8.099 8.099 8.242 -0.143 18387 923 1 2 . 1 1 20 20 ASN N N 20 121.012 121.012 118.999 2.013 18387 924 1 2 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.971 -0.066 18387 925 1 2 . 1 1 20 20 ASN C C 20 174.827 174.827 174.431 0.396 18387 926 1 2 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.167 0.300 18387 927 1 2 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.422 -1.746 18387 928 1 2 . 1 1 20 20 ASN H H 20 8.945 8.945 8.070 0.875 18387 929 1 2 . 1 1 21 21 SER N N 21 117.285 117.285 117.160 0.125 18387 930 1 2 . 1 1 21 21 SER HA H 21 5.000 5.000 5.147 -0.147 18387 931 1 2 . 1 1 21 21 SER C C 21 174.911 174.911 174.544 0.367 18387 932 1 2 . 1 1 21 21 SER CA C 21 58.730 58.730 58.155 0.575 18387 933 1 2 . 1 1 21 21 SER CB C 21 63.162 63.162 62.960 0.202 18387 934 1 2 . 1 1 21 21 SER H H 21 8.740 8.740 8.612 0.128 18387 935 1 2 . 1 1 22 22 VAL N N 22 128.665 128.665 127.331 1.334 18387 936 1 2 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.314 0.066 18387 937 1 2 . 1 1 22 22 VAL C C 22 176.276 176.276 175.095 1.181 18387 938 1 2 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.640 1.313 18387 939 1 2 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.289 1.293 18387 940 1 2 . 1 1 22 22 VAL H H 22 9.125 9.125 9.042 0.083 18387 941 1 2 . 1 1 23 23 SER N N 23 127.457 127.457 120.307 7.150 18387 942 1 2 . 1 1 23 23 SER HA H 23 5.878 5.878 5.651 0.227 18387 943 1 2 . 1 1 23 23 SER C C 23 174.436 174.436 175.081 -0.645 18387 944 1 2 . 1 1 23 23 SER CA C 23 57.101 57.101 57.146 -0.045 18387 945 1 2 . 1 1 23 23 SER CB C 23 66.078 66.078 64.972 1.106 18387 946 1 2 . 1 1 23 23 SER H H 23 8.971 8.971 8.494 0.477 18387 947 1 2 . 1 1 24 24 LEU N N 24 126.734 126.734 122.423 4.311 18387 948 1 2 . 1 1 24 24 LEU HA H 24 3.467 3.467 4.016 -0.549 18387 949 1 2 . 1 1 24 24 LEU C C 24 179.852 179.852 177.645 2.207 18387 950 1 2 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.118 2.085 18387 951 1 2 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.225 -0.247 18387 952 1 2 . 1 1 24 24 LEU H H 24 8.450 8.450 8.498 -0.048 18387 953 1 2 . 1 1 25 25 ASN N N 25 115.642 115.642 118.468 -2.826 18387 954 1 2 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.409 -0.167 18387 955 1 2 . 1 1 25 25 ASN C C 25 176.246 176.246 176.930 -0.684 18387 956 1 2 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.940 -0.570 18387 957 1 2 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.567 1.204 18387 958 1 2 . 1 1 25 25 ASN H H 25 8.505 8.505 8.794 -0.289 18387 959 1 2 . 1 1 26 26 ASP N N 26 119.722 119.722 119.281 0.441 18387 960 1 2 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.300 -0.095 18387 961 1 2 . 1 1 26 26 ASP C C 26 176.708 176.708 176.729 -0.021 18387 962 1 2 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.391 0.135 18387 963 1 2 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.211 -0.931 18387 964 1 2 . 1 1 26 26 ASP H H 26 7.731 7.731 8.039 -0.308 18387 965 1 2 . 1 1 27 27 PHE N N 27 116.827 116.827 115.749 1.078 18387 966 1 2 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.457 0.023 18387 967 1 2 . 1 1 27 27 PHE C C 27 174.227 174.227 175.341 -1.114 18387 968 1 2 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.391 -0.320 18387 969 1 2 . 1 1 27 27 PHE CB C 27 39.719 39.719 38.901 0.818 18387 970 1 2 . 1 1 27 27 PHE H H 27 7.390 7.390 7.280 0.110 18387 971 1 2 . 1 1 28 28 LYS N N 28 120.357 120.357 122.884 -2.527 18387 972 1 2 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.049 0.338 18387 973 1 2 . 1 1 28 28 LYS C C 28 177.845 177.845 175.699 2.146 18387 974 1 2 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.828 1.173 18387 975 1 2 . 1 1 28 28 LYS CB C 28 32.544 32.544 30.399 2.145 18387 976 1 2 . 1 1 28 28 LYS H H 28 6.883 6.883 7.523 -0.640 18387 977 1 2 . 1 1 29 29 GLY N N 29 112.653 112.653 107.664 4.989 18387 978 1 2 . 1 1 29 29 GLY C C 29 173.799 173.799 172.772 1.027 18387 979 1 2 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.020 -0.032 18387 980 1 2 . 1 1 29 29 GLY H H 29 8.930 8.930 8.365 0.565 18387 981 1 2 . 1 1 30 30 LYS N N 30 120.516 120.516 118.461 2.055 18387 982 1 2 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.673 -0.038 18387 983 1 2 . 1 1 30 30 LYS C C 30 176.505 176.505 174.076 2.429 18387 984 1 2 . 1 1 30 30 LYS CA C 30 55.180 55.180 55.253 -0.073 18387 985 1 2 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.855 -1.998 18387 986 1 2 . 1 1 30 30 LYS H H 30 8.098 8.098 7.269 0.829 18387 987 1 2 . 1 1 31 31 TYR N N 31 117.383 117.383 118.519 -1.136 18387 988 1 2 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.973 -0.319 18387 989 1 2 . 1 1 31 31 TYR C C 31 175.551 175.551 175.706 -0.155 18387 990 1 2 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.091 2.074 18387 991 1 2 . 1 1 31 31 TYR CB C 31 41.193 41.193 39.081 2.112 18387 992 1 2 . 1 1 31 31 TYR H H 31 8.263 8.263 8.885 -0.622 18387 993 1 2 . 1 1 32 32 VAL N N 32 120.900 120.900 123.954 -3.054 18387 994 1 2 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.888 -0.449 18387 995 1 2 . 1 1 32 32 VAL C C 32 175.975 175.975 174.106 1.869 18387 996 1 2 . 1 1 32 32 VAL CA C 32 59.706 59.706 59.229 0.477 18387 997 1 2 . 1 1 32 32 VAL CB C 32 35.507 35.507 34.836 0.671 18387 998 1 2 . 1 1 32 32 VAL H H 32 9.244 9.244 9.098 0.146 18387 999 1 2 . 1 1 33 33 LEU N N 33 130.058 130.058 131.013 -0.955 18387 1000 1 2 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.161 0.012 18387 1001 1 2 . 1 1 33 33 LEU C C 33 174.693 174.693 175.080 -0.387 18387 1002 1 2 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.322 0.027 18387 1003 1 2 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.527 0.794 18387 1004 1 2 . 1 1 33 33 LEU H H 33 8.161 8.161 8.656 -0.495 18387 1005 1 2 . 1 1 34 34 VAL N N 34 129.232 129.232 128.406 0.826 18387 1006 1 2 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.877 0.105 18387 1007 1 2 . 1 1 34 34 VAL C C 34 174.285 174.285 175.042 -0.757 18387 1008 1 2 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.486 1.020 18387 1009 1 2 . 1 1 34 34 VAL CB C 34 32.378 32.378 31.048 1.330 18387 1010 1 2 . 1 1 34 34 VAL H H 34 9.296 9.296 9.049 0.247 18387 1011 1 2 . 1 1 35 35 ASP N N 35 123.675 123.675 126.633 -2.958 18387 1012 1 2 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.897 0.452 18387 1013 1 2 . 1 1 35 35 ASP C C 35 174.258 174.258 175.191 -0.933 18387 1014 1 2 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.010 -0.956 18387 1015 1 2 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.643 -1.181 18387 1016 1 2 . 1 1 35 35 ASP H H 35 8.015 8.015 8.199 -0.184 18387 1017 1 2 . 1 1 36 36 PHE N N 36 126.959 126.959 124.019 2.940 18387 1018 1 2 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.529 0.406 18387 1019 1 2 . 1 1 36 36 PHE C C 36 175.432 175.432 175.834 -0.402 18387 1020 1 2 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.282 -0.187 18387 1021 1 2 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.547 0.483 18387 1022 1 2 . 1 1 36 36 PHE H H 36 9.171 9.171 8.382 0.789 18387 1023 1 2 . 1 1 37 37 TRP N N 37 120.839 120.839 123.559 -2.720 18387 1024 1 2 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.338 0.419 18387 1025 1 2 . 1 1 37 37 TRP C C 37 172.412 172.412 174.153 -1.741 18387 1026 1 2 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.346 0.563 18387 1027 1 2 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.980 -0.300 18387 1028 1 2 . 1 1 37 37 TRP H H 37 9.280 9.280 9.131 0.149 18387 1029 1 2 . 1 1 38 38 PHE N N 38 109.215 109.215 112.980 -3.765 18387 1030 1 2 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.737 -0.804 18387 1031 1 2 . 1 1 38 38 PHE C C 38 176.141 176.141 175.034 1.107 18387 1032 1 2 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.877 0.134 18387 1033 1 2 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.852 -1.233 18387 1034 1 2 . 1 1 38 38 PHE H H 38 7.062 7.062 8.159 -1.097 18387 1035 1 2 . 1 1 39 39 ALA N N 39 125.193 125.193 123.567 1.626 18387 1036 1 2 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.295 -0.230 18387 1037 1 2 . 1 1 39 39 ALA C C 39 179.349 179.349 178.887 0.462 18387 1038 1 2 . 1 1 39 39 ALA CA C 39 56.064 56.064 55.388 0.676 18387 1039 1 2 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.899 0.998 18387 1040 1 2 . 1 1 39 39 ALA H H 39 10.355 10.355 9.612 0.743 18387 1041 1 2 . 1 1 40 40 GLY N N 40 103.437 103.437 105.385 -1.948 18387 1042 1 2 . 1 1 40 40 GLY C C 40 172.732 172.732 173.512 -0.780 18387 1043 1 2 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.863 0.073 18387 1044 1 2 . 1 1 40 40 GLY H H 40 8.583 8.583 8.330 0.253 18387 1045 1 2 . 1 1 41 41 CYS N N 41 124.859 124.859 120.933 3.926 18387 1046 1 2 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.186 0.218 18387 1047 1 2 . 1 1 41 41 CYS C C 41 176.620 176.620 175.508 1.112 18387 1048 1 2 . 1 1 41 41 CYS CA C 41 58.375 58.375 58.706 -0.331 18387 1049 1 2 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.156 0.220 18387 1050 1 2 . 1 1 41 41 CYS H H 41 6.946 6.946 7.036 -0.090 18387 1051 1 2 . 1 1 42 42 SER HA H 42 4.040 4.040 4.375 -0.335 18387 1052 1 2 . 1 1 42 42 SER CA C 42 61.552 61.552 61.273 0.279 18387 1053 1 2 . 1 1 42 42 SER CB C 42 62.675 62.675 62.863 -0.188 18387 1054 1 2 . 1 1 43 43 TRP N N 43 129.748 129.748 121.968 7.780 18387 1055 1 2 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.639 -0.090 18387 1056 1 2 . 1 1 43 43 TRP C C 43 180.400 180.400 177.955 2.445 18387 1057 1 2 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.133 1.116 18387 1058 1 2 . 1 1 43 43 TRP CB C 43 29.592 29.592 30.189 -0.597 18387 1059 1 2 . 1 1 44 44 CYS N N 44 124.462 124.462 119.734 4.728 18387 1060 1 2 . 1 1 44 44 CYS HA H 44 4.251 4.251 3.985 0.266 18387 1061 1 2 . 1 1 44 44 CYS C C 44 178.643 178.643 176.551 2.092 18387 1062 1 2 . 1 1 44 44 CYS CA C 44 64.849 64.849 63.514 1.335 18387 1063 1 2 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.004 2.418 18387 1064 1 2 . 1 1 44 44 CYS H H 44 9.591 9.591 7.748 1.843 18387 1065 1 2 . 1 1 45 45 ARG N N 45 117.248 117.248 117.910 -0.662 18387 1066 1 2 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.109 0.067 18387 1067 1 2 . 1 1 45 45 ARG C C 45 180.302 180.302 177.405 2.897 18387 1068 1 2 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.506 -0.563 18387 1069 1 2 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.372 -1.742 18387 1070 1 2 . 1 1 45 45 ARG H H 45 7.955 7.955 7.615 0.340 18387 1071 1 2 . 1 1 46 46 LYS N N 46 120.318 120.318 118.637 1.681 18387 1072 1 2 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.064 0.208 18387 1073 1 2 . 1 1 46 46 LYS C C 46 177.755 177.755 177.342 0.413 18387 1074 1 2 . 1 1 46 46 LYS CA C 46 58.769 58.769 58.135 0.634 18387 1075 1 2 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.528 0.629 18387 1076 1 2 . 1 1 46 46 LYS H H 46 8.129 8.129 7.695 0.434 18387 1077 1 2 . 1 1 47 47 GLU N N 47 114.278 114.278 115.743 -1.465 18387 1078 1 2 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.679 0.212 18387 1079 1 2 . 1 1 47 47 GLU C C 47 178.701 178.701 177.969 0.732 18387 1080 1 2 . 1 1 47 47 GLU CA C 47 56.554 56.554 56.700 -0.146 18387 1081 1 2 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.385 0.381 18387 1082 1 2 . 1 1 47 47 GLU H H 47 7.386 7.386 7.361 0.025 18387 1083 1 2 . 1 1 48 48 THR N N 48 115.665 115.665 118.543 -2.878 18387 1084 1 2 . 1 1 48 48 THR HA H 48 4.048 4.048 4.114 -0.066 18387 1085 1 2 . 1 1 48 48 THR C C 48 172.392 172.392 174.628 -2.236 18387 1086 1 2 . 1 1 48 48 THR CA C 48 69.426 69.426 68.757 0.669 18387 1087 1 2 . 1 1 48 48 THR CB C 48 66.906 66.906 66.681 0.225 18387 1088 1 2 . 1 1 48 48 THR H H 48 7.810 7.810 7.680 0.130 18387 1089 1 2 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.184 0.105 18387 1090 1 2 . 1 1 49 49 PRO C C 49 179.828 179.828 178.497 1.331 18387 1091 1 2 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.245 0.354 18387 1092 1 2 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.096 -0.062 18387 1093 1 2 . 1 1 50 50 TYR N N 50 116.950 116.950 116.451 0.499 18387 1094 1 2 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.342 -0.204 18387 1095 1 2 . 1 1 50 50 TYR C C 50 179.488 179.488 178.081 1.407 18387 1096 1 2 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.906 -0.771 18387 1097 1 2 . 1 1 50 50 TYR CB C 50 38.301 38.301 38.148 0.153 18387 1098 1 2 . 1 1 50 50 TYR H H 50 7.071 7.071 7.266 -0.195 18387 1099 1 2 . 1 1 51 51 LEU N N 51 123.989 123.989 120.595 3.394 18387 1100 1 2 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.873 -0.203 18387 1101 1 2 . 1 1 51 51 LEU C C 51 178.072 178.072 179.004 -0.932 18387 1102 1 2 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.191 0.485 18387 1103 1 2 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.606 1.011 18387 1104 1 2 . 1 1 51 51 LEU H H 51 8.243 8.243 8.415 -0.172 18387 1105 1 2 . 1 1 52 52 LEU N N 52 119.857 119.857 119.459 0.398 18387 1106 1 2 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.194 0.133 18387 1107 1 2 . 1 1 52 52 LEU C C 52 178.704 178.704 178.474 0.230 18387 1108 1 2 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.329 0.246 18387 1109 1 2 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.660 1.078 18387 1110 1 2 . 1 1 52 52 LEU H H 52 9.085 9.085 8.429 0.656 18387 1111 1 2 . 1 1 53 53 LYS N N 53 118.658 118.658 119.014 -0.356 18387 1112 1 2 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.921 0.188 18387 1113 1 2 . 1 1 53 53 LYS C C 53 179.786 179.786 178.858 0.928 18387 1114 1 2 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.126 -0.405 18387 1115 1 2 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.224 0.935 18387 1116 1 2 . 1 1 53 53 LYS H H 53 7.807 7.807 8.318 -0.511 18387 1117 1 2 . 1 1 54 54 THR N N 54 116.869 116.869 116.171 0.698 18387 1118 1 2 . 1 1 54 54 THR HA H 54 3.965 3.965 4.294 -0.329 18387 1119 1 2 . 1 1 54 54 THR C C 54 175.328 175.328 176.686 -1.358 18387 1120 1 2 . 1 1 54 54 THR CA C 54 67.683 67.683 66.977 0.706 18387 1121 1 2 . 1 1 54 54 THR CB C 54 68.452 68.452 68.768 -0.316 18387 1122 1 2 . 1 1 54 54 THR H H 54 7.771 7.771 8.079 -0.308 18387 1123 1 2 . 1 1 55 55 TYR N N 55 122.202 122.202 122.722 -0.520 18387 1124 1 2 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.378 -0.106 18387 1125 1 2 . 1 1 55 55 TYR C C 55 176.809 176.809 177.276 -0.467 18387 1126 1 2 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.692 1.045 18387 1127 1 2 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.467 0.813 18387 1128 1 2 . 1 1 55 55 TYR H H 55 9.145 9.145 8.759 0.386 18387 1129 1 2 . 1 1 56 56 ASN N N 56 113.858 113.858 117.286 -3.428 18387 1130 1 2 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.326 -0.063 18387 1131 1 2 . 1 1 56 56 ASN C C 56 177.427 177.427 176.857 0.570 18387 1132 1 2 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.515 0.415 18387 1133 1 2 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.478 -0.524 18387 1134 1 2 . 1 1 56 56 ASN H H 56 8.850 8.850 8.482 0.368 18387 1135 1 2 . 1 1 57 57 ALA N N 57 118.829 118.829 120.053 -1.224 18387 1136 1 2 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.026 0.038 18387 1137 1 2 . 1 1 57 57 ALA C C 57 180.445 180.445 178.197 2.248 18387 1138 1 2 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.014 0.337 18387 1139 1 2 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.872 0.322 18387 1140 1 2 . 1 1 57 57 ALA H H 57 7.436 7.436 7.517 -0.081 18387 1141 1 2 . 1 1 58 58 PHE N N 58 112.082 112.082 114.694 -2.612 18387 1142 1 2 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.637 0.284 18387 1143 1 2 . 1 1 58 58 PHE C C 58 176.999 176.999 176.434 0.565 18387 1144 1 2 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.663 0.404 18387 1145 1 2 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.587 0.902 18387 1146 1 2 . 1 1 58 58 PHE H H 58 7.480 7.480 7.747 -0.267 18387 1147 1 2 . 1 1 59 59 LYS N N 59 120.666 120.666 121.479 -0.813 18387 1148 1 2 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.245 0.558 18387 1149 1 2 . 1 1 59 59 LYS C C 59 177.157 177.157 177.768 -0.611 18387 1150 1 2 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.615 -0.534 18387 1151 1 2 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.659 -1.091 18387 1152 1 2 . 1 1 59 59 LYS H H 59 8.411 8.411 7.683 0.728 18387 1153 1 2 . 1 1 60 60 ASP N N 60 118.908 118.908 118.577 0.331 18387 1154 1 2 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.593 0.532 18387 1155 1 2 . 1 1 60 60 ASP C C 60 176.889 176.889 178.010 -1.121 18387 1156 1 2 . 1 1 60 60 ASP CA C 60 54.649 54.649 56.434 -1.785 18387 1157 1 2 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.491 0.221 18387 1158 1 2 . 1 1 60 60 ASP H H 60 8.574 8.574 8.533 0.041 18387 1159 1 2 . 1 1 61 61 LYS N N 61 121.021 121.021 119.890 1.131 18387 1160 1 2 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.167 0.547 18387 1161 1 2 . 1 1 61 61 LYS C C 61 175.968 175.968 177.552 -1.584 18387 1162 1 2 . 1 1 61 61 LYS CA C 61 55.137 55.137 58.446 -3.309 18387 1163 1 2 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.184 -0.106 18387 1164 1 2 . 1 1 61 61 LYS H H 61 8.278 8.278 8.331 -0.053 18387 1165 1 2 . 1 1 62 62 GLY C C 62 173.837 173.837 172.248 1.589 18387 1166 1 2 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.336 1.714 18387 1167 1 2 . 1 1 63 63 PHE N N 63 120.476 120.476 121.684 -1.208 18387 1168 1 2 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.905 0.128 18387 1169 1 2 . 1 1 63 63 PHE C C 63 173.613 173.613 173.123 0.490 18387 1170 1 2 . 1 1 63 63 PHE CA C 63 55.850 55.850 55.917 -0.067 18387 1171 1 2 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.974 -0.299 18387 1172 1 2 . 1 1 63 63 PHE H H 63 7.413 7.413 8.163 -0.750 18387 1173 1 2 . 1 1 64 64 THR N N 64 119.903 119.903 119.574 0.329 18387 1174 1 2 . 1 1 64 64 THR HA H 64 4.097 4.097 4.532 -0.435 18387 1175 1 2 . 1 1 64 64 THR C C 64 170.397 170.397 172.349 -1.952 18387 1176 1 2 . 1 1 64 64 THR CA C 64 60.261 60.261 61.065 -0.804 18387 1177 1 2 . 1 1 64 64 THR CB C 64 69.507 69.507 72.249 -2.742 18387 1178 1 2 . 1 1 64 64 THR H H 64 7.665 7.665 7.806 -0.141 18387 1179 1 2 . 1 1 65 65 ILE N N 65 117.277 117.277 122.956 -5.679 18387 1180 1 2 . 1 1 65 65 ILE HA H 65 4.476 4.476 3.909 0.567 18387 1181 1 2 . 1 1 65 65 ILE C C 65 173.056 173.056 173.816 -0.760 18387 1182 1 2 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.666 -0.958 18387 1183 1 2 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.699 1.146 18387 1184 1 2 . 1 1 65 65 ILE H H 65 7.321 7.321 8.549 -1.228 18387 1185 1 2 . 1 1 66 66 TYR N N 66 131.968 131.968 128.185 3.783 18387 1186 1 2 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.205 0.042 18387 1187 1 2 . 1 1 66 66 TYR C C 66 174.074 174.074 174.766 -0.692 18387 1188 1 2 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.340 -0.375 18387 1189 1 2 . 1 1 66 66 TYR CB C 66 41.117 41.117 40.275 0.842 18387 1190 1 2 . 1 1 66 66 TYR H H 66 9.038 9.038 9.177 -0.139 18387 1191 1 2 . 1 1 67 67 GLY N N 67 114.364 114.364 115.774 -1.410 18387 1192 1 2 . 1 1 67 67 GLY C C 67 172.461 172.461 172.325 0.136 18387 1193 1 2 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.481 0.519 18387 1194 1 2 . 1 1 67 67 GLY H H 67 9.188 9.188 8.901 0.287 18387 1195 1 2 . 1 1 68 68 VAL N N 68 126.938 126.938 127.473 -0.535 18387 1196 1 2 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.932 -0.796 18387 1197 1 2 . 1 1 68 68 VAL C C 68 173.822 173.822 173.772 0.050 18387 1198 1 2 . 1 1 68 68 VAL CA C 68 61.498 61.498 60.038 1.460 18387 1199 1 2 . 1 1 68 68 VAL CB C 68 33.558 33.558 33.755 -0.197 18387 1200 1 2 . 1 1 68 68 VAL H H 68 9.309 9.309 8.481 0.828 18387 1201 1 2 . 1 1 69 69 SER N N 69 118.813 118.813 123.495 -4.682 18387 1202 1 2 . 1 1 69 69 SER HA H 69 5.527 5.527 5.450 0.077 18387 1203 1 2 . 1 1 69 69 SER C C 69 175.753 175.753 173.309 2.444 18387 1204 1 2 . 1 1 69 69 SER CA C 69 54.407 54.407 55.247 -0.840 18387 1205 1 2 . 1 1 69 69 SER CB C 69 63.630 63.630 65.058 -1.428 18387 1206 1 2 . 1 1 69 69 SER H H 69 8.124 8.124 9.064 -0.940 18387 1207 1 2 . 1 1 70 70 THR N N 70 113.861 113.861 116.221 -2.360 18387 1208 1 2 . 1 1 70 70 THR HA H 70 4.381 4.381 4.494 -0.113 18387 1209 1 2 . 1 1 70 70 THR C C 70 175.001 175.001 173.437 1.564 18387 1210 1 2 . 1 1 70 70 THR CA C 70 60.259 60.259 60.179 0.080 18387 1211 1 2 . 1 1 70 70 THR CB C 70 67.291 67.291 69.559 -2.268 18387 1212 1 2 . 1 1 70 70 THR H H 70 7.656 7.656 8.090 -0.434 18387 1213 1 2 . 1 1 71 71 ASP N N 71 125.133 125.133 121.888 3.245 18387 1214 1 2 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.540 -0.470 18387 1215 1 2 . 1 1 71 71 ASP C C 71 175.685 175.685 176.789 -1.104 18387 1216 1 2 . 1 1 71 71 ASP CA C 71 57.612 57.612 53.763 3.849 18387 1217 1 2 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.406 -0.037 18387 1218 1 2 . 1 1 71 71 ASP H H 71 8.931 8.931 7.815 1.116 18387 1219 1 2 . 1 1 72 72 ARG N N 72 118.814 118.814 118.622 0.192 18387 1220 1 2 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.099 0.096 18387 1221 1 2 . 1 1 72 72 ARG C C 72 177.300 177.300 176.967 0.333 18387 1222 1 2 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.765 -0.956 18387 1223 1 2 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.682 0.429 18387 1224 1 2 . 1 1 72 72 ARG H H 72 8.057 8.057 8.508 -0.451 18387 1225 1 2 . 1 1 73 73 ARG N N 73 118.174 118.174 117.083 1.091 18387 1226 1 2 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.696 0.058 18387 1227 1 2 . 1 1 73 73 ARG C C 73 176.503 176.503 175.554 0.949 18387 1228 1 2 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.967 -0.431 18387 1229 1 2 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.407 -2.379 18387 1230 1 2 . 1 1 73 73 ARG H H 73 8.639 8.639 7.737 0.902 18387 1231 1 2 . 1 1 74 74 GLU N N 74 127.609 127.609 122.992 4.617 18387 1232 1 2 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.080 -0.001 18387 1233 1 2 . 1 1 74 74 GLU C C 74 178.107 178.107 177.754 0.353 18387 1234 1 2 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.328 -0.543 18387 1235 1 2 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.879 0.219 18387 1236 1 2 . 1 1 74 74 GLU H H 74 9.129 9.129 9.050 0.079 18387 1237 1 2 . 1 1 75 75 GLU N N 75 117.874 117.874 119.173 -1.299 18387 1238 1 2 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.207 -0.107 18387 1239 1 2 . 1 1 75 75 GLU C C 75 178.993 178.993 178.921 0.072 18387 1240 1 2 . 1 1 75 75 GLU CA C 75 60.127 60.127 58.975 1.152 18387 1241 1 2 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.723 0.568 18387 1242 1 2 . 1 1 75 75 GLU H H 75 9.745 9.745 8.867 0.878 18387 1243 1 2 . 1 1 76 76 ASP N N 76 119.182 119.182 120.597 -1.415 18387 1244 1 2 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.475 -0.109 18387 1245 1 2 . 1 1 76 76 ASP C C 76 178.107 178.107 178.389 -0.282 18387 1246 1 2 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.954 -0.981 18387 1247 1 2 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.478 0.042 18387 1248 1 2 . 1 1 76 76 ASP H H 76 7.004 7.004 8.570 -1.566 18387 1249 1 2 . 1 1 77 77 TRP N N 77 123.008 123.008 122.369 0.639 18387 1250 1 2 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.226 -0.077 18387 1251 1 2 . 1 1 77 77 TRP C C 77 176.236 176.236 177.476 -1.240 18387 1252 1 2 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.867 -0.384 18387 1253 1 2 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.481 -0.946 18387 1254 1 2 . 1 1 77 77 TRP H H 77 7.112 7.112 8.121 -1.009 18387 1255 1 2 . 1 1 78 78 LYS N N 78 115.727 115.727 118.234 -2.507 18387 1256 1 2 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.405 -0.160 18387 1257 1 2 . 1 1 78 78 LYS C C 78 179.426 179.426 179.157 0.269 18387 1258 1 2 . 1 1 78 78 LYS CA C 78 60.432 60.432 58.769 1.663 18387 1259 1 2 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.136 1.609 18387 1260 1 2 . 1 1 78 78 LYS H H 78 8.431 8.431 8.382 0.049 18387 1261 1 2 . 1 1 79 79 LYS N N 79 118.321 118.321 119.665 -1.344 18387 1262 1 2 . 1 1 79 79 LYS HA H 79 4.020 4.020 4.010 0.010 18387 1263 1 2 . 1 1 79 79 LYS C C 79 178.239 178.239 178.733 -0.494 18387 1264 1 2 . 1 1 79 79 LYS CA C 79 59.067 59.067 58.862 0.205 18387 1265 1 2 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.312 0.151 18387 1266 1 2 . 1 1 79 79 LYS H H 79 7.690 7.690 8.182 -0.492 18387 1267 1 2 . 1 1 80 80 ALA N N 80 120.679 120.679 122.098 -1.419 18387 1268 1 2 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.552 -0.397 18387 1269 1 2 . 1 1 80 80 ALA C C 80 178.811 178.811 180.238 -1.427 18387 1270 1 2 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.871 0.216 18387 1271 1 2 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.402 0.356 18387 1272 1 2 . 1 1 80 80 ALA H H 80 7.560 7.560 8.177 -0.617 18387 1273 1 2 . 1 1 81 81 ILE N N 81 118.019 118.019 118.695 -0.676 18387 1274 1 2 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.333 0.069 18387 1275 1 2 . 1 1 81 81 ILE C C 81 178.113 178.113 177.637 0.476 18387 1276 1 2 . 1 1 81 81 ILE CA C 81 64.520 64.520 65.105 -0.585 18387 1277 1 2 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.419 0.785 18387 1278 1 2 . 1 1 81 81 ILE H H 81 7.514 7.514 7.811 -0.297 18387 1279 1 2 . 1 1 82 82 GLU N N 82 117.252 117.252 120.307 -3.055 18387 1280 1 2 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.940 0.154 18387 1281 1 2 . 1 1 82 82 GLU C C 82 179.558 179.558 178.763 0.795 18387 1282 1 2 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.762 -0.182 18387 1283 1 2 . 1 1 82 82 GLU CB C 82 29.383 29.383 28.928 0.455 18387 1284 1 2 . 1 1 82 82 GLU H H 82 7.401 7.401 7.655 -0.254 18387 1285 1 2 . 1 1 83 83 GLU N N 83 119.340 119.340 119.115 0.225 18387 1286 1 2 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.044 -0.146 18387 1287 1 2 . 1 1 83 83 GLU C C 83 178.740 178.740 178.575 0.165 18387 1288 1 2 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.896 0.103 18387 1289 1 2 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.628 0.292 18387 1290 1 2 . 1 1 83 83 GLU H H 83 8.191 8.191 7.857 0.334 18387 1291 1 2 . 1 1 84 84 ASP N N 84 118.449 118.449 116.912 1.537 18387 1292 1 2 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.452 -0.178 18387 1293 1 2 . 1 1 84 84 ASP C C 84 175.597 175.597 175.659 -0.062 18387 1294 1 2 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.564 0.483 18387 1295 1 2 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.816 -0.920 18387 1296 1 2 . 1 1 84 84 ASP H H 84 8.252 8.252 7.982 0.270 18387 1297 1 2 . 1 1 85 85 LYS N N 85 116.410 116.410 114.978 1.432 18387 1298 1 2 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.452 -0.279 18387 1299 1 2 . 1 1 85 85 LYS C C 85 176.856 176.856 175.276 1.580 18387 1300 1 2 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.960 -0.987 18387 1301 1 2 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.932 -1.064 18387 1302 1 2 . 1 1 85 85 LYS H H 85 7.890 7.890 7.709 0.181 18387 1303 1 2 . 1 1 86 86 SER N N 86 112.295 112.295 114.750 -2.455 18387 1304 1 2 . 1 1 86 86 SER HA H 86 3.139 3.139 3.722 -0.583 18387 1305 1 2 . 1 1 86 86 SER C C 86 175.805 175.805 172.382 3.423 18387 1306 1 2 . 1 1 86 86 SER CA C 86 53.637 53.637 57.582 -3.945 18387 1307 1 2 . 1 1 86 86 SER CB C 86 60.736 60.736 61.842 -1.106 18387 1308 1 2 . 1 1 86 86 SER H H 86 7.327 7.327 7.264 0.063 18387 1309 1 2 . 1 1 87 87 TYR N N 87 120.962 120.962 126.211 -5.249 18387 1310 1 2 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.294 0.011 18387 1311 1 2 . 1 1 87 87 TYR C C 87 177.064 177.064 175.266 1.798 18387 1312 1 2 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.190 0.033 18387 1313 1 2 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.613 -1.260 18387 1314 1 2 . 1 1 87 87 TYR H H 87 6.933 6.933 7.592 -0.659 18387 1315 1 2 . 1 1 88 88 TRP N N 88 118.597 118.597 121.650 -3.053 18387 1316 1 2 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.838 0.013 18387 1317 1 2 . 1 1 88 88 TRP C C 88 175.456 175.456 174.327 1.129 18387 1318 1 2 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.542 1.694 18387 1319 1 2 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.927 -4.200 18387 1320 1 2 . 1 1 88 88 TRP H H 88 6.552 6.552 7.249 -0.697 18387 1321 1 2 . 1 1 89 89 ASN N N 89 118.067 118.067 121.619 -3.552 18387 1322 1 2 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.802 0.247 18387 1323 1 2 . 1 1 89 89 ASN C C 89 173.773 173.773 174.937 -1.164 18387 1324 1 2 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.117 1.339 18387 1325 1 2 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.979 1.218 18387 1326 1 2 . 1 1 89 89 ASN H H 89 7.864 7.864 8.801 -0.937 18387 1327 1 2 . 1 1 90 90 GLN N N 90 125.392 125.392 121.210 4.182 18387 1328 1 2 . 1 1 90 90 GLN HA H 90 5.497 5.497 4.949 0.548 18387 1329 1 2 . 1 1 90 90 GLN C C 90 176.491 176.491 173.835 2.656 18387 1330 1 2 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.389 1.071 18387 1331 1 2 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.497 -1.270 18387 1332 1 2 . 1 1 90 90 GLN H H 90 7.904 7.904 8.324 -0.420 18387 1333 1 2 . 1 1 91 91 VAL N N 91 114.434 114.434 120.384 -5.950 18387 1334 1 2 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.721 0.759 18387 1335 1 2 . 1 1 91 91 VAL C C 91 174.248 174.248 172.389 1.859 18387 1336 1 2 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.417 -0.411 18387 1337 1 2 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.929 0.709 18387 1338 1 2 . 1 1 91 91 VAL H H 91 9.585 9.585 9.010 0.575 18387 1339 1 2 . 1 1 92 92 LEU N N 92 126.910 126.910 127.877 -0.967 18387 1340 1 2 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.727 -0.658 18387 1341 1 2 . 1 1 92 92 LEU C C 92 177.696 177.696 174.957 2.739 18387 1342 1 2 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.098 0.746 18387 1343 1 2 . 1 1 92 92 LEU CB C 92 42.947 42.947 44.366 -1.419 18387 1344 1 2 . 1 1 92 92 LEU H H 92 8.941 8.941 8.478 0.463 18387 1345 1 2 . 1 1 93 93 LEU N N 93 125.673 125.673 126.833 -1.160 18387 1346 1 2 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.489 -0.089 18387 1347 1 2 . 1 1 93 93 LEU C C 93 177.291 177.291 176.834 0.457 18387 1348 1 2 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.016 -0.065 18387 1349 1 2 . 1 1 93 93 LEU CB C 93 43.179 43.179 42.094 1.085 18387 1350 1 2 . 1 1 93 93 LEU H H 93 8.038 8.038 8.518 -0.480 18387 1351 1 2 . 1 1 94 94 GLN N N 94 122.206 122.206 121.078 1.128 18387 1352 1 2 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.195 0.042 18387 1353 1 2 . 1 1 94 94 GLN C C 94 178.246 178.246 177.083 1.163 18387 1354 1 2 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.414 0.360 18387 1355 1 2 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.636 -0.381 18387 1356 1 2 . 1 1 94 94 GLN H H 94 9.298 9.298 8.555 0.743 18387 1357 1 2 . 1 1 95 95 LYS N N 95 122.668 122.668 122.267 0.401 18387 1358 1 2 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.845 0.121 18387 1359 1 2 . 1 1 95 95 LYS C C 95 178.787 178.787 177.837 0.950 18387 1360 1 2 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.419 0.653 18387 1361 1 2 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.461 1.004 18387 1362 1 2 . 1 1 95 95 LYS H H 95 8.645 8.645 8.808 -0.163 18387 1363 1 2 . 1 1 96 96 ASP N N 96 116.775 116.775 115.024 1.751 18387 1364 1 2 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.574 0.006 18387 1365 1 2 . 1 1 96 96 ASP C C 96 176.220 176.220 177.899 -1.679 18387 1366 1 2 . 1 1 96 96 ASP CA C 96 56.346 56.346 55.871 0.475 18387 1367 1 2 . 1 1 96 96 ASP CB C 96 40.557 40.557 39.986 0.571 18387 1368 1 2 . 1 1 96 96 ASP H H 96 8.606 8.606 8.290 0.316 18387 1369 1 2 . 1 1 97 97 ASP N N 97 118.213 118.213 120.653 -2.440 18387 1370 1 2 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.353 0.574 18387 1371 1 2 . 1 1 97 97 ASP C C 97 176.954 176.954 178.321 -1.367 18387 1372 1 2 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.908 -1.549 18387 1373 1 2 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.723 1.601 18387 1374 1 2 . 1 1 97 97 ASP H H 97 7.988 7.988 8.133 -0.145 18387 1375 1 2 . 1 1 98 98 VAL N N 98 118.907 118.907 119.532 -0.625 18387 1376 1 2 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.604 -0.188 18387 1377 1 2 . 1 1 98 98 VAL C C 98 176.470 176.470 177.747 -1.277 18387 1378 1 2 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.551 1.227 18387 1379 1 2 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.160 1.231 18387 1380 1 2 . 1 1 98 98 VAL H H 98 7.098 7.098 8.625 -1.527 18387 1381 1 2 . 1 1 99 99 LYS N N 99 117.909 117.909 120.242 -2.333 18387 1382 1 2 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.901 0.042 18387 1383 1 2 . 1 1 99 99 LYS C C 99 178.762 178.762 178.588 0.174 18387 1384 1 2 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.785 0.360 18387 1385 1 2 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.102 -0.090 18387 1386 1 2 . 1 1 99 99 LYS H H 99 8.304 8.304 7.602 0.702 18387 1387 1 2 . 1 1 100 100 ASP N N 100 117.843 117.843 119.409 -1.566 18387 1388 1 2 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.466 0.012 18387 1389 1 2 . 1 1 100 100 ASP C C 100 179.694 179.694 179.082 0.612 18387 1390 1 2 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.337 0.189 18387 1391 1 2 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.764 0.064 18387 1392 1 2 . 1 1 100 100 ASP H H 100 8.024 8.024 7.641 0.383 18387 1393 1 2 . 1 1 101 101 VAL N N 101 122.202 122.202 121.284 0.918 18387 1394 1 2 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.837 0.158 18387 1395 1 2 . 1 1 101 101 VAL C C 101 178.533 178.533 177.825 0.708 18387 1396 1 2 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.641 0.361 18387 1397 1 2 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.890 0.146 18387 1398 1 2 . 1 1 101 101 VAL H H 101 8.205 8.205 8.142 0.063 18387 1399 1 2 . 1 1 102 102 LEU N N 102 118.798 118.798 119.355 -0.557 18387 1400 1 2 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.942 -0.162 18387 1401 1 2 . 1 1 102 102 LEU C C 102 180.254 180.254 178.981 1.273 18387 1402 1 2 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.634 1.307 18387 1403 1 2 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.255 -0.816 18387 1404 1 2 . 1 1 102 102 LEU H H 102 8.422 8.422 8.195 0.227 18387 1405 1 2 . 1 1 103 103 GLU N N 103 116.915 116.915 120.111 -3.196 18387 1406 1 2 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.101 0.034 18387 1407 1 2 . 1 1 103 103 GLU C C 103 180.910 180.910 179.150 1.760 18387 1408 1 2 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.687 0.716 18387 1409 1 2 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.664 0.067 18387 1410 1 2 . 1 1 103 103 GLU H H 103 8.262 8.262 7.706 0.556 18387 1411 1 2 . 1 1 104 104 SER N N 104 117.866 117.866 116.938 0.928 18387 1412 1 2 . 1 1 104 104 SER HA H 104 4.216 4.216 4.066 0.150 18387 1413 1 2 . 1 1 104 104 SER C C 104 175.455 175.455 176.250 -0.795 18387 1414 1 2 . 1 1 104 104 SER CA C 104 62.019 62.019 62.318 -0.299 18387 1415 1 2 . 1 1 104 104 SER CB C 104 62.891 62.891 63.063 -0.172 18387 1416 1 2 . 1 1 104 104 SER H H 104 8.544 8.544 8.473 0.071 18387 1417 1 2 . 1 1 105 105 TYR N N 105 117.278 117.278 118.937 -1.659 18387 1418 1 2 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.572 -0.300 18387 1419 1 2 . 1 1 105 105 TYR C C 105 174.750 174.750 175.251 -0.501 18387 1420 1 2 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.935 1.924 18387 1421 1 2 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.678 2.033 18387 1422 1 2 . 1 1 105 105 TYR H H 105 7.691 7.691 7.696 -0.005 18387 1423 1 2 . 1 1 106 106 CYS N N 106 116.897 116.897 118.184 -1.287 18387 1424 1 2 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.050 -0.155 18387 1425 1 2 . 1 1 106 106 CYS C C 106 174.056 174.056 173.889 0.167 18387 1426 1 2 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.535 0.075 18387 1427 1 2 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.859 -0.827 18387 1428 1 2 . 1 1 106 106 CYS H H 106 7.862 7.862 8.428 -0.566 18387 1429 1 2 . 1 1 107 107 ILE N N 107 118.885 118.885 121.460 -2.575 18387 1430 1 2 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.698 -0.359 18387 1431 1 2 . 1 1 107 107 ILE C C 107 176.793 176.793 175.144 1.649 18387 1432 1 2 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.894 1.851 18387 1433 1 2 . 1 1 107 107 ILE CB C 107 38.079 38.079 34.535 3.544 18387 1434 1 2 . 1 1 107 107 ILE H H 107 7.707 7.707 7.720 -0.013 18387 1435 1 2 . 1 1 108 108 VAL N N 108 123.983 123.983 124.246 -0.263 18387 1436 1 2 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.301 -0.027 18387 1437 1 2 . 1 1 108 108 VAL C C 108 175.476 175.476 176.094 -0.618 18387 1438 1 2 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.017 -0.393 18387 1439 1 2 . 1 1 108 108 VAL CB C 108 33.008 33.008 34.149 -1.141 18387 1440 1 2 . 1 1 108 108 VAL H H 108 8.656 8.656 7.854 0.802 18387 1441 1 2 . 1 1 109 109 GLY N N 109 110.120 110.120 108.826 1.294 18387 1442 1 2 . 1 1 109 109 GLY C C 109 169.982 169.982 172.461 -2.479 18387 1443 1 2 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.475 0.128 18387 1444 1 2 . 1 1 109 109 GLY H H 109 7.500 7.500 7.499 0.001 18387 1445 1 2 . 1 1 110 110 PHE N N 110 115.276 115.276 122.454 -7.178 18387 1446 1 2 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.130 -0.356 18387 1447 1 2 . 1 1 110 110 PHE C C 110 174.361 174.361 174.187 0.174 18387 1448 1 2 . 1 1 110 110 PHE CA C 110 55.687 55.687 54.461 1.226 18387 1449 1 2 . 1 1 110 110 PHE CB C 110 41.951 41.951 42.197 -0.246 18387 1450 1 2 . 1 1 110 110 PHE H H 110 8.203 8.203 8.384 -0.181 18387 1451 1 2 . 1 1 111 111 PRO HA H 111 5.359 5.359 3.324 2.035 18387 1452 1 2 . 1 1 111 111 PRO C C 111 175.691 175.691 174.983 0.708 18387 1453 1 2 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.478 0.679 18387 1454 1 2 . 1 1 111 111 PRO CB C 111 35.304 35.304 32.576 2.728 18387 1455 1 2 . 1 1 112 112 HIS N N 112 123.708 123.708 123.753 -0.045 18387 1456 1 2 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.993 -0.030 18387 1457 1 2 . 1 1 112 112 HIS C C 112 173.649 173.649 174.602 -0.953 18387 1458 1 2 . 1 1 112 112 HIS CA C 112 57.074 57.074 54.825 2.249 18387 1459 1 2 . 1 1 112 112 HIS CB C 112 32.197 32.197 29.472 2.725 18387 1460 1 2 . 1 1 112 112 HIS H H 112 8.952 8.952 8.208 0.744 18387 1461 1 2 . 1 1 113 113 ILE N N 113 128.596 128.596 128.686 -0.090 18387 1462 1 2 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.655 1.042 18387 1463 1 2 . 1 1 113 113 ILE C C 113 176.130 176.130 174.730 1.400 18387 1464 1 2 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.383 0.612 18387 1465 1 2 . 1 1 113 113 ILE CB C 113 38.055 38.055 38.833 -0.778 18387 1466 1 2 . 1 1 113 113 ILE H H 113 8.808 8.808 7.856 0.952 18387 1467 1 2 . 1 1 114 114 ILE N N 114 119.668 119.668 122.216 -2.548 18387 1468 1 2 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.954 0.019 18387 1469 1 2 . 1 1 114 114 ILE C C 114 173.186 173.186 173.757 -0.571 18387 1470 1 2 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.282 0.448 18387 1471 1 2 . 1 1 114 114 ILE CB C 114 42.540 42.540 41.985 0.555 18387 1472 1 2 . 1 1 114 114 ILE H H 114 8.721 8.721 8.817 -0.096 18387 1473 1 2 . 1 1 115 115 LEU N N 115 122.770 122.770 124.022 -1.252 18387 1474 1 2 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.526 -0.251 18387 1475 1 2 . 1 1 115 115 LEU C C 115 173.601 173.601 174.759 -1.158 18387 1476 1 2 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.108 0.674 18387 1477 1 2 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.280 0.854 18387 1478 1 2 . 1 1 115 115 LEU H H 115 8.665 8.665 8.807 -0.142 18387 1479 1 2 . 1 1 116 116 VAL N N 116 130.411 130.411 127.623 2.788 18387 1480 1 2 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.088 -0.230 18387 1481 1 2 . 1 1 116 116 VAL C C 116 174.565 174.565 175.293 -0.728 18387 1482 1 2 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.298 0.506 18387 1483 1 2 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.565 -0.650 18387 1484 1 2 . 1 1 116 116 VAL H H 116 9.472 9.472 9.196 0.276 18387 1485 1 2 . 1 1 117 117 ASP N N 117 127.896 127.896 126.699 1.197 18387 1486 1 2 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.552 -0.160 18387 1487 1 2 . 1 1 117 117 ASP C C 117 176.567 176.567 176.245 0.322 18387 1488 1 2 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.061 0.539 18387 1489 1 2 . 1 1 117 117 ASP CB C 117 40.584 40.584 39.953 0.631 18387 1490 1 2 . 1 1 117 117 ASP H H 117 9.429 9.429 8.636 0.793 18387 1491 1 2 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.031 0.163 18387 1492 1 2 . 1 1 118 118 PRO C C 118 177.534 177.534 177.873 -0.339 18387 1493 1 2 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.190 -0.025 18387 1494 1 2 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.729 1.084 18387 1495 1 2 . 1 1 119 119 GLU N N 119 114.015 114.015 117.305 -3.290 18387 1496 1 2 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.144 0.195 18387 1497 1 2 . 1 1 119 119 GLU C C 119 176.722 176.722 177.210 -0.488 18387 1498 1 2 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.138 -1.499 18387 1499 1 2 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.935 0.642 18387 1500 1 2 . 1 1 119 119 GLU H H 119 7.733 7.733 7.988 -0.255 18387 1501 1 2 . 1 1 120 120 GLY N N 120 108.218 108.218 108.568 -0.350 18387 1502 1 2 . 1 1 120 120 GLY C C 120 174.110 174.110 173.146 0.964 18387 1503 1 2 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.195 0.201 18387 1504 1 2 . 1 1 120 120 GLY H H 120 8.588 8.588 8.465 0.123 18387 1505 1 2 . 1 1 121 121 LYS N N 121 121.778 121.778 119.483 2.295 18387 1506 1 2 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.012 -0.153 18387 1507 1 2 . 1 1 121 121 LYS C C 121 176.458 176.458 175.540 0.918 18387 1508 1 2 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.371 0.591 18387 1509 1 2 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.817 -2.365 18387 1510 1 2 . 1 1 121 121 LYS H H 121 8.600 8.600 8.176 0.424 18387 1511 1 2 . 1 1 122 122 ILE N N 122 122.058 122.058 123.249 -1.191 18387 1512 1 2 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.337 -0.065 18387 1513 1 2 . 1 1 122 122 ILE C C 122 177.084 177.084 176.197 0.887 18387 1514 1 2 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.556 0.263 18387 1515 1 2 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.337 1.311 18387 1516 1 2 . 1 1 122 122 ILE H H 122 9.006 9.006 8.478 0.528 18387 1517 1 2 . 1 1 123 123 VAL N N 123 120.561 120.561 129.803 -9.242 18387 1518 1 2 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.143 0.612 18387 1519 1 2 . 1 1 123 123 VAL C C 123 175.584 175.584 174.586 0.998 18387 1520 1 2 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.158 -1.007 18387 1521 1 2 . 1 1 123 123 VAL CB C 123 33.401 33.401 33.077 0.324 18387 1522 1 2 . 1 1 123 123 VAL H H 123 9.054 9.054 8.836 0.218 18387 1523 1 2 . 1 1 124 124 ALA N N 124 121.102 121.102 120.861 0.241 18387 1524 1 2 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.752 -0.095 18387 1525 1 2 . 1 1 124 124 ALA C C 124 174.832 174.832 174.716 0.116 18387 1526 1 2 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.552 0.908 18387 1527 1 2 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.505 1.325 18387 1528 1 2 . 1 1 124 124 ALA H H 124 7.793 7.793 7.428 0.365 18387 1529 1 2 . 1 1 125 125 LYS N N 125 117.637 117.637 118.545 -0.908 18387 1530 1 2 . 1 1 125 125 LYS HA H 125 5.033 5.033 5.151 -0.118 18387 1531 1 2 . 1 1 125 125 LYS C C 125 173.417 173.417 175.755 -2.338 18387 1532 1 2 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.170 -0.029 18387 1533 1 2 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.863 0.788 18387 1534 1 2 . 1 1 125 125 LYS H H 125 8.872 8.872 8.215 0.657 18387 1535 1 2 . 1 1 126 126 GLU N N 126 115.236 115.236 114.614 0.622 18387 1536 1 2 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.912 0.086 18387 1537 1 2 . 1 1 126 126 GLU C C 126 175.998 175.998 175.486 0.512 18387 1538 1 2 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.627 -0.665 18387 1539 1 2 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.217 -0.782 18387 1540 1 2 . 1 1 126 126 GLU H H 126 7.941 7.941 8.443 -0.502 18387 1541 1 2 . 1 1 127 127 LEU N N 127 118.584 118.584 119.541 -0.957 18387 1542 1 2 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.129 0.253 18387 1543 1 2 . 1 1 127 127 LEU C C 127 176.766 176.766 176.364 0.402 18387 1544 1 2 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.651 -1.042 18387 1545 1 2 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.286 1.677 18387 1546 1 2 . 1 1 127 127 LEU H H 127 7.300 7.300 7.159 0.141 18387 1547 1 2 . 1 1 128 128 ARG N N 128 118.625 118.625 120.975 -2.350 18387 1548 1 2 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.843 -0.368 18387 1549 1 2 . 1 1 128 128 ARG C C 128 177.113 177.113 177.095 0.018 18387 1550 1 2 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.180 -0.790 18387 1551 1 2 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.254 1.358 18387 1552 1 2 . 1 1 128 128 ARG H H 128 7.929 7.929 8.076 -0.147 18387 1553 1 2 . 1 1 129 129 GLY N N 129 114.010 114.010 113.844 0.166 18387 1554 1 2 . 1 1 129 129 GLY C C 129 175.931 175.931 174.769 1.162 18387 1555 1 2 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.132 -1.671 18387 1556 1 2 . 1 1 129 129 GLY H H 129 10.649 10.649 9.623 1.026 18387 1557 1 2 . 1 1 130 130 ASP N N 130 123.975 123.975 121.980 1.995 18387 1558 1 2 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.478 0.054 18387 1559 1 2 . 1 1 130 130 ASP C C 130 177.507 177.507 177.907 -0.400 18387 1560 1 2 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.677 0.695 18387 1561 1 2 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.274 0.629 18387 1562 1 2 . 1 1 130 130 ASP H H 130 8.540 8.540 8.463 0.077 18387 1563 1 2 . 1 1 131 131 ASP N N 131 116.806 116.806 120.932 -4.126 18387 1564 1 2 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.549 0.021 18387 1565 1 2 . 1 1 131 131 ASP C C 131 179.038 179.038 178.633 0.405 18387 1566 1 2 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.266 0.717 18387 1567 1 2 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.911 0.023 18387 1568 1 2 . 1 1 131 131 ASP H H 131 7.907 7.907 8.271 -0.364 18387 1569 1 2 . 1 1 132 132 LEU N N 132 123.869 123.869 120.881 2.988 18387 1570 1 2 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.868 -0.077 18387 1571 1 2 . 1 1 132 132 LEU C C 132 176.343 176.343 178.461 -2.118 18387 1572 1 2 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.466 1.318 18387 1573 1 2 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.412 0.356 18387 1574 1 2 . 1 1 132 132 LEU H H 132 7.542 7.542 7.582 -0.040 18387 1575 1 2 . 1 1 133 133 TYR N N 133 120.042 120.042 118.637 1.405 18387 1576 1 2 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.179 -0.183 18387 1577 1 2 . 1 1 133 133 TYR C C 133 177.426 177.426 177.641 -0.215 18387 1578 1 2 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.912 0.221 18387 1579 1 2 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.390 0.186 18387 1580 1 2 . 1 1 133 133 TYR H H 133 7.384 7.384 7.742 -0.358 18387 1581 1 2 . 1 1 134 134 ASN N N 134 114.936 114.936 117.077 -2.141 18387 1582 1 2 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.584 -0.181 18387 1583 1 2 . 1 1 134 134 ASN C C 134 178.703 178.703 178.135 0.568 18387 1584 1 2 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.551 -0.742 18387 1585 1 2 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.022 0.186 18387 1586 1 2 . 1 1 134 134 ASN H H 134 8.399 8.399 8.811 -0.412 18387 1587 1 2 . 1 1 135 135 THR N N 135 117.387 117.387 117.547 -0.160 18387 1588 1 2 . 1 1 135 135 THR HA H 135 3.920 3.920 4.174 -0.254 18387 1589 1 2 . 1 1 135 135 THR C C 135 175.323 175.323 176.081 -0.758 18387 1590 1 2 . 1 1 135 135 THR CA C 135 67.402 67.402 67.135 0.268 18387 1591 1 2 . 1 1 135 135 THR CB C 135 68.111 68.111 68.829 -0.718 18387 1592 1 2 . 1 1 135 135 THR H H 135 8.265 8.265 8.419 -0.154 18387 1593 1 2 . 1 1 136 136 VAL N N 136 121.207 121.207 121.674 -0.467 18387 1594 1 2 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.212 -0.197 18387 1595 1 2 . 1 1 136 136 VAL C C 136 176.457 176.457 177.201 -0.744 18387 1596 1 2 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.371 1.901 18387 1597 1 2 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.445 0.496 18387 1598 1 2 . 1 1 136 136 VAL H H 136 7.595 7.595 7.298 0.297 18387 1599 1 2 . 1 1 137 137 GLU N N 137 118.266 118.266 119.042 -0.776 18387 1600 1 2 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.014 -1.332 18387 1601 1 2 . 1 1 137 137 GLU C C 137 177.482 177.482 177.959 -0.477 18387 1602 1 2 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.027 0.903 18387 1603 1 2 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.307 0.475 18387 1604 1 2 . 1 1 137 137 GLU H H 137 8.114 8.114 8.080 0.034 18387 1605 1 2 . 1 1 138 138 LYS N N 138 116.431 116.431 118.641 -2.210 18387 1606 1 2 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.910 -0.142 18387 1607 1 2 . 1 1 138 138 LYS C C 138 179.193 179.193 178.815 0.378 18387 1608 1 2 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.456 -0.416 18387 1609 1 2 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.440 -0.281 18387 1610 1 2 . 1 1 138 138 LYS H H 138 7.133 7.133 7.558 -0.425 18387 1611 1 2 . 1 1 139 139 PHE N N 139 116.336 116.336 116.673 -0.337 18387 1612 1 2 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.386 -0.376 18387 1613 1 2 . 1 1 139 139 PHE C C 139 177.855 177.855 177.786 0.069 18387 1614 1 2 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.827 0.557 18387 1615 1 2 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.711 -0.359 18387 1616 1 2 . 1 1 139 139 PHE H H 139 7.338 7.338 8.147 -0.809 18387 1617 1 2 . 1 1 140 140 VAL N N 140 116.491 116.491 117.757 -1.266 18387 1618 1 2 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.240 0.284 18387 1619 1 2 . 1 1 140 140 VAL C C 140 177.747 177.747 177.598 0.149 18387 1620 1 2 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.624 -0.382 18387 1621 1 2 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.470 -0.080 18387 1622 1 2 . 1 1 140 140 VAL H H 140 8.332 8.332 8.013 0.319 18387 1623 1 2 . 1 1 141 141 ASN N N 141 116.956 116.956 117.451 -0.495 18387 1624 1 2 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.544 0.282 18387 1625 1 2 . 1 1 141 141 ASN C C 141 176.997 176.997 175.676 1.321 18387 1626 1 2 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.473 -0.796 18387 1627 1 2 . 1 1 141 141 ASN CB C 141 38.448 38.448 38.783 -0.335 18387 1628 1 2 . 1 1 141 141 ASN H H 141 7.862 7.862 7.594 0.268 18387 1629 1 2 . 1 1 142 142 GLY N N 142 107.938 107.938 106.441 1.497 18387 1630 1 2 . 1 1 142 142 GLY C C 142 174.336 174.336 173.091 1.245 18387 1631 1 2 . 1 1 142 142 GLY CA C 142 45.985 45.985 43.807 2.178 18387 1632 1 2 . 1 1 142 142 GLY H H 142 7.466 7.466 7.596 -0.130 18387 1633 1 2 . 1 1 143 143 ALA N N 143 123.441 123.441 122.879 0.562 18387 1634 1 2 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.190 0.151 18387 1635 1 2 . 1 1 143 143 ALA C C 143 178.212 178.212 176.623 1.589 18387 1636 1 2 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.078 0.748 18387 1637 1 2 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.254 0.990 18387 1638 1 2 . 1 1 143 143 ALA H H 143 7.950 7.950 8.355 -0.405 18387 1639 1 2 . 1 1 144 144 LYS N N 144 120.149 120.149 124.560 -4.411 18387 1640 1 2 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.471 -0.176 18387 1641 1 2 . 1 1 144 144 LYS C C 144 176.945 176.945 175.965 0.980 18387 1642 1 2 . 1 1 144 144 LYS CA C 144 56.519 56.519 54.383 2.136 18387 1643 1 2 . 1 1 144 144 LYS CB C 144 33.030 33.030 34.206 -1.176 18387 1644 1 2 . 1 1 144 144 LYS H H 144 8.187 8.187 7.595 0.592 18387 1645 1 2 . 1 1 145 145 GLU N N 145 120.992 120.992 122.591 -1.599 18387 1646 1 2 . 1 1 145 145 GLU HA H 145 4.295 4.295 3.840 0.455 18387 1647 1 2 . 1 1 145 145 GLU C C 145 177.116 177.116 176.656 0.460 18387 1648 1 2 . 1 1 145 145 GLU CA C 145 56.903 56.903 57.966 -1.063 18387 1649 1 2 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.333 1.909 18387 1650 1 2 . 1 1 145 145 GLU H H 145 8.363 8.363 9.252 -0.889 18387 1651 1 2 . 1 1 146 146 GLY N N 146 109.467 109.467 106.402 3.065 18387 1652 1 2 . 1 1 146 146 GLY C C 146 174.108 174.108 174.600 -0.492 18387 1653 1 2 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.242 0.159 18387 1654 1 2 . 1 1 146 146 GLY H H 146 8.371 8.371 8.213 0.158 18387 1655 1 2 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.338 0.271 18387 1656 1 2 . 1 1 151 151 HIS C C 151 174.258 174.258 175.406 -1.148 18387 1657 1 2 . 1 1 151 151 HIS CA C 151 56.165 56.165 57.824 -1.659 18387 1658 1 2 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.570 0.263 18387 1659 1 3 . 1 1 2 2 SER HA H 2 3.992 3.992 4.808 -0.816 18387 1660 1 3 . 1 1 2 2 SER CA C 2 57.555 57.555 57.775 -0.220 18387 1661 1 3 . 1 1 2 2 SER CB C 2 64.977 64.977 64.965 0.012 18387 1662 1 3 . 1 1 3 3 LEU HA H 3 4.439 4.439 3.925 0.514 18387 1663 1 3 . 1 1 3 3 LEU C C 3 176.631 176.631 175.465 1.166 18387 1664 1 3 . 1 1 3 3 LEU CA C 3 54.564 54.564 55.310 -0.746 18387 1665 1 3 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.028 0.696 18387 1666 1 3 . 1 1 4 4 ALA N N 4 125.483 125.483 124.049 1.434 18387 1667 1 3 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.595 -0.216 18387 1668 1 3 . 1 1 4 4 ALA C C 4 179.642 179.642 176.154 3.488 18387 1669 1 3 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.235 0.500 18387 1670 1 3 . 1 1 4 4 ALA CB C 4 19.752 19.752 22.097 -2.345 18387 1671 1 3 . 1 1 4 4 ALA H H 4 8.483 8.483 8.011 0.472 18387 1672 1 3 . 1 1 5 5 THR HA H 5 3.845 3.845 4.454 -0.609 18387 1673 1 3 . 1 1 5 5 THR C C 5 175.487 175.487 175.979 -0.492 18387 1674 1 3 . 1 1 5 5 THR CA C 5 64.531 64.531 63.174 1.357 18387 1675 1 3 . 1 1 5 5 THR CB C 5 68.108 68.108 68.308 -0.200 18387 1676 1 3 . 1 1 6 6 GLY N N 6 114.298 114.298 115.482 -1.184 18387 1677 1 3 . 1 1 6 6 GLY C C 6 174.324 174.324 173.824 0.500 18387 1678 1 3 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.725 0.110 18387 1679 1 3 . 1 1 6 6 GLY H H 6 9.511 9.511 9.146 0.365 18387 1680 1 3 . 1 1 7 7 SER N N 7 115.270 115.270 116.928 -1.658 18387 1681 1 3 . 1 1 7 7 SER HA H 7 4.500 4.500 4.579 -0.079 18387 1682 1 3 . 1 1 7 7 SER C C 7 173.315 173.315 174.504 -1.189 18387 1683 1 3 . 1 1 7 7 SER CA C 7 58.915 58.915 58.093 0.822 18387 1684 1 3 . 1 1 7 7 SER CB C 7 64.308 64.308 64.574 -0.266 18387 1685 1 3 . 1 1 7 7 SER H H 7 7.736 7.736 7.851 -0.115 18387 1686 1 3 . 1 1 8 8 VAL N N 8 123.708 123.708 124.946 -1.238 18387 1687 1 3 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.216 -0.384 18387 1688 1 3 . 1 1 8 8 VAL C C 8 176.673 176.673 175.641 1.032 18387 1689 1 3 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.986 0.687 18387 1690 1 3 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.375 -0.153 18387 1691 1 3 . 1 1 8 8 VAL H H 8 8.632 8.632 8.463 0.169 18387 1692 1 3 . 1 1 9 9 ALA N N 9 133.040 133.040 130.734 2.306 18387 1693 1 3 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.556 -0.293 18387 1694 1 3 . 1 1 9 9 ALA C C 9 175.404 175.404 175.388 0.016 18387 1695 1 3 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.792 1.163 18387 1696 1 3 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.637 -0.607 18387 1697 1 3 . 1 1 9 9 ALA H H 9 8.448 8.448 8.408 0.040 18387 1698 1 3 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.429 -0.098 18387 1699 1 3 . 1 1 10 10 PRO C C 10 175.071 175.071 176.257 -1.186 18387 1700 1 3 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.649 -0.008 18387 1701 1 3 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.511 -0.187 18387 1702 1 3 . 1 1 11 11 ALA N N 11 124.172 124.172 124.722 -0.550 18387 1703 1 3 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.323 -0.079 18387 1704 1 3 . 1 1 11 11 ALA C C 11 177.688 177.688 176.896 0.792 18387 1705 1 3 . 1 1 11 11 ALA CA C 11 53.621 53.621 52.332 1.289 18387 1706 1 3 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.620 -0.293 18387 1707 1 3 . 1 1 11 11 ALA H H 11 8.221 8.221 8.263 -0.042 18387 1708 1 3 . 1 1 12 12 ILE N N 12 117.815 117.815 122.836 -5.021 18387 1709 1 3 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.295 0.033 18387 1710 1 3 . 1 1 12 12 ILE C C 12 175.013 175.013 175.451 -0.438 18387 1711 1 3 . 1 1 12 12 ILE CA C 12 62.166 62.166 59.685 2.481 18387 1712 1 3 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.719 5.571 18387 1713 1 3 . 1 1 12 12 ILE H H 12 7.693 7.693 8.166 -0.473 18387 1714 1 3 . 1 1 13 13 THR N N 13 121.186 121.186 123.287 -2.101 18387 1715 1 3 . 1 1 13 13 THR HA H 13 4.840 4.840 4.930 -0.090 18387 1716 1 3 . 1 1 13 13 THR C C 13 172.625 172.625 173.751 -1.126 18387 1717 1 3 . 1 1 13 13 THR CA C 13 62.297 62.297 61.290 1.007 18387 1718 1 3 . 1 1 13 13 THR CB C 13 71.585 71.585 69.007 2.579 18387 1719 1 3 . 1 1 13 13 THR H H 13 8.363 8.363 8.855 -0.492 18387 1720 1 3 . 1 1 14 14 GLY N N 14 110.785 110.785 111.901 -1.116 18387 1721 1 3 . 1 1 14 14 GLY C C 14 170.040 170.040 172.111 -2.071 18387 1722 1 3 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.148 1.242 18387 1723 1 3 . 1 1 14 14 GLY H H 14 7.993 7.993 9.137 -1.144 18387 1724 1 3 . 1 1 15 15 ILE N N 15 119.088 119.088 123.028 -3.940 18387 1725 1 3 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.530 0.595 18387 1726 1 3 . 1 1 15 15 ILE C C 15 176.359 176.359 175.573 0.786 18387 1727 1 3 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.349 -2.735 18387 1728 1 3 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.508 0.132 18387 1729 1 3 . 1 1 15 15 ILE H H 15 7.973 7.973 8.883 -0.910 18387 1730 1 3 . 1 1 16 16 ASP N N 16 126.633 126.633 127.508 -0.875 18387 1731 1 3 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.177 0.672 18387 1732 1 3 . 1 1 16 16 ASP C C 16 179.190 179.190 178.024 1.166 18387 1733 1 3 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.613 -0.733 18387 1734 1 3 . 1 1 16 16 ASP CB C 16 42.275 42.275 43.146 -0.871 18387 1735 1 3 . 1 1 16 16 ASP H H 16 9.335 9.335 9.148 0.187 18387 1736 1 3 . 1 1 17 17 LEU N N 17 116.648 116.648 120.696 -4.048 18387 1737 1 3 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.374 -0.200 18387 1738 1 3 . 1 1 17 17 LEU C C 17 178.432 178.432 178.332 0.100 18387 1739 1 3 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.941 0.041 18387 1740 1 3 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.543 1.443 18387 1741 1 3 . 1 1 17 17 LEU H H 17 8.071 8.071 9.094 -1.023 18387 1742 1 3 . 1 1 18 18 LYS N N 18 117.401 117.401 119.022 -1.621 18387 1743 1 3 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.382 0.127 18387 1744 1 3 . 1 1 18 18 LYS C C 18 176.793 176.793 177.144 -0.351 18387 1745 1 3 . 1 1 18 18 LYS CA C 18 55.435 55.435 56.547 -1.112 18387 1746 1 3 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.904 0.159 18387 1747 1 3 . 1 1 18 18 LYS H H 18 8.207 8.207 8.624 -0.417 18387 1748 1 3 . 1 1 19 19 GLY N N 19 108.061 108.061 108.062 -0.001 18387 1749 1 3 . 1 1 19 19 GLY C C 19 174.649 174.649 173.933 0.716 18387 1750 1 3 . 1 1 19 19 GLY CA C 19 45.597 45.597 45.144 0.453 18387 1751 1 3 . 1 1 19 19 GLY H H 19 8.099 8.099 8.405 -0.306 18387 1752 1 3 . 1 1 20 20 ASN N N 20 121.012 121.012 119.299 1.713 18387 1753 1 3 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.832 0.073 18387 1754 1 3 . 1 1 20 20 ASN C C 20 174.827 174.827 174.278 0.549 18387 1755 1 3 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.600 -0.133 18387 1756 1 3 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.451 -0.775 18387 1757 1 3 . 1 1 20 20 ASN H H 20 8.945 8.945 7.870 1.075 18387 1758 1 3 . 1 1 21 21 SER N N 21 117.285 117.285 118.939 -1.654 18387 1759 1 3 . 1 1 21 21 SER HA H 21 5.000 5.000 4.604 0.396 18387 1760 1 3 . 1 1 21 21 SER C C 21 174.911 174.911 174.046 0.865 18387 1761 1 3 . 1 1 21 21 SER CA C 21 58.730 58.730 58.329 0.401 18387 1762 1 3 . 1 1 21 21 SER CB C 21 63.162 63.162 63.302 -0.140 18387 1763 1 3 . 1 1 21 21 SER H H 21 8.740 8.740 8.731 0.009 18387 1764 1 3 . 1 1 22 22 VAL N N 22 128.665 128.665 128.655 0.010 18387 1765 1 3 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.413 -0.033 18387 1766 1 3 . 1 1 22 22 VAL C C 22 176.276 176.276 174.792 1.484 18387 1767 1 3 . 1 1 22 22 VAL CA C 22 62.953 62.953 60.991 1.962 18387 1768 1 3 . 1 1 22 22 VAL CB C 22 35.582 35.582 35.645 -0.063 18387 1769 1 3 . 1 1 22 22 VAL H H 22 9.125 9.125 9.107 0.018 18387 1770 1 3 . 1 1 23 23 SER N N 23 127.457 127.457 118.224 9.233 18387 1771 1 3 . 1 1 23 23 SER HA H 23 5.878 5.878 5.919 -0.041 18387 1772 1 3 . 1 1 23 23 SER C C 23 174.436 174.436 176.375 -1.939 18387 1773 1 3 . 1 1 23 23 SER CA C 23 57.101 57.101 56.086 1.015 18387 1774 1 3 . 1 1 23 23 SER CB C 23 66.078 66.078 64.907 1.171 18387 1775 1 3 . 1 1 23 23 SER H H 23 8.971 8.971 8.481 0.490 18387 1776 1 3 . 1 1 24 24 LEU N N 24 126.734 126.734 118.712 8.022 18387 1777 1 3 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.983 -0.516 18387 1778 1 3 . 1 1 24 24 LEU C C 24 179.852 179.852 177.583 2.269 18387 1779 1 3 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.342 0.861 18387 1780 1 3 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.227 0.751 18387 1781 1 3 . 1 1 24 24 LEU H H 24 8.450 8.450 8.082 0.368 18387 1782 1 3 . 1 1 25 25 ASN N N 25 115.642 115.642 117.689 -2.047 18387 1783 1 3 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.441 -0.199 18387 1784 1 3 . 1 1 25 25 ASN C C 25 176.246 176.246 177.118 -0.872 18387 1785 1 3 . 1 1 25 25 ASN CA C 25 55.370 55.370 54.876 0.494 18387 1786 1 3 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.045 1.726 18387 1787 1 3 . 1 1 25 25 ASN H H 25 8.505 8.505 8.607 -0.102 18387 1788 1 3 . 1 1 26 26 ASP N N 26 119.722 119.722 120.110 -0.388 18387 1789 1 3 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.253 -0.048 18387 1790 1 3 . 1 1 26 26 ASP C C 26 176.708 176.708 176.313 0.395 18387 1791 1 3 . 1 1 26 26 ASP CA C 26 56.525 56.525 57.080 -0.555 18387 1792 1 3 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.291 -1.011 18387 1793 1 3 . 1 1 26 26 ASP H H 26 7.731 7.731 7.797 -0.066 18387 1794 1 3 . 1 1 27 27 PHE N N 27 116.827 116.827 114.345 2.482 18387 1795 1 3 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.552 -0.072 18387 1796 1 3 . 1 1 27 27 PHE C C 27 174.227 174.227 175.668 -1.441 18387 1797 1 3 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.312 -0.241 18387 1798 1 3 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.269 0.450 18387 1799 1 3 . 1 1 27 27 PHE H H 27 7.390 7.390 7.367 0.023 18387 1800 1 3 . 1 1 28 28 LYS N N 28 120.357 120.357 122.076 -1.719 18387 1801 1 3 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.058 0.329 18387 1802 1 3 . 1 1 28 28 LYS C C 28 177.845 177.845 177.359 0.486 18387 1803 1 3 . 1 1 28 28 LYS CA C 28 58.002 58.002 58.067 -0.065 18387 1804 1 3 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.768 -0.224 18387 1805 1 3 . 1 1 28 28 LYS H H 28 6.883 6.883 7.360 -0.477 18387 1806 1 3 . 1 1 29 29 GLY N N 29 112.653 112.653 111.360 1.293 18387 1807 1 3 . 1 1 29 29 GLY C C 29 173.799 173.799 173.484 0.315 18387 1808 1 3 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.959 0.029 18387 1809 1 3 . 1 1 29 29 GLY H H 29 8.930 8.930 8.472 0.458 18387 1810 1 3 . 1 1 30 30 LYS N N 30 120.516 120.516 117.954 2.562 18387 1811 1 3 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.561 0.074 18387 1812 1 3 . 1 1 30 30 LYS C C 30 176.505 176.505 175.005 1.500 18387 1813 1 3 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.414 0.766 18387 1814 1 3 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.819 -0.962 18387 1815 1 3 . 1 1 30 30 LYS H H 30 8.098 8.098 7.335 0.763 18387 1816 1 3 . 1 1 31 31 TYR N N 31 117.383 117.383 120.397 -3.014 18387 1817 1 3 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.899 -0.245 18387 1818 1 3 . 1 1 31 31 TYR C C 31 175.551 175.551 175.820 -0.269 18387 1819 1 3 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.709 1.456 18387 1820 1 3 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.587 2.606 18387 1821 1 3 . 1 1 31 31 TYR H H 31 8.263 8.263 8.755 -0.492 18387 1822 1 3 . 1 1 32 32 VAL N N 32 120.900 120.900 125.178 -4.278 18387 1823 1 3 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.777 -0.338 18387 1824 1 3 . 1 1 32 32 VAL C C 32 175.975 175.975 174.664 1.311 18387 1825 1 3 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.736 -1.030 18387 1826 1 3 . 1 1 32 32 VAL CB C 32 35.507 35.507 33.572 1.935 18387 1827 1 3 . 1 1 32 32 VAL H H 32 9.244 9.244 8.820 0.424 18387 1828 1 3 . 1 1 33 33 LEU N N 33 130.058 130.058 130.536 -0.478 18387 1829 1 3 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.264 -0.091 18387 1830 1 3 . 1 1 33 33 LEU C C 33 174.693 174.693 175.447 -0.754 18387 1831 1 3 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.192 0.156 18387 1832 1 3 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.585 0.736 18387 1833 1 3 . 1 1 33 33 LEU H H 33 8.161 8.161 8.569 -0.408 18387 1834 1 3 . 1 1 34 34 VAL N N 34 129.232 129.232 128.940 0.292 18387 1835 1 3 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.797 0.185 18387 1836 1 3 . 1 1 34 34 VAL C C 34 174.285 174.285 174.690 -0.405 18387 1837 1 3 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.801 -0.295 18387 1838 1 3 . 1 1 34 34 VAL CB C 34 32.378 32.378 33.113 -0.735 18387 1839 1 3 . 1 1 34 34 VAL H H 34 9.296 9.296 9.144 0.152 18387 1840 1 3 . 1 1 35 35 ASP N N 35 123.675 123.675 127.406 -3.731 18387 1841 1 3 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.402 -0.053 18387 1842 1 3 . 1 1 35 35 ASP C C 35 174.258 174.258 174.665 -0.407 18387 1843 1 3 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.119 -1.065 18387 1844 1 3 . 1 1 35 35 ASP CB C 35 40.462 40.462 44.635 -4.173 18387 1845 1 3 . 1 1 35 35 ASP H H 35 8.015 8.015 8.689 -0.674 18387 1846 1 3 . 1 1 36 36 PHE N N 36 126.959 126.959 124.727 2.232 18387 1847 1 3 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.683 0.252 18387 1848 1 3 . 1 1 36 36 PHE C C 36 175.432 175.432 174.856 0.576 18387 1849 1 3 . 1 1 36 36 PHE CA C 36 58.095 58.095 56.765 1.330 18387 1850 1 3 . 1 1 36 36 PHE CB C 36 40.030 40.030 41.205 -1.175 18387 1851 1 3 . 1 1 36 36 PHE H H 36 9.171 9.171 8.546 0.625 18387 1852 1 3 . 1 1 37 37 TRP N N 37 120.839 120.839 121.106 -0.267 18387 1853 1 3 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.050 0.707 18387 1854 1 3 . 1 1 37 37 TRP C C 37 172.412 172.412 173.029 -0.617 18387 1855 1 3 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.909 0.000 18387 1856 1 3 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.545 0.134 18387 1857 1 3 . 1 1 37 37 TRP H H 37 9.280 9.280 8.640 0.640 18387 1858 1 3 . 1 1 38 38 PHE N N 38 109.215 109.215 112.296 -3.081 18387 1859 1 3 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.782 -0.849 18387 1860 1 3 . 1 1 38 38 PHE C C 38 176.141 176.141 175.170 0.971 18387 1861 1 3 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.928 0.083 18387 1862 1 3 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.614 -0.995 18387 1863 1 3 . 1 1 38 38 PHE H H 38 7.062 7.062 8.384 -1.322 18387 1864 1 3 . 1 1 39 39 ALA N N 39 125.193 125.193 123.884 1.309 18387 1865 1 3 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.080 -0.015 18387 1866 1 3 . 1 1 39 39 ALA C C 39 179.349 179.349 178.889 0.460 18387 1867 1 3 . 1 1 39 39 ALA CA C 39 56.064 56.064 55.298 0.766 18387 1868 1 3 . 1 1 39 39 ALA CB C 39 19.897 19.897 19.015 0.882 18387 1869 1 3 . 1 1 39 39 ALA H H 39 10.355 10.355 9.504 0.851 18387 1870 1 3 . 1 1 40 40 GLY N N 40 103.437 103.437 107.907 -4.470 18387 1871 1 3 . 1 1 40 40 GLY C C 40 172.732 172.732 174.678 -1.946 18387 1872 1 3 . 1 1 40 40 GLY CA C 40 44.936 44.936 46.939 -2.003 18387 1873 1 3 . 1 1 40 40 GLY H H 40 8.583 8.583 8.671 -0.088 18387 1874 1 3 . 1 1 41 41 CYS N N 41 124.859 124.859 122.681 2.178 18387 1875 1 3 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.461 -0.057 18387 1876 1 3 . 1 1 41 41 CYS C C 41 176.620 176.620 175.790 0.830 18387 1877 1 3 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.424 0.951 18387 1878 1 3 . 1 1 41 41 CYS CB C 41 28.376 28.376 25.526 2.850 18387 1879 1 3 . 1 1 41 41 CYS H H 41 6.946 6.946 6.597 0.349 18387 1880 1 3 . 1 1 42 42 SER HA H 42 4.040 4.040 4.191 -0.151 18387 1881 1 3 . 1 1 42 42 SER CA C 42 61.552 61.552 60.761 0.791 18387 1882 1 3 . 1 1 42 42 SER CB C 42 62.675 62.675 63.245 -0.570 18387 1883 1 3 . 1 1 43 43 TRP N N 43 129.748 129.748 121.857 7.891 18387 1884 1 3 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.546 0.003 18387 1885 1 3 . 1 1 43 43 TRP C C 43 180.400 180.400 178.662 1.738 18387 1886 1 3 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.636 1.613 18387 1887 1 3 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.266 0.326 18387 1888 1 3 . 1 1 44 44 CYS N N 44 124.462 124.462 118.336 6.126 18387 1889 1 3 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.287 -0.036 18387 1890 1 3 . 1 1 44 44 CYS C C 44 178.643 178.643 177.015 1.628 18387 1891 1 3 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.986 1.863 18387 1892 1 3 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.109 2.313 18387 1893 1 3 . 1 1 44 44 CYS H H 44 9.591 9.591 7.861 1.730 18387 1894 1 3 . 1 1 45 45 ARG N N 45 117.248 117.248 118.255 -1.007 18387 1895 1 3 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.196 -0.020 18387 1896 1 3 . 1 1 45 45 ARG C C 45 180.302 180.302 178.167 2.135 18387 1897 1 3 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.945 -1.002 18387 1898 1 3 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.762 -2.131 18387 1899 1 3 . 1 1 45 45 ARG H H 45 7.955 7.955 7.804 0.151 18387 1900 1 3 . 1 1 46 46 LYS N N 46 120.318 120.318 118.870 1.448 18387 1901 1 3 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.202 0.070 18387 1902 1 3 . 1 1 46 46 LYS C C 46 177.755 177.755 177.482 0.273 18387 1903 1 3 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.641 1.128 18387 1904 1 3 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.072 1.085 18387 1905 1 3 . 1 1 46 46 LYS H H 46 8.129 8.129 7.492 0.637 18387 1906 1 3 . 1 1 47 47 GLU N N 47 114.278 114.278 116.948 -2.670 18387 1907 1 3 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.924 -0.033 18387 1908 1 3 . 1 1 47 47 GLU C C 47 178.701 178.701 177.755 0.946 18387 1909 1 3 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.330 -0.776 18387 1910 1 3 . 1 1 47 47 GLU CB C 47 29.766 29.766 30.419 -0.653 18387 1911 1 3 . 1 1 47 47 GLU H H 47 7.386 7.386 7.654 -0.268 18387 1912 1 3 . 1 1 48 48 THR N N 48 115.665 115.665 117.791 -2.126 18387 1913 1 3 . 1 1 48 48 THR HA H 48 4.048 4.048 4.319 -0.271 18387 1914 1 3 . 1 1 48 48 THR C C 48 172.392 172.392 174.452 -2.060 18387 1915 1 3 . 1 1 48 48 THR CA C 48 69.426 69.426 68.719 0.707 18387 1916 1 3 . 1 1 48 48 THR CB C 48 66.906 66.906 66.459 0.447 18387 1917 1 3 . 1 1 48 48 THR H H 48 7.810 7.810 7.678 0.132 18387 1918 1 3 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.239 0.050 18387 1919 1 3 . 1 1 49 49 PRO C C 49 179.828 179.828 178.599 1.229 18387 1920 1 3 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.235 0.364 18387 1921 1 3 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.210 -0.176 18387 1922 1 3 . 1 1 50 50 TYR N N 50 116.950 116.950 115.956 0.994 18387 1923 1 3 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.369 -0.231 18387 1924 1 3 . 1 1 50 50 TYR C C 50 179.488 179.488 178.409 1.079 18387 1925 1 3 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.372 -0.237 18387 1926 1 3 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.787 0.514 18387 1927 1 3 . 1 1 50 50 TYR H H 50 7.071 7.071 7.141 -0.070 18387 1928 1 3 . 1 1 51 51 LEU N N 51 123.989 123.989 120.876 3.113 18387 1929 1 3 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.939 -0.269 18387 1930 1 3 . 1 1 51 51 LEU C C 51 178.072 178.072 179.078 -1.006 18387 1931 1 3 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.071 0.605 18387 1932 1 3 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.564 1.053 18387 1933 1 3 . 1 1 51 51 LEU H H 51 8.243 8.243 8.426 -0.183 18387 1934 1 3 . 1 1 52 52 LEU N N 52 119.857 119.857 120.034 -0.177 18387 1935 1 3 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.325 0.002 18387 1936 1 3 . 1 1 52 52 LEU C C 52 178.704 178.704 178.607 0.097 18387 1937 1 3 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.572 0.004 18387 1938 1 3 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.716 1.022 18387 1939 1 3 . 1 1 52 52 LEU H H 52 9.085 9.085 8.653 0.432 18387 1940 1 3 . 1 1 53 53 LYS N N 53 118.658 118.658 118.997 -0.339 18387 1941 1 3 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.019 0.090 18387 1942 1 3 . 1 1 53 53 LYS C C 53 179.786 179.786 179.076 0.710 18387 1943 1 3 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.926 -0.205 18387 1944 1 3 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.309 0.850 18387 1945 1 3 . 1 1 53 53 LYS H H 53 7.807 7.807 8.010 -0.203 18387 1946 1 3 . 1 1 54 54 THR N N 54 116.869 116.869 116.590 0.279 18387 1947 1 3 . 1 1 54 54 THR HA H 54 3.965 3.965 4.413 -0.448 18387 1948 1 3 . 1 1 54 54 THR C C 54 175.328 175.328 176.852 -1.524 18387 1949 1 3 . 1 1 54 54 THR CA C 54 67.683 67.683 67.075 0.608 18387 1950 1 3 . 1 1 54 54 THR CB C 54 68.452 68.452 68.900 -0.448 18387 1951 1 3 . 1 1 54 54 THR H H 54 7.771 7.771 8.170 -0.399 18387 1952 1 3 . 1 1 55 55 TYR N N 55 122.202 122.202 122.969 -0.767 18387 1953 1 3 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.356 -0.084 18387 1954 1 3 . 1 1 55 55 TYR C C 55 176.809 176.809 177.469 -0.660 18387 1955 1 3 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.957 0.780 18387 1956 1 3 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.637 0.643 18387 1957 1 3 . 1 1 55 55 TYR H H 55 9.145 9.145 8.832 0.313 18387 1958 1 3 . 1 1 56 56 ASN N N 56 113.858 113.858 117.367 -3.509 18387 1959 1 3 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.519 -0.256 18387 1960 1 3 . 1 1 56 56 ASN C C 56 177.427 177.427 176.656 0.771 18387 1961 1 3 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.503 0.427 18387 1962 1 3 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.417 -0.463 18387 1963 1 3 . 1 1 56 56 ASN H H 56 8.850 8.850 8.524 0.326 18387 1964 1 3 . 1 1 57 57 ALA N N 57 118.829 118.829 120.186 -1.357 18387 1965 1 3 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.062 0.002 18387 1966 1 3 . 1 1 57 57 ALA C C 57 180.445 180.445 178.033 2.412 18387 1967 1 3 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.423 -0.072 18387 1968 1 3 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.493 -0.299 18387 1969 1 3 . 1 1 57 57 ALA H H 57 7.436 7.436 7.521 -0.085 18387 1970 1 3 . 1 1 58 58 PHE N N 58 112.082 112.082 115.391 -3.309 18387 1971 1 3 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.696 0.225 18387 1972 1 3 . 1 1 58 58 PHE C C 58 176.999 176.999 176.995 0.004 18387 1973 1 3 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.444 0.623 18387 1974 1 3 . 1 1 58 58 PHE CB C 58 40.490 40.490 38.541 1.949 18387 1975 1 3 . 1 1 58 58 PHE H H 58 7.480 7.480 8.250 -0.770 18387 1976 1 3 . 1 1 59 59 LYS N N 59 120.666 120.666 119.599 1.067 18387 1977 1 3 . 1 1 59 59 LYS HA H 59 4.803 4.803 3.874 0.929 18387 1978 1 3 . 1 1 59 59 LYS C C 59 177.157 177.157 176.423 0.734 18387 1979 1 3 . 1 1 59 59 LYS CA C 59 59.081 59.081 58.514 0.567 18387 1980 1 3 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.689 -1.121 18387 1981 1 3 . 1 1 59 59 LYS H H 59 8.411 8.411 7.595 0.816 18387 1982 1 3 . 1 1 60 60 ASP N N 60 118.908 118.908 116.300 2.608 18387 1983 1 3 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.780 0.345 18387 1984 1 3 . 1 1 60 60 ASP C C 60 176.889 176.889 176.060 0.829 18387 1985 1 3 . 1 1 60 60 ASP CA C 60 54.649 54.649 54.085 0.564 18387 1986 1 3 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.300 0.412 18387 1987 1 3 . 1 1 60 60 ASP H H 60 8.574 8.574 8.265 0.309 18387 1988 1 3 . 1 1 61 61 LYS N N 61 121.021 121.021 120.633 0.388 18387 1989 1 3 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.651 0.063 18387 1990 1 3 . 1 1 61 61 LYS C C 61 175.968 175.968 176.353 -0.385 18387 1991 1 3 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.661 -0.524 18387 1992 1 3 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.633 0.445 18387 1993 1 3 . 1 1 61 61 LYS H H 61 8.278 8.278 7.557 0.721 18387 1994 1 3 . 1 1 62 62 GLY C C 62 173.837 173.837 173.604 0.233 18387 1995 1 3 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.261 1.789 18387 1996 1 3 . 1 1 63 63 PHE N N 63 120.476 120.476 120.333 0.143 18387 1997 1 3 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.650 0.383 18387 1998 1 3 . 1 1 63 63 PHE C C 63 173.613 173.613 173.355 0.258 18387 1999 1 3 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.338 -0.488 18387 2000 1 3 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.723 -0.048 18387 2001 1 3 . 1 1 63 63 PHE H H 63 7.413 7.413 7.657 -0.244 18387 2002 1 3 . 1 1 64 64 THR N N 64 119.903 119.903 122.634 -2.731 18387 2003 1 3 . 1 1 64 64 THR HA H 64 4.097 4.097 4.803 -0.706 18387 2004 1 3 . 1 1 64 64 THR C C 64 170.397 170.397 172.785 -2.388 18387 2005 1 3 . 1 1 64 64 THR CA C 64 60.261 60.261 60.979 -0.718 18387 2006 1 3 . 1 1 64 64 THR CB C 64 69.507 69.507 72.046 -2.539 18387 2007 1 3 . 1 1 64 64 THR H H 64 7.665 7.665 8.479 -0.814 18387 2008 1 3 . 1 1 65 65 ILE N N 65 117.277 117.277 126.253 -8.976 18387 2009 1 3 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.195 0.281 18387 2010 1 3 . 1 1 65 65 ILE C C 65 173.056 173.056 175.100 -2.044 18387 2011 1 3 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.897 -1.189 18387 2012 1 3 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.427 1.418 18387 2013 1 3 . 1 1 65 65 ILE H H 65 7.321 7.321 8.882 -1.561 18387 2014 1 3 . 1 1 66 66 TYR N N 66 131.968 131.968 130.349 1.619 18387 2015 1 3 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.913 0.334 18387 2016 1 3 . 1 1 66 66 TYR C C 66 174.074 174.074 175.060 -0.986 18387 2017 1 3 . 1 1 66 66 TYR CA C 66 54.965 54.965 56.186 -1.221 18387 2018 1 3 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.633 1.484 18387 2019 1 3 . 1 1 66 66 TYR H H 66 9.038 9.038 9.120 -0.082 18387 2020 1 3 . 1 1 67 67 GLY N N 67 114.364 114.364 116.212 -1.848 18387 2021 1 3 . 1 1 67 67 GLY C C 67 172.461 172.461 172.538 -0.077 18387 2022 1 3 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.654 0.346 18387 2023 1 3 . 1 1 67 67 GLY H H 67 9.188 9.188 9.097 0.091 18387 2024 1 3 . 1 1 68 68 VAL N N 68 126.938 126.938 120.717 6.221 18387 2025 1 3 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.069 -0.933 18387 2026 1 3 . 1 1 68 68 VAL C C 68 173.822 173.822 173.613 0.209 18387 2027 1 3 . 1 1 68 68 VAL CA C 68 61.498 61.498 58.217 3.281 18387 2028 1 3 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.779 0.779 18387 2029 1 3 . 1 1 68 68 VAL H H 68 9.309 9.309 8.910 0.399 18387 2030 1 3 . 1 1 69 69 SER N N 69 118.813 118.813 120.349 -1.536 18387 2031 1 3 . 1 1 69 69 SER HA H 69 5.527 5.527 4.984 0.543 18387 2032 1 3 . 1 1 69 69 SER C C 69 175.753 175.753 173.540 2.213 18387 2033 1 3 . 1 1 69 69 SER CA C 69 54.407 54.407 55.226 -0.819 18387 2034 1 3 . 1 1 69 69 SER CB C 69 63.630 63.630 64.372 -0.742 18387 2035 1 3 . 1 1 69 69 SER H H 69 8.124 8.124 8.463 -0.339 18387 2036 1 3 . 1 1 70 70 THR N N 70 113.861 113.861 122.086 -8.225 18387 2037 1 3 . 1 1 70 70 THR HA H 70 4.381 4.381 4.286 0.095 18387 2038 1 3 . 1 1 70 70 THR C C 70 175.001 175.001 173.886 1.115 18387 2039 1 3 . 1 1 70 70 THR CA C 70 60.259 60.259 59.841 0.418 18387 2040 1 3 . 1 1 70 70 THR CB C 70 67.291 67.291 68.178 -0.887 18387 2041 1 3 . 1 1 70 70 THR H H 70 7.656 7.656 7.978 -0.322 18387 2042 1 3 . 1 1 71 71 ASP N N 71 125.133 125.133 122.311 2.822 18387 2043 1 3 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.531 -0.461 18387 2044 1 3 . 1 1 71 71 ASP C C 71 175.685 175.685 177.380 -1.695 18387 2045 1 3 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.697 2.915 18387 2046 1 3 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.092 0.277 18387 2047 1 3 . 1 1 71 71 ASP H H 71 8.931 8.931 7.174 1.757 18387 2048 1 3 . 1 1 72 72 ARG N N 72 118.814 118.814 119.326 -0.512 18387 2049 1 3 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.113 0.082 18387 2050 1 3 . 1 1 72 72 ARG C C 72 177.300 177.300 176.200 1.100 18387 2051 1 3 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.544 -1.735 18387 2052 1 3 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.914 0.197 18387 2053 1 3 . 1 1 72 72 ARG H H 72 8.057 8.057 8.655 -0.598 18387 2054 1 3 . 1 1 73 73 ARG N N 73 118.174 118.174 116.462 1.712 18387 2055 1 3 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.526 0.228 18387 2056 1 3 . 1 1 73 73 ARG C C 73 176.503 176.503 175.440 1.063 18387 2057 1 3 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.071 -0.535 18387 2058 1 3 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.653 -1.625 18387 2059 1 3 . 1 1 73 73 ARG H H 73 8.639 8.639 7.593 1.046 18387 2060 1 3 . 1 1 74 74 GLU N N 74 127.609 127.609 124.294 3.315 18387 2061 1 3 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.144 -0.065 18387 2062 1 3 . 1 1 74 74 GLU C C 74 178.107 178.107 177.822 0.285 18387 2063 1 3 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.675 -0.890 18387 2064 1 3 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.927 0.171 18387 2065 1 3 . 1 1 74 74 GLU H H 74 9.129 9.129 9.058 0.071 18387 2066 1 3 . 1 1 75 75 GLU N N 75 117.874 117.874 119.117 -1.243 18387 2067 1 3 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.114 -0.014 18387 2068 1 3 . 1 1 75 75 GLU C C 75 178.993 178.993 178.665 0.328 18387 2069 1 3 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.932 0.195 18387 2070 1 3 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.875 0.416 18387 2071 1 3 . 1 1 75 75 GLU H H 75 9.745 9.745 8.797 0.948 18387 2072 1 3 . 1 1 76 76 ASP N N 76 119.182 119.182 119.695 -0.513 18387 2073 1 3 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.454 -0.088 18387 2074 1 3 . 1 1 76 76 ASP C C 76 178.107 178.107 178.063 0.044 18387 2075 1 3 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.442 -0.469 18387 2076 1 3 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.559 -0.039 18387 2077 1 3 . 1 1 76 76 ASP H H 76 7.004 7.004 8.345 -1.341 18387 2078 1 3 . 1 1 77 77 TRP N N 77 123.008 123.008 122.556 0.452 18387 2079 1 3 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.358 -0.209 18387 2080 1 3 . 1 1 77 77 TRP C C 77 176.236 176.236 178.265 -2.029 18387 2081 1 3 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.964 -0.481 18387 2082 1 3 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.164 -0.629 18387 2083 1 3 . 1 1 77 77 TRP H H 77 7.112 7.112 8.578 -1.466 18387 2084 1 3 . 1 1 78 78 LYS N N 78 115.727 115.727 118.591 -2.864 18387 2085 1 3 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.246 -0.001 18387 2086 1 3 . 1 1 78 78 LYS C C 78 179.426 179.426 178.764 0.662 18387 2087 1 3 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.908 0.524 18387 2088 1 3 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.769 0.976 18387 2089 1 3 . 1 1 78 78 LYS H H 78 8.431 8.431 8.628 -0.197 18387 2090 1 3 . 1 1 79 79 LYS N N 79 118.321 118.321 119.488 -1.167 18387 2091 1 3 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.908 0.112 18387 2092 1 3 . 1 1 79 79 LYS C C 79 178.239 178.239 178.488 -0.249 18387 2093 1 3 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.383 -0.316 18387 2094 1 3 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.474 -0.011 18387 2095 1 3 . 1 1 79 79 LYS H H 79 7.690 7.690 7.933 -0.243 18387 2096 1 3 . 1 1 80 80 ALA N N 80 120.679 120.679 122.332 -1.653 18387 2097 1 3 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.139 0.016 18387 2098 1 3 . 1 1 80 80 ALA C C 80 178.811 178.811 179.623 -0.812 18387 2099 1 3 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.092 -0.005 18387 2100 1 3 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.434 0.324 18387 2101 1 3 . 1 1 80 80 ALA H H 80 7.560 7.560 8.128 -0.568 18387 2102 1 3 . 1 1 81 81 ILE N N 81 118.019 118.019 119.066 -1.047 18387 2103 1 3 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.436 -0.034 18387 2104 1 3 . 1 1 81 81 ILE C C 81 178.113 178.113 178.002 0.111 18387 2105 1 3 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.775 -0.255 18387 2106 1 3 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.334 0.869 18387 2107 1 3 . 1 1 81 81 ILE H H 81 7.514 7.514 8.020 -0.506 18387 2108 1 3 . 1 1 82 82 GLU N N 82 117.252 117.252 119.593 -2.341 18387 2109 1 3 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.811 0.283 18387 2110 1 3 . 1 1 82 82 GLU C C 82 179.558 179.558 178.619 0.939 18387 2111 1 3 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.635 -0.055 18387 2112 1 3 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.015 0.368 18387 2113 1 3 . 1 1 82 82 GLU H H 82 7.401 7.401 7.448 -0.047 18387 2114 1 3 . 1 1 83 83 GLU N N 83 119.340 119.340 118.919 0.421 18387 2115 1 3 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.934 -0.036 18387 2116 1 3 . 1 1 83 83 GLU C C 83 178.740 178.740 179.042 -0.302 18387 2117 1 3 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.025 -0.026 18387 2118 1 3 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.618 0.302 18387 2119 1 3 . 1 1 83 83 GLU H H 83 8.191 8.191 8.072 0.119 18387 2120 1 3 . 1 1 84 84 ASP N N 84 118.449 118.449 115.744 2.705 18387 2121 1 3 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.444 -0.170 18387 2122 1 3 . 1 1 84 84 ASP C C 84 175.597 175.597 175.435 0.162 18387 2123 1 3 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.622 0.425 18387 2124 1 3 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.910 -1.014 18387 2125 1 3 . 1 1 84 84 ASP H H 84 8.252 8.252 7.908 0.344 18387 2126 1 3 . 1 1 85 85 LYS N N 85 116.410 116.410 114.963 1.447 18387 2127 1 3 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.345 -0.172 18387 2128 1 3 . 1 1 85 85 LYS C C 85 176.856 176.856 175.345 1.511 18387 2129 1 3 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.216 -0.243 18387 2130 1 3 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.703 -0.835 18387 2131 1 3 . 1 1 85 85 LYS H H 85 7.890 7.890 7.220 0.670 18387 2132 1 3 . 1 1 86 86 SER N N 86 112.295 112.295 113.733 -1.438 18387 2133 1 3 . 1 1 86 86 SER HA H 86 3.139 3.139 3.504 -0.365 18387 2134 1 3 . 1 1 86 86 SER C C 86 175.805 175.805 173.395 2.410 18387 2135 1 3 . 1 1 86 86 SER CA C 86 53.637 53.637 56.589 -2.952 18387 2136 1 3 . 1 1 86 86 SER CB C 86 60.736 60.736 60.773 -0.037 18387 2137 1 3 . 1 1 86 86 SER H H 86 7.327 7.327 7.430 -0.103 18387 2138 1 3 . 1 1 87 87 TYR N N 87 120.962 120.962 125.862 -4.900 18387 2139 1 3 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.261 0.044 18387 2140 1 3 . 1 1 87 87 TYR C C 87 177.064 177.064 174.567 2.497 18387 2141 1 3 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.913 -0.690 18387 2142 1 3 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.633 -0.280 18387 2143 1 3 . 1 1 87 87 TYR H H 87 6.933 6.933 7.702 -0.769 18387 2144 1 3 . 1 1 88 88 TRP N N 88 118.597 118.597 120.489 -1.892 18387 2145 1 3 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.746 0.105 18387 2146 1 3 . 1 1 88 88 TRP C C 88 175.456 175.456 174.128 1.328 18387 2147 1 3 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.877 1.359 18387 2148 1 3 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.854 -4.127 18387 2149 1 3 . 1 1 88 88 TRP H H 88 6.552 6.552 7.220 -0.668 18387 2150 1 3 . 1 1 89 89 ASN N N 89 118.067 118.067 120.915 -2.848 18387 2151 1 3 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.663 0.386 18387 2152 1 3 . 1 1 89 89 ASN C C 89 173.773 173.773 174.505 -0.732 18387 2153 1 3 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.544 0.912 18387 2154 1 3 . 1 1 89 89 ASN CB C 89 39.197 39.197 39.028 0.169 18387 2155 1 3 . 1 1 89 89 ASN H H 89 7.864 7.864 8.685 -0.821 18387 2156 1 3 . 1 1 90 90 GLN N N 90 125.392 125.392 122.119 3.273 18387 2157 1 3 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.440 0.057 18387 2158 1 3 . 1 1 90 90 GLN C C 90 176.491 176.491 175.020 1.471 18387 2159 1 3 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.757 0.703 18387 2160 1 3 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.575 -1.348 18387 2161 1 3 . 1 1 90 90 GLN H H 90 7.904 7.904 8.458 -0.554 18387 2162 1 3 . 1 1 91 91 VAL N N 91 114.434 114.434 118.994 -4.560 18387 2163 1 3 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.792 0.688 18387 2164 1 3 . 1 1 91 91 VAL C C 91 174.248 174.248 172.769 1.479 18387 2165 1 3 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.782 -0.776 18387 2166 1 3 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.362 1.276 18387 2167 1 3 . 1 1 91 91 VAL H H 91 9.585 9.585 9.142 0.443 18387 2168 1 3 . 1 1 92 92 LEU N N 92 126.910 126.910 125.070 1.840 18387 2169 1 3 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.203 -0.134 18387 2170 1 3 . 1 1 92 92 LEU C C 92 177.696 177.696 175.753 1.943 18387 2171 1 3 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.230 0.614 18387 2172 1 3 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.295 0.652 18387 2173 1 3 . 1 1 92 92 LEU H H 92 8.941 8.941 8.332 0.609 18387 2174 1 3 . 1 1 93 93 LEU N N 93 125.673 125.673 128.247 -2.574 18387 2175 1 3 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.096 0.304 18387 2176 1 3 . 1 1 93 93 LEU C C 93 177.291 177.291 176.791 0.500 18387 2177 1 3 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.135 -0.184 18387 2178 1 3 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.619 1.560 18387 2179 1 3 . 1 1 93 93 LEU H H 93 8.038 8.038 8.655 -0.617 18387 2180 1 3 . 1 1 94 94 GLN N N 94 122.206 122.206 123.625 -1.419 18387 2181 1 3 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.110 0.127 18387 2182 1 3 . 1 1 94 94 GLN C C 94 178.246 178.246 176.564 1.682 18387 2183 1 3 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.055 -0.280 18387 2184 1 3 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.204 0.051 18387 2185 1 3 . 1 1 94 94 GLN H H 94 9.298 9.298 8.049 1.249 18387 2186 1 3 . 1 1 95 95 LYS N N 95 122.668 122.668 123.469 -0.801 18387 2187 1 3 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.938 0.028 18387 2188 1 3 . 1 1 95 95 LYS C C 95 178.787 178.787 178.644 0.143 18387 2189 1 3 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.419 0.653 18387 2190 1 3 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.152 0.313 18387 2191 1 3 . 1 1 95 95 LYS H H 95 8.645 8.645 8.708 -0.063 18387 2192 1 3 . 1 1 96 96 ASP N N 96 116.775 116.775 119.101 -2.326 18387 2193 1 3 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.474 0.106 18387 2194 1 3 . 1 1 96 96 ASP C C 96 176.220 176.220 177.993 -1.773 18387 2195 1 3 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.809 -0.463 18387 2196 1 3 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.518 0.039 18387 2197 1 3 . 1 1 96 96 ASP H H 96 8.606 8.606 8.173 0.433 18387 2198 1 3 . 1 1 97 97 ASP N N 97 118.213 118.213 120.246 -2.033 18387 2199 1 3 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.311 0.616 18387 2200 1 3 . 1 1 97 97 ASP C C 97 176.954 176.954 178.261 -1.307 18387 2201 1 3 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.257 -1.898 18387 2202 1 3 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.837 1.487 18387 2203 1 3 . 1 1 97 97 ASP H H 97 7.988 7.988 8.066 -0.078 18387 2204 1 3 . 1 1 98 98 VAL N N 98 118.907 118.907 119.144 -0.237 18387 2205 1 3 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.612 -0.196 18387 2206 1 3 . 1 1 98 98 VAL C C 98 176.470 176.470 177.761 -1.291 18387 2207 1 3 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.555 1.223 18387 2208 1 3 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.104 1.287 18387 2209 1 3 . 1 1 98 98 VAL H H 98 7.098 7.098 8.539 -1.441 18387 2210 1 3 . 1 1 99 99 LYS N N 99 117.909 117.909 120.349 -2.440 18387 2211 1 3 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.903 0.040 18387 2212 1 3 . 1 1 99 99 LYS C C 99 178.762 178.762 178.134 0.628 18387 2213 1 3 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.232 -0.087 18387 2214 1 3 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.010 0.002 18387 2215 1 3 . 1 1 99 99 LYS H H 99 8.304 8.304 7.461 0.843 18387 2216 1 3 . 1 1 100 100 ASP N N 100 117.843 117.843 118.902 -1.059 18387 2217 1 3 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.484 -0.006 18387 2218 1 3 . 1 1 100 100 ASP C C 100 179.694 179.694 178.978 0.716 18387 2219 1 3 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.114 0.412 18387 2220 1 3 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.536 0.291 18387 2221 1 3 . 1 1 100 100 ASP H H 100 8.024 8.024 7.838 0.186 18387 2222 1 3 . 1 1 101 101 VAL N N 101 122.202 122.202 120.981 1.221 18387 2223 1 3 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.750 0.245 18387 2224 1 3 . 1 1 101 101 VAL C C 101 178.533 178.533 177.848 0.685 18387 2225 1 3 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.280 0.722 18387 2226 1 3 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.338 0.699 18387 2227 1 3 . 1 1 101 101 VAL H H 101 8.205 8.205 8.146 0.059 18387 2228 1 3 . 1 1 102 102 LEU N N 102 118.798 118.798 119.493 -0.695 18387 2229 1 3 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.686 0.094 18387 2230 1 3 . 1 1 102 102 LEU C C 102 180.254 180.254 179.097 1.157 18387 2231 1 3 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.143 0.798 18387 2232 1 3 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.294 -0.855 18387 2233 1 3 . 1 1 102 102 LEU H H 102 8.422 8.422 8.465 -0.043 18387 2234 1 3 . 1 1 103 103 GLU N N 103 116.915 116.915 120.024 -3.109 18387 2235 1 3 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.941 0.194 18387 2236 1 3 . 1 1 103 103 GLU C C 103 180.910 180.910 179.334 1.576 18387 2237 1 3 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.933 0.470 18387 2238 1 3 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.130 0.601 18387 2239 1 3 . 1 1 103 103 GLU H H 103 8.262 8.262 7.870 0.392 18387 2240 1 3 . 1 1 104 104 SER N N 104 117.866 117.866 116.339 1.527 18387 2241 1 3 . 1 1 104 104 SER HA H 104 4.216 4.216 4.235 -0.019 18387 2242 1 3 . 1 1 104 104 SER C C 104 175.455 175.455 176.390 -0.935 18387 2243 1 3 . 1 1 104 104 SER CA C 104 62.019 62.019 61.448 0.571 18387 2244 1 3 . 1 1 104 104 SER CB C 104 62.891 62.891 63.258 -0.367 18387 2245 1 3 . 1 1 104 104 SER H H 104 8.544 8.544 8.053 0.491 18387 2246 1 3 . 1 1 105 105 TYR N N 105 117.278 117.278 119.315 -2.037 18387 2247 1 3 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.565 -0.293 18387 2248 1 3 . 1 1 105 105 TYR C C 105 174.750 174.750 175.325 -0.575 18387 2249 1 3 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.715 2.144 18387 2250 1 3 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.141 2.570 18387 2251 1 3 . 1 1 105 105 TYR H H 105 7.691 7.691 7.851 -0.160 18387 2252 1 3 . 1 1 106 106 CYS N N 106 116.897 116.897 115.617 1.280 18387 2253 1 3 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.059 -0.164 18387 2254 1 3 . 1 1 106 106 CYS C C 106 174.056 174.056 173.473 0.583 18387 2255 1 3 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.297 0.313 18387 2256 1 3 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.808 0.224 18387 2257 1 3 . 1 1 106 106 CYS H H 106 7.862 7.862 8.117 -0.255 18387 2258 1 3 . 1 1 107 107 ILE N N 107 118.885 118.885 121.800 -2.915 18387 2259 1 3 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.074 -0.735 18387 2260 1 3 . 1 1 107 107 ILE C C 107 176.793 176.793 174.472 2.321 18387 2261 1 3 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.541 3.204 18387 2262 1 3 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.708 0.371 18387 2263 1 3 . 1 1 107 107 ILE H H 107 7.707 7.707 8.110 -0.403 18387 2264 1 3 . 1 1 108 108 VAL N N 108 123.983 123.983 126.065 -2.082 18387 2265 1 3 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.112 0.162 18387 2266 1 3 . 1 1 108 108 VAL C C 108 175.476 175.476 174.458 1.018 18387 2267 1 3 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.426 0.198 18387 2268 1 3 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.818 0.190 18387 2269 1 3 . 1 1 108 108 VAL H H 108 8.656 8.656 8.444 0.212 18387 2270 1 3 . 1 1 109 109 GLY N N 109 110.120 110.120 106.766 3.354 18387 2271 1 3 . 1 1 109 109 GLY C C 109 169.982 169.982 172.536 -2.554 18387 2272 1 3 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.911 -0.308 18387 2273 1 3 . 1 1 109 109 GLY H H 109 7.500 7.500 7.383 0.117 18387 2274 1 3 . 1 1 110 110 PHE N N 110 115.276 115.276 118.352 -3.076 18387 2275 1 3 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.089 -0.315 18387 2276 1 3 . 1 1 110 110 PHE C C 110 174.361 174.361 174.387 -0.026 18387 2277 1 3 . 1 1 110 110 PHE CA C 110 55.687 55.687 54.983 0.704 18387 2278 1 3 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.569 1.382 18387 2279 1 3 . 1 1 110 110 PHE H H 110 8.203 8.203 8.256 -0.053 18387 2280 1 3 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.022 0.337 18387 2281 1 3 . 1 1 111 111 PRO C C 111 175.691 175.691 175.846 -0.155 18387 2282 1 3 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.280 -0.123 18387 2283 1 3 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.621 1.683 18387 2284 1 3 . 1 1 112 112 HIS N N 112 123.708 123.708 116.585 7.123 18387 2285 1 3 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.855 0.108 18387 2286 1 3 . 1 1 112 112 HIS C C 112 173.649 173.649 173.756 -0.107 18387 2287 1 3 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.730 0.344 18387 2288 1 3 . 1 1 112 112 HIS CB C 112 32.197 32.197 31.143 1.054 18387 2289 1 3 . 1 1 112 112 HIS H H 112 8.952 8.952 8.588 0.364 18387 2290 1 3 . 1 1 113 113 ILE N N 113 128.596 128.596 127.267 1.329 18387 2291 1 3 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.365 0.332 18387 2292 1 3 . 1 1 113 113 ILE C C 113 176.130 176.130 174.418 1.712 18387 2293 1 3 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.875 1.120 18387 2294 1 3 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.021 -2.966 18387 2295 1 3 . 1 1 113 113 ILE H H 113 8.808 8.808 8.635 0.173 18387 2296 1 3 . 1 1 114 114 ILE N N 114 119.668 119.668 120.417 -0.749 18387 2297 1 3 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.905 0.068 18387 2298 1 3 . 1 1 114 114 ILE C C 114 173.186 173.186 173.476 -0.290 18387 2299 1 3 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.900 -0.170 18387 2300 1 3 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.416 0.124 18387 2301 1 3 . 1 1 114 114 ILE H H 114 8.721 8.721 9.032 -0.311 18387 2302 1 3 . 1 1 115 115 LEU N N 115 122.770 122.770 125.182 -2.412 18387 2303 1 3 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.337 -0.062 18387 2304 1 3 . 1 1 115 115 LEU C C 115 173.601 173.601 174.909 -1.308 18387 2305 1 3 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.130 0.652 18387 2306 1 3 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.097 1.037 18387 2307 1 3 . 1 1 115 115 LEU H H 115 8.665 8.665 8.954 -0.289 18387 2308 1 3 . 1 1 116 116 VAL N N 116 130.411 130.411 121.463 8.948 18387 2309 1 3 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.239 -0.381 18387 2310 1 3 . 1 1 116 116 VAL C C 116 174.565 174.565 175.525 -0.960 18387 2311 1 3 . 1 1 116 116 VAL CA C 116 60.804 60.804 58.733 2.071 18387 2312 1 3 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.570 -0.655 18387 2313 1 3 . 1 1 116 116 VAL H H 116 9.472 9.472 9.094 0.378 18387 2314 1 3 . 1 1 117 117 ASP N N 117 127.896 127.896 124.181 3.715 18387 2315 1 3 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.620 -0.228 18387 2316 1 3 . 1 1 117 117 ASP C C 117 176.567 176.567 176.448 0.119 18387 2317 1 3 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.528 1.072 18387 2318 1 3 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.045 0.539 18387 2319 1 3 . 1 1 117 117 ASP H H 117 9.429 9.429 8.838 0.591 18387 2320 1 3 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.285 -0.091 18387 2321 1 3 . 1 1 118 118 PRO C C 118 177.534 177.534 177.558 -0.024 18387 2322 1 3 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.756 0.409 18387 2323 1 3 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.772 1.041 18387 2324 1 3 . 1 1 119 119 GLU N N 119 114.015 114.015 117.881 -3.866 18387 2325 1 3 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.163 0.176 18387 2326 1 3 . 1 1 119 119 GLU C C 119 176.722 176.722 177.556 -0.834 18387 2327 1 3 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.654 -2.015 18387 2328 1 3 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.993 0.584 18387 2329 1 3 . 1 1 119 119 GLU H H 119 7.733 7.733 7.976 -0.243 18387 2330 1 3 . 1 1 120 120 GLY N N 120 108.218 108.218 106.557 1.661 18387 2331 1 3 . 1 1 120 120 GLY C C 120 174.110 174.110 173.021 1.089 18387 2332 1 3 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.776 0.620 18387 2333 1 3 . 1 1 120 120 GLY H H 120 8.588 8.588 8.370 0.218 18387 2334 1 3 . 1 1 121 121 LYS N N 121 121.778 121.778 120.225 1.553 18387 2335 1 3 . 1 1 121 121 LYS HA H 121 4.859 4.859 4.988 -0.129 18387 2336 1 3 . 1 1 121 121 LYS C C 121 176.458 176.458 175.432 1.026 18387 2337 1 3 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.409 0.553 18387 2338 1 3 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.532 -2.080 18387 2339 1 3 . 1 1 121 121 LYS H H 121 8.600 8.600 8.454 0.146 18387 2340 1 3 . 1 1 122 122 ILE N N 122 122.058 122.058 124.490 -2.432 18387 2341 1 3 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.337 -0.065 18387 2342 1 3 . 1 1 122 122 ILE C C 122 177.084 177.084 177.311 -0.227 18387 2343 1 3 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.023 0.796 18387 2344 1 3 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.824 1.824 18387 2345 1 3 . 1 1 122 122 ILE H H 122 9.006 9.006 9.043 -0.037 18387 2346 1 3 . 1 1 123 123 VAL N N 123 120.561 120.561 125.782 -5.221 18387 2347 1 3 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.080 0.675 18387 2348 1 3 . 1 1 123 123 VAL C C 123 175.584 175.584 175.566 0.018 18387 2349 1 3 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.317 -2.166 18387 2350 1 3 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.053 1.348 18387 2351 1 3 . 1 1 123 123 VAL H H 123 9.054 9.054 8.365 0.689 18387 2352 1 3 . 1 1 124 124 ALA N N 124 121.102 121.102 121.532 -0.430 18387 2353 1 3 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.729 -0.072 18387 2354 1 3 . 1 1 124 124 ALA C C 124 174.832 174.832 174.900 -0.068 18387 2355 1 3 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.881 0.579 18387 2356 1 3 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.312 1.518 18387 2357 1 3 . 1 1 124 124 ALA H H 124 7.793 7.793 7.447 0.346 18387 2358 1 3 . 1 1 125 125 LYS N N 125 117.637 117.637 120.084 -2.447 18387 2359 1 3 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.855 0.178 18387 2360 1 3 . 1 1 125 125 LYS C C 125 173.417 173.417 175.914 -2.497 18387 2361 1 3 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.097 0.044 18387 2362 1 3 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.931 0.720 18387 2363 1 3 . 1 1 125 125 LYS H H 125 8.872 8.872 8.288 0.584 18387 2364 1 3 . 1 1 126 126 GLU N N 126 115.236 115.236 115.508 -0.272 18387 2365 1 3 . 1 1 126 126 GLU HA H 126 3.998 3.998 4.039 -0.041 18387 2366 1 3 . 1 1 126 126 GLU C C 126 175.998 175.998 176.018 -0.020 18387 2367 1 3 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.271 -0.309 18387 2368 1 3 . 1 1 126 126 GLU CB C 126 26.435 26.435 26.898 -0.463 18387 2369 1 3 . 1 1 126 126 GLU H H 126 7.941 7.941 8.458 -0.517 18387 2370 1 3 . 1 1 127 127 LEU N N 127 118.584 118.584 118.655 -0.071 18387 2371 1 3 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.375 0.007 18387 2372 1 3 . 1 1 127 127 LEU C C 127 176.766 176.766 176.993 -0.227 18387 2373 1 3 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.821 -1.212 18387 2374 1 3 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.640 1.323 18387 2375 1 3 . 1 1 127 127 LEU H H 127 7.300 7.300 7.646 -0.346 18387 2376 1 3 . 1 1 128 128 ARG N N 128 118.625 118.625 118.268 0.357 18387 2377 1 3 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.728 -0.253 18387 2378 1 3 . 1 1 128 128 ARG C C 128 177.113 177.113 177.463 -0.350 18387 2379 1 3 . 1 1 128 128 ARG CA C 128 53.390 53.390 52.707 0.683 18387 2380 1 3 . 1 1 128 128 ARG CB C 128 34.612 34.612 31.968 2.643 18387 2381 1 3 . 1 1 128 128 ARG H H 128 7.929 7.929 9.054 -1.125 18387 2382 1 3 . 1 1 129 129 GLY N N 129 114.010 114.010 110.360 3.650 18387 2383 1 3 . 1 1 129 129 GLY C C 129 175.931 175.931 175.328 0.603 18387 2384 1 3 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.535 -2.074 18387 2385 1 3 . 1 1 129 129 GLY H H 129 10.649 10.649 9.094 1.555 18387 2386 1 3 . 1 1 130 130 ASP N N 130 123.975 123.975 120.149 3.826 18387 2387 1 3 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.434 0.098 18387 2388 1 3 . 1 1 130 130 ASP C C 130 177.507 177.507 177.323 0.184 18387 2389 1 3 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.216 0.156 18387 2390 1 3 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.595 0.308 18387 2391 1 3 . 1 1 130 130 ASP H H 130 8.540 8.540 8.277 0.263 18387 2392 1 3 . 1 1 131 131 ASP N N 131 116.806 116.806 121.522 -4.716 18387 2393 1 3 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.337 0.233 18387 2394 1 3 . 1 1 131 131 ASP C C 131 179.038 179.038 177.996 1.042 18387 2395 1 3 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.978 0.005 18387 2396 1 3 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.837 0.097 18387 2397 1 3 . 1 1 131 131 ASP H H 131 7.907 7.907 8.156 -0.249 18387 2398 1 3 . 1 1 132 132 LEU N N 132 123.869 123.869 120.359 3.510 18387 2399 1 3 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.872 -0.081 18387 2400 1 3 . 1 1 132 132 LEU C C 132 176.343 176.343 178.679 -2.336 18387 2401 1 3 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.363 1.421 18387 2402 1 3 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.569 0.199 18387 2403 1 3 . 1 1 132 132 LEU H H 132 7.542 7.542 8.578 -1.036 18387 2404 1 3 . 1 1 133 133 TYR N N 133 120.042 120.042 119.269 0.773 18387 2405 1 3 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.081 -0.085 18387 2406 1 3 . 1 1 133 133 TYR C C 133 177.426 177.426 177.455 -0.029 18387 2407 1 3 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.201 -0.068 18387 2408 1 3 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.559 0.017 18387 2409 1 3 . 1 1 133 133 TYR H H 133 7.384 7.384 7.832 -0.448 18387 2410 1 3 . 1 1 134 134 ASN N N 134 114.936 114.936 115.588 -0.652 18387 2411 1 3 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.421 -0.018 18387 2412 1 3 . 1 1 134 134 ASN C C 134 178.703 178.703 177.745 0.958 18387 2413 1 3 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.233 -0.424 18387 2414 1 3 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.163 0.045 18387 2415 1 3 . 1 1 134 134 ASN H H 134 8.399 8.399 8.302 0.097 18387 2416 1 3 . 1 1 135 135 THR N N 135 117.387 117.387 117.131 0.256 18387 2417 1 3 . 1 1 135 135 THR HA H 135 3.920 3.920 3.928 -0.008 18387 2418 1 3 . 1 1 135 135 THR C C 135 175.323 175.323 176.500 -1.177 18387 2419 1 3 . 1 1 135 135 THR CA C 135 67.402 67.402 66.981 0.421 18387 2420 1 3 . 1 1 135 135 THR CB C 135 68.111 68.111 68.714 -0.603 18387 2421 1 3 . 1 1 135 135 THR H H 135 8.265 8.265 8.307 -0.042 18387 2422 1 3 . 1 1 136 136 VAL N N 136 121.207 121.207 121.279 -0.072 18387 2423 1 3 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.612 -0.597 18387 2424 1 3 . 1 1 136 136 VAL C C 136 176.457 176.457 177.289 -0.832 18387 2425 1 3 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.090 2.182 18387 2426 1 3 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.599 0.342 18387 2427 1 3 . 1 1 136 136 VAL H H 136 7.595 7.595 8.180 -0.585 18387 2428 1 3 . 1 1 137 137 GLU N N 137 118.266 118.266 120.585 -2.319 18387 2429 1 3 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.132 -1.450 18387 2430 1 3 . 1 1 137 137 GLU C C 137 177.482 177.482 178.551 -1.069 18387 2431 1 3 . 1 1 137 137 GLU CA C 137 59.930 59.930 60.170 -0.240 18387 2432 1 3 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.177 0.605 18387 2433 1 3 . 1 1 137 137 GLU H H 137 8.114 8.114 8.418 -0.304 18387 2434 1 3 . 1 1 138 138 LYS N N 138 116.431 116.431 118.357 -1.926 18387 2435 1 3 . 1 1 138 138 LYS HA H 138 3.768 3.768 4.297 -0.529 18387 2436 1 3 . 1 1 138 138 LYS C C 138 179.193 179.193 179.124 0.069 18387 2437 1 3 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.867 0.173 18387 2438 1 3 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.230 -0.071 18387 2439 1 3 . 1 1 138 138 LYS H H 138 7.133 7.133 7.388 -0.255 18387 2440 1 3 . 1 1 139 139 PHE N N 139 116.336 116.336 117.964 -1.628 18387 2441 1 3 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.451 -0.441 18387 2442 1 3 . 1 1 139 139 PHE C C 139 177.855 177.855 178.014 -0.159 18387 2443 1 3 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.156 2.228 18387 2444 1 3 . 1 1 139 139 PHE CB C 139 39.352 39.352 38.947 0.405 18387 2445 1 3 . 1 1 139 139 PHE H H 139 7.338 7.338 7.445 -0.107 18387 2446 1 3 . 1 1 140 140 VAL N N 140 116.491 116.491 117.689 -1.198 18387 2447 1 3 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.347 0.177 18387 2448 1 3 . 1 1 140 140 VAL C C 140 177.747 177.747 176.986 0.761 18387 2449 1 3 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.149 0.093 18387 2450 1 3 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.181 0.209 18387 2451 1 3 . 1 1 140 140 VAL H H 140 8.332 8.332 8.527 -0.195 18387 2452 1 3 . 1 1 141 141 ASN N N 141 116.956 116.956 117.440 -0.484 18387 2453 1 3 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.739 0.087 18387 2454 1 3 . 1 1 141 141 ASN C C 141 176.997 176.997 175.492 1.505 18387 2455 1 3 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.372 -0.695 18387 2456 1 3 . 1 1 141 141 ASN CB C 141 38.448 38.448 41.150 -2.702 18387 2457 1 3 . 1 1 141 141 ASN H H 141 7.862 7.862 7.844 0.018 18387 2458 1 3 . 1 1 142 142 GLY N N 142 107.938 107.938 105.804 2.134 18387 2459 1 3 . 1 1 142 142 GLY C C 142 174.336 174.336 171.867 2.469 18387 2460 1 3 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.231 0.754 18387 2461 1 3 . 1 1 142 142 GLY H H 142 7.466 7.466 8.246 -0.780 18387 2462 1 3 . 1 1 143 143 ALA N N 143 123.441 123.441 120.011 3.430 18387 2463 1 3 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.830 -0.489 18387 2464 1 3 . 1 1 143 143 ALA C C 143 178.212 178.212 176.468 1.744 18387 2465 1 3 . 1 1 143 143 ALA CA C 143 52.826 52.826 51.262 1.564 18387 2466 1 3 . 1 1 143 143 ALA CB C 143 19.244 19.244 21.909 -2.665 18387 2467 1 3 . 1 1 143 143 ALA H H 143 7.950 7.950 7.833 0.117 18387 2468 1 3 . 1 1 144 144 LYS N N 144 120.149 120.149 118.410 1.739 18387 2469 1 3 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.208 0.087 18387 2470 1 3 . 1 1 144 144 LYS C C 144 176.945 176.945 177.541 -0.596 18387 2471 1 3 . 1 1 144 144 LYS CA C 144 56.519 56.519 58.157 -1.638 18387 2472 1 3 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.397 0.633 18387 2473 1 3 . 1 1 144 144 LYS H H 144 8.187 8.187 8.509 -0.322 18387 2474 1 3 . 1 1 145 145 GLU N N 145 120.992 120.992 120.205 0.787 18387 2475 1 3 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.391 -0.096 18387 2476 1 3 . 1 1 145 145 GLU C C 145 177.116 177.116 176.619 0.497 18387 2477 1 3 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.841 1.062 18387 2478 1 3 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.396 1.845 18387 2479 1 3 . 1 1 145 145 GLU H H 145 8.363 8.363 8.508 -0.145 18387 2480 1 3 . 1 1 146 146 GLY N N 146 109.467 109.467 108.658 0.809 18387 2481 1 3 . 1 1 146 146 GLY C C 146 174.108 174.108 174.414 -0.306 18387 2482 1 3 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.304 0.097 18387 2483 1 3 . 1 1 146 146 GLY H H 146 8.371 8.371 7.544 0.827 18387 2484 1 3 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.928 -0.319 18387 2485 1 3 . 1 1 151 151 HIS C C 151 174.258 174.258 174.206 0.052 18387 2486 1 3 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.620 0.545 18387 2487 1 3 . 1 1 151 151 HIS CB C 151 30.833 30.833 29.750 1.083 18387 2488 1 4 . 1 1 2 2 SER HA H 2 3.992 3.992 4.186 -0.194 18387 2489 1 4 . 1 1 2 2 SER CA C 2 57.555 57.555 59.216 -1.661 18387 2490 1 4 . 1 1 2 2 SER CB C 2 64.977 64.977 63.123 1.854 18387 2491 1 4 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.507 -0.068 18387 2492 1 4 . 1 1 3 3 LEU C C 3 176.631 176.631 176.166 0.465 18387 2493 1 4 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.620 -0.056 18387 2494 1 4 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.393 0.331 18387 2495 1 4 . 1 1 4 4 ALA N N 4 125.483 125.483 122.413 3.070 18387 2496 1 4 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.405 -0.026 18387 2497 1 4 . 1 1 4 4 ALA C C 4 179.642 179.642 177.493 2.149 18387 2498 1 4 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.660 0.075 18387 2499 1 4 . 1 1 4 4 ALA CB C 4 19.752 19.752 19.415 0.337 18387 2500 1 4 . 1 1 4 4 ALA H H 4 8.483 8.483 8.321 0.162 18387 2501 1 4 . 1 1 5 5 THR HA H 5 3.845 3.845 4.354 -0.509 18387 2502 1 4 . 1 1 5 5 THR C C 5 175.487 175.487 175.859 -0.372 18387 2503 1 4 . 1 1 5 5 THR CA C 5 64.531 64.531 62.692 1.839 18387 2504 1 4 . 1 1 5 5 THR CB C 5 68.108 68.108 69.117 -1.009 18387 2505 1 4 . 1 1 6 6 GLY N N 6 114.298 114.298 113.984 0.314 18387 2506 1 4 . 1 1 6 6 GLY C C 6 174.324 174.324 174.046 0.278 18387 2507 1 4 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.811 0.024 18387 2508 1 4 . 1 1 6 6 GLY H H 6 9.511 9.511 9.071 0.440 18387 2509 1 4 . 1 1 7 7 SER N N 7 115.270 115.270 117.301 -2.031 18387 2510 1 4 . 1 1 7 7 SER HA H 7 4.500 4.500 4.528 -0.028 18387 2511 1 4 . 1 1 7 7 SER C C 7 173.315 173.315 174.444 -1.129 18387 2512 1 4 . 1 1 7 7 SER CA C 7 58.915 58.915 58.555 0.360 18387 2513 1 4 . 1 1 7 7 SER CB C 7 64.308 64.308 64.386 -0.078 18387 2514 1 4 . 1 1 7 7 SER H H 7 7.736 7.736 7.571 0.165 18387 2515 1 4 . 1 1 8 8 VAL N N 8 123.708 123.708 124.735 -1.027 18387 2516 1 4 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.187 -0.355 18387 2517 1 4 . 1 1 8 8 VAL C C 8 176.673 176.673 176.061 0.612 18387 2518 1 4 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.611 0.062 18387 2519 1 4 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.222 -0.000 18387 2520 1 4 . 1 1 8 8 VAL H H 8 8.632 8.632 8.414 0.218 18387 2521 1 4 . 1 1 9 9 ALA N N 9 133.040 133.040 131.460 1.580 18387 2522 1 4 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.941 -0.678 18387 2523 1 4 . 1 1 9 9 ALA C C 9 175.404 175.404 175.697 -0.293 18387 2524 1 4 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.519 1.436 18387 2525 1 4 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.822 -0.792 18387 2526 1 4 . 1 1 9 9 ALA H H 9 8.448 8.448 8.747 -0.299 18387 2527 1 4 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.381 -0.050 18387 2528 1 4 . 1 1 10 10 PRO C C 10 175.071 175.071 176.285 -1.214 18387 2529 1 4 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.955 -0.314 18387 2530 1 4 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.048 0.276 18387 2531 1 4 . 1 1 11 11 ALA N N 11 124.172 124.172 128.748 -4.576 18387 2532 1 4 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.412 -0.168 18387 2533 1 4 . 1 1 11 11 ALA C C 11 177.688 177.688 177.575 0.113 18387 2534 1 4 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.702 1.919 18387 2535 1 4 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.698 -0.371 18387 2536 1 4 . 1 1 11 11 ALA H H 11 8.221 8.221 8.443 -0.222 18387 2537 1 4 . 1 1 12 12 ILE N N 12 117.815 117.815 125.784 -7.969 18387 2538 1 4 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.068 0.260 18387 2539 1 4 . 1 1 12 12 ILE C C 12 175.013 175.013 176.116 -1.103 18387 2540 1 4 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.495 1.671 18387 2541 1 4 . 1 1 12 12 ILE CB C 12 44.290 44.290 37.212 7.077 18387 2542 1 4 . 1 1 12 12 ILE H H 12 7.693 7.693 8.649 -0.956 18387 2543 1 4 . 1 1 13 13 THR N N 13 121.186 121.186 123.882 -2.696 18387 2544 1 4 . 1 1 13 13 THR HA H 13 4.840 4.840 5.114 -0.274 18387 2545 1 4 . 1 1 13 13 THR C C 13 172.625 172.625 173.971 -1.346 18387 2546 1 4 . 1 1 13 13 THR CA C 13 62.297 62.297 61.682 0.615 18387 2547 1 4 . 1 1 13 13 THR CB C 13 71.585 71.585 68.848 2.737 18387 2548 1 4 . 1 1 13 13 THR H H 13 8.363 8.363 9.234 -0.871 18387 2549 1 4 . 1 1 14 14 GLY N N 14 110.785 110.785 111.461 -0.676 18387 2550 1 4 . 1 1 14 14 GLY C C 14 170.040 170.040 171.904 -1.864 18387 2551 1 4 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.238 1.152 18387 2552 1 4 . 1 1 14 14 GLY H H 14 7.993 7.993 8.879 -0.886 18387 2553 1 4 . 1 1 15 15 ILE N N 15 119.088 119.088 119.739 -0.651 18387 2554 1 4 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.267 -0.142 18387 2555 1 4 . 1 1 15 15 ILE C C 15 176.359 176.359 175.876 0.483 18387 2556 1 4 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.128 -1.514 18387 2557 1 4 . 1 1 15 15 ILE CB C 15 38.639 38.639 40.174 -1.535 18387 2558 1 4 . 1 1 15 15 ILE H H 15 7.973 7.973 8.362 -0.389 18387 2559 1 4 . 1 1 16 16 ASP N N 16 126.633 126.633 126.695 -0.062 18387 2560 1 4 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.495 0.354 18387 2561 1 4 . 1 1 16 16 ASP C C 16 179.190 179.190 177.231 1.959 18387 2562 1 4 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.830 0.050 18387 2563 1 4 . 1 1 16 16 ASP CB C 16 42.275 42.275 43.157 -0.882 18387 2564 1 4 . 1 1 16 16 ASP H H 16 9.335 9.335 8.764 0.571 18387 2565 1 4 . 1 1 17 17 LEU N N 17 116.648 116.648 118.190 -1.542 18387 2566 1 4 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.903 0.271 18387 2567 1 4 . 1 1 17 17 LEU C C 17 178.432 178.432 178.968 -0.536 18387 2568 1 4 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.412 0.569 18387 2569 1 4 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.856 1.130 18387 2570 1 4 . 1 1 17 17 LEU H H 17 8.071 8.071 8.595 -0.524 18387 2571 1 4 . 1 1 18 18 LYS N N 18 117.401 117.401 116.870 0.531 18387 2572 1 4 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.172 0.337 18387 2573 1 4 . 1 1 18 18 LYS C C 18 176.793 176.793 177.514 -0.721 18387 2574 1 4 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.661 -2.226 18387 2575 1 4 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.965 0.098 18387 2576 1 4 . 1 1 18 18 LYS H H 18 8.207 8.207 8.610 -0.403 18387 2577 1 4 . 1 1 19 19 GLY N N 19 108.061 108.061 106.057 2.004 18387 2578 1 4 . 1 1 19 19 GLY C C 19 174.649 174.649 174.115 0.534 18387 2579 1 4 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.559 1.038 18387 2580 1 4 . 1 1 19 19 GLY H H 19 8.099 8.099 8.012 0.087 18387 2581 1 4 . 1 1 20 20 ASN N N 20 121.012 121.012 120.807 0.205 18387 2582 1 4 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.927 -0.022 18387 2583 1 4 . 1 1 20 20 ASN C C 20 174.827 174.827 174.910 -0.083 18387 2584 1 4 . 1 1 20 20 ASN CA C 20 52.467 52.467 53.127 -0.660 18387 2585 1 4 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.081 -0.405 18387 2586 1 4 . 1 1 20 20 ASN H H 20 8.945 8.945 9.030 -0.085 18387 2587 1 4 . 1 1 21 21 SER N N 21 117.285 117.285 118.174 -0.889 18387 2588 1 4 . 1 1 21 21 SER HA H 21 5.000 5.000 5.063 -0.063 18387 2589 1 4 . 1 1 21 21 SER C C 21 174.911 174.911 175.250 -0.339 18387 2590 1 4 . 1 1 21 21 SER CA C 21 58.730 58.730 57.988 0.742 18387 2591 1 4 . 1 1 21 21 SER CB C 21 63.162 63.162 62.582 0.580 18387 2592 1 4 . 1 1 21 21 SER H H 21 8.740 8.740 8.731 0.009 18387 2593 1 4 . 1 1 22 22 VAL N N 22 128.665 128.665 119.678 8.987 18387 2594 1 4 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.884 -0.504 18387 2595 1 4 . 1 1 22 22 VAL C C 22 176.276 176.276 175.143 1.133 18387 2596 1 4 . 1 1 22 22 VAL CA C 22 62.953 62.953 59.933 3.020 18387 2597 1 4 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.340 1.242 18387 2598 1 4 . 1 1 22 22 VAL H H 22 9.125 9.125 8.748 0.377 18387 2599 1 4 . 1 1 23 23 SER N N 23 127.457 127.457 115.951 11.506 18387 2600 1 4 . 1 1 23 23 SER HA H 23 5.878 5.878 6.026 -0.148 18387 2601 1 4 . 1 1 23 23 SER C C 23 174.436 174.436 176.374 -1.938 18387 2602 1 4 . 1 1 23 23 SER CA C 23 57.101 57.101 55.844 1.257 18387 2603 1 4 . 1 1 23 23 SER CB C 23 66.078 66.078 66.350 -0.272 18387 2604 1 4 . 1 1 23 23 SER H H 23 8.971 8.971 8.791 0.180 18387 2605 1 4 . 1 1 24 24 LEU N N 24 126.734 126.734 120.210 6.524 18387 2606 1 4 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.764 -0.297 18387 2607 1 4 . 1 1 24 24 LEU C C 24 179.852 179.852 178.185 1.667 18387 2608 1 4 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.345 0.858 18387 2609 1 4 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.313 0.665 18387 2610 1 4 . 1 1 24 24 LEU H H 24 8.450 8.450 8.275 0.175 18387 2611 1 4 . 1 1 25 25 ASN N N 25 115.642 115.642 118.295 -2.653 18387 2612 1 4 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.461 -0.219 18387 2613 1 4 . 1 1 25 25 ASN C C 25 176.246 176.246 176.872 -0.626 18387 2614 1 4 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.914 -0.544 18387 2615 1 4 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.133 0.638 18387 2616 1 4 . 1 1 25 25 ASN H H 25 8.505 8.505 8.639 -0.134 18387 2617 1 4 . 1 1 26 26 ASP N N 26 119.722 119.722 119.575 0.147 18387 2618 1 4 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.317 -0.112 18387 2619 1 4 . 1 1 26 26 ASP C C 26 176.708 176.708 176.681 0.027 18387 2620 1 4 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.745 -0.220 18387 2621 1 4 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.494 -1.214 18387 2622 1 4 . 1 1 26 26 ASP H H 26 7.731 7.731 7.777 -0.046 18387 2623 1 4 . 1 1 27 27 PHE N N 27 116.827 116.827 116.187 0.640 18387 2624 1 4 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.606 -0.126 18387 2625 1 4 . 1 1 27 27 PHE C C 27 174.227 174.227 175.955 -1.728 18387 2626 1 4 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.444 -0.373 18387 2627 1 4 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.570 0.149 18387 2628 1 4 . 1 1 27 27 PHE H H 27 7.390 7.390 7.368 0.022 18387 2629 1 4 . 1 1 28 28 LYS N N 28 120.357 120.357 120.674 -0.317 18387 2630 1 4 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.024 0.363 18387 2631 1 4 . 1 1 28 28 LYS C C 28 177.845 177.845 177.604 0.241 18387 2632 1 4 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.644 0.358 18387 2633 1 4 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.920 -0.376 18387 2634 1 4 . 1 1 28 28 LYS H H 28 6.883 6.883 7.399 -0.516 18387 2635 1 4 . 1 1 29 29 GLY N N 29 112.653 112.653 105.201 7.452 18387 2636 1 4 . 1 1 29 29 GLY C C 29 173.799 173.799 173.143 0.656 18387 2637 1 4 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.619 -0.631 18387 2638 1 4 . 1 1 29 29 GLY H H 29 8.930 8.930 8.275 0.655 18387 2639 1 4 . 1 1 30 30 LYS N N 30 120.516 120.516 117.272 3.244 18387 2640 1 4 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.519 0.116 18387 2641 1 4 . 1 1 30 30 LYS C C 30 176.505 176.505 174.681 1.824 18387 2642 1 4 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.422 0.758 18387 2643 1 4 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.883 -1.026 18387 2644 1 4 . 1 1 30 30 LYS H H 30 8.098 8.098 7.135 0.963 18387 2645 1 4 . 1 1 31 31 TYR N N 31 117.383 117.383 120.048 -2.665 18387 2646 1 4 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.971 -0.317 18387 2647 1 4 . 1 1 31 31 TYR C C 31 175.551 175.551 175.446 0.105 18387 2648 1 4 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.398 1.767 18387 2649 1 4 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.908 2.285 18387 2650 1 4 . 1 1 31 31 TYR H H 31 8.263 8.263 8.924 -0.661 18387 2651 1 4 . 1 1 32 32 VAL N N 32 120.900 120.900 123.349 -2.449 18387 2652 1 4 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.842 -0.403 18387 2653 1 4 . 1 1 32 32 VAL C C 32 175.975 175.975 175.208 0.767 18387 2654 1 4 . 1 1 32 32 VAL CA C 32 59.706 59.706 59.882 -0.176 18387 2655 1 4 . 1 1 32 32 VAL CB C 32 35.507 35.507 34.041 1.466 18387 2656 1 4 . 1 1 32 32 VAL H H 32 9.244 9.244 8.854 0.390 18387 2657 1 4 . 1 1 33 33 LEU N N 33 130.058 130.058 127.348 2.710 18387 2658 1 4 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.049 0.124 18387 2659 1 4 . 1 1 33 33 LEU C C 33 174.693 174.693 176.189 -1.496 18387 2660 1 4 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.936 -0.588 18387 2661 1 4 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.270 1.051 18387 2662 1 4 . 1 1 33 33 LEU H H 33 8.161 8.161 8.235 -0.074 18387 2663 1 4 . 1 1 34 34 VAL N N 34 129.232 129.232 125.272 3.960 18387 2664 1 4 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.658 0.324 18387 2665 1 4 . 1 1 34 34 VAL C C 34 174.285 174.285 174.485 -0.200 18387 2666 1 4 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.237 0.269 18387 2667 1 4 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.341 0.037 18387 2668 1 4 . 1 1 34 34 VAL H H 34 9.296 9.296 9.054 0.242 18387 2669 1 4 . 1 1 35 35 ASP N N 35 123.675 123.675 129.271 -5.596 18387 2670 1 4 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.934 0.415 18387 2671 1 4 . 1 1 35 35 ASP C C 35 174.258 174.258 175.285 -1.027 18387 2672 1 4 . 1 1 35 35 ASP CA C 35 51.054 51.054 53.530 -2.476 18387 2673 1 4 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.640 -1.178 18387 2674 1 4 . 1 1 35 35 ASP H H 35 8.015 8.015 8.366 -0.351 18387 2675 1 4 . 1 1 36 36 PHE N N 36 126.959 126.959 125.638 1.321 18387 2676 1 4 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.656 0.279 18387 2677 1 4 . 1 1 36 36 PHE C C 36 175.432 175.432 175.612 -0.180 18387 2678 1 4 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.526 -0.431 18387 2679 1 4 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.864 0.166 18387 2680 1 4 . 1 1 36 36 PHE H H 36 9.171 9.171 8.423 0.748 18387 2681 1 4 . 1 1 37 37 TRP N N 37 120.839 120.839 122.840 -2.001 18387 2682 1 4 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.365 0.392 18387 2683 1 4 . 1 1 37 37 TRP C C 37 172.412 172.412 173.687 -1.275 18387 2684 1 4 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.113 0.796 18387 2685 1 4 . 1 1 37 37 TRP CB C 37 32.680 32.680 33.016 -0.336 18387 2686 1 4 . 1 1 37 37 TRP H H 37 9.280 9.280 9.271 0.009 18387 2687 1 4 . 1 1 38 38 PHE N N 38 109.215 109.215 112.403 -3.188 18387 2688 1 4 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.614 -0.681 18387 2689 1 4 . 1 1 38 38 PHE C C 38 176.141 176.141 174.465 1.676 18387 2690 1 4 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.328 0.683 18387 2691 1 4 . 1 1 38 38 PHE CB C 38 39.619 39.619 41.348 -1.729 18387 2692 1 4 . 1 1 38 38 PHE H H 38 7.062 7.062 8.146 -1.084 18387 2693 1 4 . 1 1 39 39 ALA N N 39 125.193 125.193 124.653 0.540 18387 2694 1 4 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.355 -0.290 18387 2695 1 4 . 1 1 39 39 ALA C C 39 179.349 179.349 177.826 1.523 18387 2696 1 4 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.013 2.051 18387 2697 1 4 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.848 1.049 18387 2698 1 4 . 1 1 39 39 ALA H H 39 10.355 10.355 9.236 1.119 18387 2699 1 4 . 1 1 40 40 GLY N N 40 103.437 103.437 104.311 -0.874 18387 2700 1 4 . 1 1 40 40 GLY C C 40 172.732 172.732 174.003 -1.271 18387 2701 1 4 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.650 0.286 18387 2702 1 4 . 1 1 40 40 GLY H H 40 8.583 8.583 8.213 0.370 18387 2703 1 4 . 1 1 41 41 CYS N N 41 124.859 124.859 119.111 5.748 18387 2704 1 4 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.568 -0.164 18387 2705 1 4 . 1 1 41 41 CYS C C 41 176.620 176.620 175.020 1.600 18387 2706 1 4 . 1 1 41 41 CYS CA C 41 58.375 58.375 56.844 1.531 18387 2707 1 4 . 1 1 41 41 CYS CB C 41 28.376 28.376 29.112 -0.736 18387 2708 1 4 . 1 1 41 41 CYS H H 41 6.946 6.946 7.226 -0.280 18387 2709 1 4 . 1 1 42 42 SER HA H 42 4.040 4.040 4.280 -0.240 18387 2710 1 4 . 1 1 42 42 SER CA C 42 61.552 61.552 61.477 0.075 18387 2711 1 4 . 1 1 42 42 SER CB C 42 62.675 62.675 63.090 -0.415 18387 2712 1 4 . 1 1 43 43 TRP N N 43 129.748 129.748 121.206 8.542 18387 2713 1 4 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.509 0.040 18387 2714 1 4 . 1 1 43 43 TRP C C 43 180.400 180.400 177.203 3.197 18387 2715 1 4 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.858 0.391 18387 2716 1 4 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.932 -0.340 18387 2717 1 4 . 1 1 44 44 CYS N N 44 124.462 124.462 115.648 8.814 18387 2718 1 4 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.293 -0.043 18387 2719 1 4 . 1 1 44 44 CYS C C 44 178.643 178.643 176.276 2.367 18387 2720 1 4 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.186 2.663 18387 2721 1 4 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.655 2.767 18387 2722 1 4 . 1 1 44 44 CYS H H 44 9.591 9.591 7.751 1.840 18387 2723 1 4 . 1 1 45 45 ARG N N 45 117.248 117.248 118.193 -0.945 18387 2724 1 4 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.418 -0.242 18387 2725 1 4 . 1 1 45 45 ARG C C 45 180.302 180.302 177.811 2.491 18387 2726 1 4 . 1 1 45 45 ARG CA C 45 56.943 56.943 55.701 1.242 18387 2727 1 4 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.703 -2.072 18387 2728 1 4 . 1 1 45 45 ARG H H 45 7.955 7.955 7.397 0.558 18387 2729 1 4 . 1 1 46 46 LYS N N 46 120.318 120.318 120.498 -0.180 18387 2730 1 4 . 1 1 46 46 LYS HA H 46 4.272 4.272 3.849 0.423 18387 2731 1 4 . 1 1 46 46 LYS C C 46 177.755 177.755 177.989 -0.234 18387 2732 1 4 . 1 1 46 46 LYS CA C 46 58.769 58.769 58.937 -0.168 18387 2733 1 4 . 1 1 46 46 LYS CB C 46 33.157 33.157 31.434 1.723 18387 2734 1 4 . 1 1 46 46 LYS H H 46 8.129 8.129 7.548 0.581 18387 2735 1 4 . 1 1 47 47 GLU N N 47 114.278 114.278 117.932 -3.654 18387 2736 1 4 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.287 0.604 18387 2737 1 4 . 1 1 47 47 GLU C C 47 178.701 178.701 178.770 -0.069 18387 2738 1 4 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.943 -2.389 18387 2739 1 4 . 1 1 47 47 GLU CB C 47 29.766 29.766 28.963 0.803 18387 2740 1 4 . 1 1 47 47 GLU H H 47 7.386 7.386 7.620 -0.234 18387 2741 1 4 . 1 1 48 48 THR N N 48 115.665 115.665 116.518 -0.853 18387 2742 1 4 . 1 1 48 48 THR HA H 48 4.048 4.048 4.123 -0.075 18387 2743 1 4 . 1 1 48 48 THR C C 48 172.392 172.392 174.150 -1.758 18387 2744 1 4 . 1 1 48 48 THR CA C 48 69.426 69.426 68.621 0.805 18387 2745 1 4 . 1 1 48 48 THR CB C 48 66.906 66.906 66.419 0.486 18387 2746 1 4 . 1 1 48 48 THR H H 48 7.810 7.810 7.607 0.203 18387 2747 1 4 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.143 0.146 18387 2748 1 4 . 1 1 49 49 PRO C C 49 179.828 179.828 178.383 1.445 18387 2749 1 4 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.164 0.435 18387 2750 1 4 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.936 0.098 18387 2751 1 4 . 1 1 50 50 TYR N N 50 116.950 116.950 116.215 0.735 18387 2752 1 4 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.243 -0.105 18387 2753 1 4 . 1 1 50 50 TYR C C 50 179.488 179.488 178.662 0.826 18387 2754 1 4 . 1 1 50 50 TYR CA C 50 61.135 61.135 60.510 0.625 18387 2755 1 4 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.336 0.965 18387 2756 1 4 . 1 1 50 50 TYR H H 50 7.071 7.071 7.045 0.026 18387 2757 1 4 . 1 1 51 51 LEU N N 51 123.989 123.989 121.863 2.126 18387 2758 1 4 . 1 1 51 51 LEU HA H 51 3.670 3.670 4.043 -0.373 18387 2759 1 4 . 1 1 51 51 LEU C C 51 178.072 178.072 178.463 -0.391 18387 2760 1 4 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.630 1.046 18387 2761 1 4 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.443 1.174 18387 2762 1 4 . 1 1 51 51 LEU H H 51 8.243 8.243 8.661 -0.418 18387 2763 1 4 . 1 1 52 52 LEU N N 52 119.857 119.857 120.549 -0.692 18387 2764 1 4 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.308 0.019 18387 2765 1 4 . 1 1 52 52 LEU C C 52 178.704 178.704 178.140 0.564 18387 2766 1 4 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.770 -0.195 18387 2767 1 4 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.669 1.069 18387 2768 1 4 . 1 1 52 52 LEU H H 52 9.085 9.085 8.830 0.255 18387 2769 1 4 . 1 1 53 53 LYS N N 53 118.658 118.658 119.067 -0.409 18387 2770 1 4 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.959 0.150 18387 2771 1 4 . 1 1 53 53 LYS C C 53 179.786 179.786 178.943 0.843 18387 2772 1 4 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.024 -0.303 18387 2773 1 4 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.248 0.911 18387 2774 1 4 . 1 1 53 53 LYS H H 53 7.807 7.807 8.025 -0.218 18387 2775 1 4 . 1 1 54 54 THR N N 54 116.869 116.869 116.722 0.147 18387 2776 1 4 . 1 1 54 54 THR HA H 54 3.965 3.965 4.164 -0.199 18387 2777 1 4 . 1 1 54 54 THR C C 54 175.328 175.328 176.537 -1.209 18387 2778 1 4 . 1 1 54 54 THR CA C 54 67.683 67.683 66.979 0.704 18387 2779 1 4 . 1 1 54 54 THR CB C 54 68.452 68.452 69.153 -0.701 18387 2780 1 4 . 1 1 54 54 THR H H 54 7.771 7.771 8.165 -0.394 18387 2781 1 4 . 1 1 55 55 TYR N N 55 122.202 122.202 122.624 -0.422 18387 2782 1 4 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.209 0.063 18387 2783 1 4 . 1 1 55 55 TYR C C 55 176.809 176.809 177.302 -0.493 18387 2784 1 4 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.073 0.664 18387 2785 1 4 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.555 0.725 18387 2786 1 4 . 1 1 55 55 TYR H H 55 9.145 9.145 8.783 0.362 18387 2787 1 4 . 1 1 56 56 ASN N N 56 113.858 113.858 117.292 -3.434 18387 2788 1 4 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.255 0.008 18387 2789 1 4 . 1 1 56 56 ASN C C 56 177.427 177.427 176.945 0.482 18387 2790 1 4 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.710 0.220 18387 2791 1 4 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.402 -0.448 18387 2792 1 4 . 1 1 56 56 ASN H H 56 8.850 8.850 8.545 0.305 18387 2793 1 4 . 1 1 57 57 ALA N N 57 118.829 118.829 119.219 -0.390 18387 2794 1 4 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.010 0.054 18387 2795 1 4 . 1 1 57 57 ALA C C 57 180.445 180.445 178.188 2.257 18387 2796 1 4 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.883 0.468 18387 2797 1 4 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.542 0.652 18387 2798 1 4 . 1 1 57 57 ALA H H 57 7.436 7.436 7.434 0.002 18387 2799 1 4 . 1 1 58 58 PHE N N 58 112.082 112.082 115.336 -3.254 18387 2800 1 4 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.678 0.243 18387 2801 1 4 . 1 1 58 58 PHE C C 58 176.999 176.999 177.094 -0.095 18387 2802 1 4 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.272 0.795 18387 2803 1 4 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.115 1.375 18387 2804 1 4 . 1 1 58 58 PHE H H 58 7.480 7.480 7.588 -0.108 18387 2805 1 4 . 1 1 59 59 LYS N N 59 120.666 120.666 121.429 -0.763 18387 2806 1 4 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.394 0.409 18387 2807 1 4 . 1 1 59 59 LYS C C 59 177.157 177.157 177.570 -0.413 18387 2808 1 4 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.425 -0.344 18387 2809 1 4 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.644 -1.076 18387 2810 1 4 . 1 1 59 59 LYS H H 59 8.411 8.411 7.881 0.530 18387 2811 1 4 . 1 1 60 60 ASP N N 60 118.908 118.908 118.740 0.168 18387 2812 1 4 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.717 0.408 18387 2813 1 4 . 1 1 60 60 ASP C C 60 176.889 176.889 176.478 0.411 18387 2814 1 4 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.394 -0.745 18387 2815 1 4 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.855 0.857 18387 2816 1 4 . 1 1 60 60 ASP H H 60 8.574 8.574 8.497 0.077 18387 2817 1 4 . 1 1 61 61 LYS N N 61 121.021 121.021 119.511 1.510 18387 2818 1 4 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.611 0.103 18387 2819 1 4 . 1 1 61 61 LYS C C 61 175.968 175.968 176.677 -0.709 18387 2820 1 4 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.885 -0.748 18387 2821 1 4 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.678 0.400 18387 2822 1 4 . 1 1 61 61 LYS H H 61 8.278 8.278 7.916 0.362 18387 2823 1 4 . 1 1 62 62 GLY C C 62 173.837 173.837 173.208 0.629 18387 2824 1 4 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.274 1.776 18387 2825 1 4 . 1 1 63 63 PHE N N 63 120.476 120.476 120.088 0.388 18387 2826 1 4 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.746 0.287 18387 2827 1 4 . 1 1 63 63 PHE C C 63 173.613 173.613 173.421 0.192 18387 2828 1 4 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.796 -0.946 18387 2829 1 4 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.972 -0.298 18387 2830 1 4 . 1 1 63 63 PHE H H 63 7.413 7.413 7.578 -0.165 18387 2831 1 4 . 1 1 64 64 THR N N 64 119.903 119.903 118.746 1.157 18387 2832 1 4 . 1 1 64 64 THR HA H 64 4.097 4.097 4.750 -0.653 18387 2833 1 4 . 1 1 64 64 THR C C 64 170.397 170.397 172.168 -1.771 18387 2834 1 4 . 1 1 64 64 THR CA C 64 60.261 60.261 59.798 0.463 18387 2835 1 4 . 1 1 64 64 THR CB C 64 69.507 69.507 71.474 -1.967 18387 2836 1 4 . 1 1 64 64 THR H H 64 7.665 7.665 8.532 -0.867 18387 2837 1 4 . 1 1 65 65 ILE N N 65 117.277 117.277 122.113 -4.836 18387 2838 1 4 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.049 0.427 18387 2839 1 4 . 1 1 65 65 ILE C C 65 173.056 173.056 173.610 -0.554 18387 2840 1 4 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.675 -0.966 18387 2841 1 4 . 1 1 65 65 ILE CB C 65 39.845 39.845 40.137 -0.292 18387 2842 1 4 . 1 1 65 65 ILE H H 65 7.321 7.321 8.391 -1.070 18387 2843 1 4 . 1 1 66 66 TYR N N 66 131.968 131.968 129.048 2.920 18387 2844 1 4 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.381 -0.134 18387 2845 1 4 . 1 1 66 66 TYR C C 66 174.074 174.074 174.776 -0.702 18387 2846 1 4 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.033 -0.068 18387 2847 1 4 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.899 1.218 18387 2848 1 4 . 1 1 66 66 TYR H H 66 9.038 9.038 9.150 -0.112 18387 2849 1 4 . 1 1 67 67 GLY N N 67 114.364 114.364 115.272 -0.908 18387 2850 1 4 . 1 1 67 67 GLY C C 67 172.461 172.461 172.858 -0.397 18387 2851 1 4 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.518 0.482 18387 2852 1 4 . 1 1 67 67 GLY H H 67 9.188 9.188 8.753 0.435 18387 2853 1 4 . 1 1 68 68 VAL N N 68 126.938 126.938 128.674 -1.736 18387 2854 1 4 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.057 -0.921 18387 2855 1 4 . 1 1 68 68 VAL C C 68 173.822 173.822 175.424 -1.602 18387 2856 1 4 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.512 -0.014 18387 2857 1 4 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.358 1.200 18387 2858 1 4 . 1 1 68 68 VAL H H 68 9.309 9.309 8.859 0.450 18387 2859 1 4 . 1 1 69 69 SER N N 69 118.813 118.813 121.654 -2.841 18387 2860 1 4 . 1 1 69 69 SER HA H 69 5.527 5.527 5.425 0.102 18387 2861 1 4 . 1 1 69 69 SER C C 69 175.753 175.753 174.318 1.435 18387 2862 1 4 . 1 1 69 69 SER CA C 69 54.407 54.407 55.667 -1.260 18387 2863 1 4 . 1 1 69 69 SER CB C 69 63.630 63.630 65.658 -2.028 18387 2864 1 4 . 1 1 69 69 SER H H 69 8.124 8.124 9.211 -1.087 18387 2865 1 4 . 1 1 70 70 THR N N 70 113.861 113.861 113.287 0.574 18387 2866 1 4 . 1 1 70 70 THR HA H 70 4.381 4.381 4.371 0.010 18387 2867 1 4 . 1 1 70 70 THR C C 70 175.001 175.001 173.165 1.836 18387 2868 1 4 . 1 1 70 70 THR CA C 70 60.259 60.259 60.435 -0.176 18387 2869 1 4 . 1 1 70 70 THR CB C 70 67.291 67.291 69.201 -1.910 18387 2870 1 4 . 1 1 70 70 THR H H 70 7.656 7.656 7.960 -0.304 18387 2871 1 4 . 1 1 71 71 ASP N N 71 125.133 125.133 122.554 2.579 18387 2872 1 4 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.534 -0.464 18387 2873 1 4 . 1 1 71 71 ASP C C 71 175.685 175.685 176.593 -0.908 18387 2874 1 4 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.835 2.777 18387 2875 1 4 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.276 1.093 18387 2876 1 4 . 1 1 71 71 ASP H H 71 8.931 8.931 7.882 1.049 18387 2877 1 4 . 1 1 72 72 ARG N N 72 118.814 118.814 123.191 -4.377 18387 2878 1 4 . 1 1 72 72 ARG HA H 72 4.195 4.195 3.924 0.271 18387 2879 1 4 . 1 1 72 72 ARG C C 72 177.300 177.300 176.962 0.338 18387 2880 1 4 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.760 -0.951 18387 2881 1 4 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.185 0.926 18387 2882 1 4 . 1 1 72 72 ARG H H 72 8.057 8.057 8.438 -0.381 18387 2883 1 4 . 1 1 73 73 ARG N N 73 118.174 118.174 121.695 -3.521 18387 2884 1 4 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.411 0.343 18387 2885 1 4 . 1 1 73 73 ARG C C 73 176.503 176.503 176.400 0.103 18387 2886 1 4 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.596 -1.060 18387 2887 1 4 . 1 1 73 73 ARG CB C 73 31.028 31.028 30.070 0.958 18387 2888 1 4 . 1 1 73 73 ARG H H 73 8.639 8.639 8.245 0.394 18387 2889 1 4 . 1 1 74 74 GLU N N 74 127.609 127.609 125.642 1.967 18387 2890 1 4 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.079 0.000 18387 2891 1 4 . 1 1 74 74 GLU C C 74 178.107 178.107 177.425 0.682 18387 2892 1 4 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.297 -0.512 18387 2893 1 4 . 1 1 74 74 GLU CB C 74 30.098 30.098 30.208 -0.110 18387 2894 1 4 . 1 1 74 74 GLU H H 74 9.129 9.129 8.634 0.494 18387 2895 1 4 . 1 1 75 75 GLU N N 75 117.874 117.874 118.642 -0.768 18387 2896 1 4 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.126 -0.026 18387 2897 1 4 . 1 1 75 75 GLU C C 75 178.993 178.993 178.529 0.464 18387 2898 1 4 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.260 0.867 18387 2899 1 4 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.341 0.950 18387 2900 1 4 . 1 1 75 75 GLU H H 75 9.745 9.745 8.570 1.175 18387 2901 1 4 . 1 1 76 76 ASP N N 76 119.182 119.182 119.941 -0.759 18387 2902 1 4 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.532 -0.166 18387 2903 1 4 . 1 1 76 76 ASP C C 76 178.107 178.107 177.815 0.292 18387 2904 1 4 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.739 0.234 18387 2905 1 4 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.600 -0.080 18387 2906 1 4 . 1 1 76 76 ASP H H 76 7.004 7.004 8.442 -1.438 18387 2907 1 4 . 1 1 77 77 TRP N N 77 123.008 123.008 123.469 -0.461 18387 2908 1 4 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.292 -0.143 18387 2909 1 4 . 1 1 77 77 TRP C C 77 176.236 176.236 177.896 -1.660 18387 2910 1 4 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.515 -1.032 18387 2911 1 4 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.240 -0.705 18387 2912 1 4 . 1 1 77 77 TRP H H 77 7.112 7.112 7.966 -0.854 18387 2913 1 4 . 1 1 78 78 LYS N N 78 115.727 115.727 118.149 -2.422 18387 2914 1 4 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.495 -0.250 18387 2915 1 4 . 1 1 78 78 LYS C C 78 179.426 179.426 178.674 0.752 18387 2916 1 4 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.394 1.038 18387 2917 1 4 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.845 0.900 18387 2918 1 4 . 1 1 78 78 LYS H H 78 8.431 8.431 8.469 -0.038 18387 2919 1 4 . 1 1 79 79 LYS N N 79 118.321 118.321 119.715 -1.394 18387 2920 1 4 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.922 0.098 18387 2921 1 4 . 1 1 79 79 LYS C C 79 178.239 178.239 178.565 -0.326 18387 2922 1 4 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.415 -0.348 18387 2923 1 4 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.492 -0.029 18387 2924 1 4 . 1 1 79 79 LYS H H 79 7.690 7.690 7.751 -0.061 18387 2925 1 4 . 1 1 80 80 ALA N N 80 120.679 120.679 122.221 -1.542 18387 2926 1 4 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.476 -0.321 18387 2927 1 4 . 1 1 80 80 ALA C C 80 178.811 178.811 180.162 -1.351 18387 2928 1 4 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.850 0.237 18387 2929 1 4 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.536 0.222 18387 2930 1 4 . 1 1 80 80 ALA H H 80 7.560 7.560 8.558 -0.998 18387 2931 1 4 . 1 1 81 81 ILE N N 81 118.019 118.019 118.200 -0.181 18387 2932 1 4 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.826 -0.424 18387 2933 1 4 . 1 1 81 81 ILE C C 81 178.113 178.113 178.310 -0.197 18387 2934 1 4 . 1 1 81 81 ILE CA C 81 64.520 64.520 62.613 1.907 18387 2935 1 4 . 1 1 81 81 ILE CB C 81 38.204 38.204 36.475 1.729 18387 2936 1 4 . 1 1 81 81 ILE H H 81 7.514 7.514 7.736 -0.222 18387 2937 1 4 . 1 1 82 82 GLU N N 82 117.252 117.252 120.083 -2.831 18387 2938 1 4 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.869 0.225 18387 2939 1 4 . 1 1 82 82 GLU C C 82 179.558 179.558 178.194 1.364 18387 2940 1 4 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.461 0.119 18387 2941 1 4 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.162 0.221 18387 2942 1 4 . 1 1 82 82 GLU H H 82 7.401 7.401 7.607 -0.206 18387 2943 1 4 . 1 1 83 83 GLU N N 83 119.340 119.340 118.426 0.914 18387 2944 1 4 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.045 -0.147 18387 2945 1 4 . 1 1 83 83 GLU C C 83 178.740 178.740 178.251 0.489 18387 2946 1 4 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.550 0.450 18387 2947 1 4 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.816 0.104 18387 2948 1 4 . 1 1 83 83 GLU H H 83 8.191 8.191 7.843 0.348 18387 2949 1 4 . 1 1 84 84 ASP N N 84 118.449 118.449 115.330 3.119 18387 2950 1 4 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.450 -0.176 18387 2951 1 4 . 1 1 84 84 ASP C C 84 175.597 175.597 176.353 -0.756 18387 2952 1 4 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.215 0.832 18387 2953 1 4 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.667 -1.771 18387 2954 1 4 . 1 1 84 84 ASP H H 84 8.252 8.252 7.613 0.639 18387 2955 1 4 . 1 1 85 85 LYS N N 85 116.410 116.410 116.327 0.083 18387 2956 1 4 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.344 -0.171 18387 2957 1 4 . 1 1 85 85 LYS C C 85 176.856 176.856 175.130 1.726 18387 2958 1 4 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.331 -0.358 18387 2959 1 4 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.354 -0.486 18387 2960 1 4 . 1 1 85 85 LYS H H 85 7.890 7.890 7.777 0.113 18387 2961 1 4 . 1 1 86 86 SER N N 86 112.295 112.295 114.793 -2.498 18387 2962 1 4 . 1 1 86 86 SER HA H 86 3.139 3.139 3.667 -0.528 18387 2963 1 4 . 1 1 86 86 SER C C 86 175.805 175.805 173.042 2.763 18387 2964 1 4 . 1 1 86 86 SER CA C 86 53.637 53.637 57.818 -4.181 18387 2965 1 4 . 1 1 86 86 SER CB C 86 60.736 60.736 61.425 -0.689 18387 2966 1 4 . 1 1 86 86 SER H H 86 7.327 7.327 7.391 -0.064 18387 2967 1 4 . 1 1 87 87 TYR N N 87 120.962 120.962 126.488 -5.526 18387 2968 1 4 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.133 0.172 18387 2969 1 4 . 1 1 87 87 TYR C C 87 177.064 177.064 174.004 3.060 18387 2970 1 4 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.080 -0.857 18387 2971 1 4 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.096 -0.743 18387 2972 1 4 . 1 1 87 87 TYR H H 87 6.933 6.933 7.440 -0.507 18387 2973 1 4 . 1 1 88 88 TRP N N 88 118.597 118.597 122.521 -3.924 18387 2974 1 4 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.826 0.025 18387 2975 1 4 . 1 1 88 88 TRP C C 88 175.456 175.456 174.393 1.063 18387 2976 1 4 . 1 1 88 88 TRP CA C 88 56.236 56.236 55.743 0.493 18387 2977 1 4 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.532 -3.805 18387 2978 1 4 . 1 1 88 88 TRP H H 88 6.552 6.552 7.196 -0.644 18387 2979 1 4 . 1 1 89 89 ASN N N 89 118.067 118.067 121.490 -3.423 18387 2980 1 4 . 1 1 89 89 ASN HA H 89 5.049 5.049 5.125 -0.076 18387 2981 1 4 . 1 1 89 89 ASN C C 89 173.773 173.773 174.691 -0.918 18387 2982 1 4 . 1 1 89 89 ASN CA C 89 55.456 55.456 52.625 2.831 18387 2983 1 4 . 1 1 89 89 ASN CB C 89 39.197 39.197 39.169 0.028 18387 2984 1 4 . 1 1 89 89 ASN H H 89 7.864 7.864 8.446 -0.582 18387 2985 1 4 . 1 1 90 90 GLN N N 90 125.392 125.392 121.357 4.035 18387 2986 1 4 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.009 0.488 18387 2987 1 4 . 1 1 90 90 GLN C C 90 176.491 176.491 174.435 2.056 18387 2988 1 4 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.771 0.689 18387 2989 1 4 . 1 1 90 90 GLN CB C 90 31.227 31.227 30.701 0.526 18387 2990 1 4 . 1 1 90 90 GLN H H 90 7.904 7.904 8.377 -0.473 18387 2991 1 4 . 1 1 91 91 VAL N N 91 114.434 114.434 121.965 -7.531 18387 2992 1 4 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.754 0.726 18387 2993 1 4 . 1 1 91 91 VAL C C 91 174.248 174.248 172.801 1.447 18387 2994 1 4 . 1 1 91 91 VAL CA C 91 59.006 59.006 60.334 -1.327 18387 2995 1 4 . 1 1 91 91 VAL CB C 91 36.638 36.638 36.060 0.578 18387 2996 1 4 . 1 1 91 91 VAL H H 91 9.585 9.585 9.260 0.325 18387 2997 1 4 . 1 1 92 92 LEU N N 92 126.910 126.910 129.220 -2.310 18387 2998 1 4 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.699 -0.630 18387 2999 1 4 . 1 1 92 92 LEU C C 92 177.696 177.696 175.405 2.291 18387 3000 1 4 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.309 0.535 18387 3001 1 4 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.648 -0.701 18387 3002 1 4 . 1 1 92 92 LEU H H 92 8.941 8.941 8.832 0.109 18387 3003 1 4 . 1 1 93 93 LEU N N 93 125.673 125.673 127.776 -2.103 18387 3004 1 4 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.411 -0.011 18387 3005 1 4 . 1 1 93 93 LEU C C 93 177.291 177.291 176.915 0.376 18387 3006 1 4 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.887 -0.936 18387 3007 1 4 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.679 1.500 18387 3008 1 4 . 1 1 93 93 LEU H H 93 8.038 8.038 8.618 -0.580 18387 3009 1 4 . 1 1 94 94 GLN N N 94 122.206 122.206 122.578 -0.372 18387 3010 1 4 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.371 -0.134 18387 3011 1 4 . 1 1 94 94 GLN C C 94 178.246 178.246 176.908 1.338 18387 3012 1 4 . 1 1 94 94 GLN CA C 94 55.775 55.775 54.959 0.816 18387 3013 1 4 . 1 1 94 94 GLN CB C 94 29.255 29.255 30.116 -0.861 18387 3014 1 4 . 1 1 94 94 GLN H H 94 9.298 9.298 8.090 1.208 18387 3015 1 4 . 1 1 95 95 LYS N N 95 122.668 122.668 122.361 0.307 18387 3016 1 4 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.905 0.061 18387 3017 1 4 . 1 1 95 95 LYS C C 95 178.787 178.787 177.064 1.723 18387 3018 1 4 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.573 0.499 18387 3019 1 4 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.608 0.857 18387 3020 1 4 . 1 1 95 95 LYS H H 95 8.645 8.645 8.819 -0.174 18387 3021 1 4 . 1 1 96 96 ASP N N 96 116.775 116.775 117.095 -0.320 18387 3022 1 4 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.612 -0.032 18387 3023 1 4 . 1 1 96 96 ASP C C 96 176.220 176.220 178.406 -2.186 18387 3024 1 4 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.029 0.318 18387 3025 1 4 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.105 0.452 18387 3026 1 4 . 1 1 96 96 ASP H H 96 8.606 8.606 8.219 0.387 18387 3027 1 4 . 1 1 97 97 ASP N N 97 118.213 118.213 121.483 -3.270 18387 3028 1 4 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.285 0.642 18387 3029 1 4 . 1 1 97 97 ASP C C 97 176.954 176.954 178.149 -1.195 18387 3030 1 4 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.087 -1.728 18387 3031 1 4 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.637 1.687 18387 3032 1 4 . 1 1 97 97 ASP H H 97 7.988 7.988 8.275 -0.287 18387 3033 1 4 . 1 1 98 98 VAL N N 98 118.907 118.907 119.576 -0.669 18387 3034 1 4 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.450 -0.034 18387 3035 1 4 . 1 1 98 98 VAL C C 98 176.470 176.470 177.844 -1.374 18387 3036 1 4 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.573 1.205 18387 3037 1 4 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.606 0.785 18387 3038 1 4 . 1 1 98 98 VAL H H 98 7.098 7.098 8.562 -1.464 18387 3039 1 4 . 1 1 99 99 LYS N N 99 117.909 117.909 119.690 -1.781 18387 3040 1 4 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.953 -0.010 18387 3041 1 4 . 1 1 99 99 LYS C C 99 178.762 178.762 178.577 0.185 18387 3042 1 4 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.129 1.016 18387 3043 1 4 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.787 0.225 18387 3044 1 4 . 1 1 99 99 LYS H H 99 8.304 8.304 7.582 0.722 18387 3045 1 4 . 1 1 100 100 ASP N N 100 117.843 117.843 119.477 -1.634 18387 3046 1 4 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.367 0.111 18387 3047 1 4 . 1 1 100 100 ASP C C 100 179.694 179.694 179.048 0.646 18387 3048 1 4 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.659 -0.133 18387 3049 1 4 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.697 0.131 18387 3050 1 4 . 1 1 100 100 ASP H H 100 8.024 8.024 7.678 0.346 18387 3051 1 4 . 1 1 101 101 VAL N N 101 122.202 122.202 121.171 1.031 18387 3052 1 4 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.558 0.437 18387 3053 1 4 . 1 1 101 101 VAL C C 101 178.533 178.533 177.939 0.594 18387 3054 1 4 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.414 0.588 18387 3055 1 4 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.885 0.152 18387 3056 1 4 . 1 1 101 101 VAL H H 101 8.205 8.205 7.859 0.346 18387 3057 1 4 . 1 1 102 102 LEU N N 102 118.798 118.798 118.851 -0.053 18387 3058 1 4 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.438 0.342 18387 3059 1 4 . 1 1 102 102 LEU C C 102 180.254 180.254 178.639 1.615 18387 3060 1 4 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.841 1.100 18387 3061 1 4 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.252 -0.813 18387 3062 1 4 . 1 1 102 102 LEU H H 102 8.422 8.422 7.516 0.906 18387 3063 1 4 . 1 1 103 103 GLU N N 103 116.915 116.915 119.774 -2.859 18387 3064 1 4 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.789 0.346 18387 3065 1 4 . 1 1 103 103 GLU C C 103 180.910 180.910 179.329 1.581 18387 3066 1 4 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.563 -0.160 18387 3067 1 4 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.734 -0.003 18387 3068 1 4 . 1 1 103 103 GLU H H 103 8.262 8.262 8.368 -0.106 18387 3069 1 4 . 1 1 104 104 SER N N 104 117.866 117.866 116.098 1.768 18387 3070 1 4 . 1 1 104 104 SER HA H 104 4.216 4.216 4.197 0.019 18387 3071 1 4 . 1 1 104 104 SER C C 104 175.455 175.455 176.978 -1.523 18387 3072 1 4 . 1 1 104 104 SER CA C 104 62.019 62.019 61.819 0.200 18387 3073 1 4 . 1 1 104 104 SER CB C 104 62.891 62.891 62.930 -0.039 18387 3074 1 4 . 1 1 104 104 SER H H 104 8.544 8.544 8.231 0.313 18387 3075 1 4 . 1 1 105 105 TYR N N 105 117.278 117.278 120.219 -2.941 18387 3076 1 4 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.606 -0.334 18387 3077 1 4 . 1 1 105 105 TYR C C 105 174.750 174.750 174.977 -0.227 18387 3078 1 4 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.141 2.718 18387 3079 1 4 . 1 1 105 105 TYR CB C 105 39.711 39.711 36.985 2.726 18387 3080 1 4 . 1 1 105 105 TYR H H 105 7.691 7.691 7.658 0.033 18387 3081 1 4 . 1 1 106 106 CYS N N 106 116.897 116.897 115.911 0.986 18387 3082 1 4 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.066 -0.171 18387 3083 1 4 . 1 1 106 106 CYS C C 106 174.056 174.056 173.779 0.277 18387 3084 1 4 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.000 -0.390 18387 3085 1 4 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.915 0.117 18387 3086 1 4 . 1 1 106 106 CYS H H 106 7.862 7.862 8.288 -0.426 18387 3087 1 4 . 1 1 107 107 ILE N N 107 118.885 118.885 121.721 -2.836 18387 3088 1 4 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.484 -0.145 18387 3089 1 4 . 1 1 107 107 ILE C C 107 176.793 176.793 175.807 0.986 18387 3090 1 4 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.386 1.359 18387 3091 1 4 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.186 0.893 18387 3092 1 4 . 1 1 107 107 ILE H H 107 7.707 7.707 7.816 -0.109 18387 3093 1 4 . 1 1 108 108 VAL N N 108 123.983 123.983 127.251 -3.268 18387 3094 1 4 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.042 0.232 18387 3095 1 4 . 1 1 108 108 VAL C C 108 175.476 175.476 176.002 -0.526 18387 3096 1 4 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.449 -0.825 18387 3097 1 4 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.566 0.442 18387 3098 1 4 . 1 1 108 108 VAL H H 108 8.656 8.656 8.139 0.517 18387 3099 1 4 . 1 1 109 109 GLY N N 109 110.120 110.120 106.981 3.139 18387 3100 1 4 . 1 1 109 109 GLY C C 109 169.982 169.982 172.178 -2.196 18387 3101 1 4 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.063 -0.460 18387 3102 1 4 . 1 1 109 109 GLY H H 109 7.500 7.500 7.267 0.233 18387 3103 1 4 . 1 1 110 110 PHE N N 110 115.276 115.276 118.305 -3.029 18387 3104 1 4 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.201 -0.427 18387 3105 1 4 . 1 1 110 110 PHE C C 110 174.361 174.361 174.447 -0.086 18387 3106 1 4 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.805 -0.118 18387 3107 1 4 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.100 0.851 18387 3108 1 4 . 1 1 110 110 PHE H H 110 8.203 8.203 8.318 -0.115 18387 3109 1 4 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.291 0.068 18387 3110 1 4 . 1 1 111 111 PRO C C 111 175.691 175.691 175.937 -0.246 18387 3111 1 4 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.700 0.457 18387 3112 1 4 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.042 2.262 18387 3113 1 4 . 1 1 112 112 HIS N N 112 123.708 123.708 118.807 4.901 18387 3114 1 4 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.968 -0.005 18387 3115 1 4 . 1 1 112 112 HIS C C 112 173.649 173.649 174.101 -0.452 18387 3116 1 4 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.330 0.744 18387 3117 1 4 . 1 1 112 112 HIS CB C 112 32.197 32.197 31.940 0.257 18387 3118 1 4 . 1 1 112 112 HIS H H 112 8.952 8.952 8.596 0.356 18387 3119 1 4 . 1 1 113 113 ILE N N 113 128.596 128.596 127.811 0.785 18387 3120 1 4 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.337 0.360 18387 3121 1 4 . 1 1 113 113 ILE C C 113 176.130 176.130 174.622 1.508 18387 3122 1 4 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.837 1.158 18387 3123 1 4 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.740 -2.685 18387 3124 1 4 . 1 1 113 113 ILE H H 113 8.808 8.808 8.673 0.135 18387 3125 1 4 . 1 1 114 114 ILE N N 114 119.668 119.668 120.436 -0.768 18387 3126 1 4 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.774 0.199 18387 3127 1 4 . 1 1 114 114 ILE C C 114 173.186 173.186 173.424 -0.238 18387 3128 1 4 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.907 -0.177 18387 3129 1 4 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.202 0.338 18387 3130 1 4 . 1 1 114 114 ILE H H 114 8.721 8.721 8.431 0.290 18387 3131 1 4 . 1 1 115 115 LEU N N 115 122.770 122.770 125.203 -2.433 18387 3132 1 4 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.336 -0.061 18387 3133 1 4 . 1 1 115 115 LEU C C 115 173.601 173.601 175.156 -1.555 18387 3134 1 4 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.064 0.718 18387 3135 1 4 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.624 1.510 18387 3136 1 4 . 1 1 115 115 LEU H H 115 8.665 8.665 9.040 -0.375 18387 3137 1 4 . 1 1 116 116 VAL N N 116 130.411 130.411 122.297 8.114 18387 3138 1 4 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.235 -0.377 18387 3139 1 4 . 1 1 116 116 VAL C C 116 174.565 174.565 175.641 -1.076 18387 3140 1 4 . 1 1 116 116 VAL CA C 116 60.804 60.804 58.961 1.843 18387 3141 1 4 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.051 -0.136 18387 3142 1 4 . 1 1 116 116 VAL H H 116 9.472 9.472 9.257 0.215 18387 3143 1 4 . 1 1 117 117 ASP N N 117 127.896 127.896 124.702 3.194 18387 3144 1 4 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.819 -0.427 18387 3145 1 4 . 1 1 117 117 ASP C C 117 176.567 176.567 176.424 0.143 18387 3146 1 4 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.730 0.870 18387 3147 1 4 . 1 1 117 117 ASP CB C 117 40.584 40.584 39.902 0.682 18387 3148 1 4 . 1 1 117 117 ASP H H 117 9.429 9.429 8.846 0.583 18387 3149 1 4 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.332 -0.138 18387 3150 1 4 . 1 1 118 118 PRO C C 118 177.534 177.534 178.060 -0.526 18387 3151 1 4 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.060 0.105 18387 3152 1 4 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.853 0.960 18387 3153 1 4 . 1 1 119 119 GLU N N 119 114.015 114.015 117.228 -3.213 18387 3154 1 4 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.134 0.205 18387 3155 1 4 . 1 1 119 119 GLU C C 119 176.722 176.722 177.307 -0.585 18387 3156 1 4 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.708 -2.068 18387 3157 1 4 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.205 0.372 18387 3158 1 4 . 1 1 119 119 GLU H H 119 7.733 7.733 8.009 -0.276 18387 3159 1 4 . 1 1 120 120 GLY N N 120 108.218 108.218 105.837 2.381 18387 3160 1 4 . 1 1 120 120 GLY C C 120 174.110 174.110 172.990 1.120 18387 3161 1 4 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.795 0.601 18387 3162 1 4 . 1 1 120 120 GLY H H 120 8.588 8.588 8.443 0.145 18387 3163 1 4 . 1 1 121 121 LYS N N 121 121.778 121.778 120.304 1.474 18387 3164 1 4 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.065 -0.206 18387 3165 1 4 . 1 1 121 121 LYS C C 121 176.458 176.458 175.594 0.864 18387 3166 1 4 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.480 0.482 18387 3167 1 4 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.415 -1.963 18387 3168 1 4 . 1 1 121 121 LYS H H 121 8.600 8.600 8.531 0.069 18387 3169 1 4 . 1 1 122 122 ILE N N 122 122.058 122.058 124.970 -2.912 18387 3170 1 4 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.267 0.005 18387 3171 1 4 . 1 1 122 122 ILE C C 122 177.084 177.084 176.521 0.563 18387 3172 1 4 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.295 0.524 18387 3173 1 4 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.827 1.821 18387 3174 1 4 . 1 1 122 122 ILE H H 122 9.006 9.006 9.108 -0.102 18387 3175 1 4 . 1 1 123 123 VAL N N 123 120.561 120.561 128.854 -8.293 18387 3176 1 4 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.007 0.748 18387 3177 1 4 . 1 1 123 123 VAL C C 123 175.584 175.584 174.698 0.886 18387 3178 1 4 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.863 -1.712 18387 3179 1 4 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.460 0.941 18387 3180 1 4 . 1 1 123 123 VAL H H 123 9.054 9.054 8.218 0.836 18387 3181 1 4 . 1 1 124 124 ALA N N 124 121.102 121.102 122.390 -1.288 18387 3182 1 4 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.646 0.011 18387 3183 1 4 . 1 1 124 124 ALA C C 124 174.832 174.832 174.972 -0.140 18387 3184 1 4 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.129 1.331 18387 3185 1 4 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.273 1.556 18387 3186 1 4 . 1 1 124 124 ALA H H 124 7.793 7.793 7.784 0.009 18387 3187 1 4 . 1 1 125 125 LYS N N 125 117.637 117.637 126.581 -8.944 18387 3188 1 4 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.475 0.558 18387 3189 1 4 . 1 1 125 125 LYS C C 125 173.417 173.417 175.616 -2.199 18387 3190 1 4 . 1 1 125 125 LYS CA C 125 55.141 55.141 54.723 0.418 18387 3191 1 4 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.531 1.120 18387 3192 1 4 . 1 1 125 125 LYS H H 125 8.872 8.872 8.494 0.378 18387 3193 1 4 . 1 1 126 126 GLU N N 126 115.236 115.236 119.905 -4.669 18387 3194 1 4 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.833 0.165 18387 3195 1 4 . 1 1 126 126 GLU C C 126 175.998 175.998 175.137 0.861 18387 3196 1 4 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.252 -0.290 18387 3197 1 4 . 1 1 126 126 GLU CB C 126 26.435 26.435 26.986 -0.551 18387 3198 1 4 . 1 1 126 126 GLU H H 126 7.941 7.941 8.466 -0.525 18387 3199 1 4 . 1 1 127 127 LEU N N 127 118.584 118.584 120.503 -1.919 18387 3200 1 4 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.577 -0.195 18387 3201 1 4 . 1 1 127 127 LEU C C 127 176.766 176.766 175.845 0.921 18387 3202 1 4 . 1 1 127 127 LEU CA C 127 54.609 54.609 53.315 1.294 18387 3203 1 4 . 1 1 127 127 LEU CB C 127 43.963 43.963 44.102 -0.139 18387 3204 1 4 . 1 1 127 127 LEU H H 127 7.300 7.300 7.476 -0.176 18387 3205 1 4 . 1 1 128 128 ARG N N 128 118.625 118.625 118.375 0.250 18387 3206 1 4 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.746 -0.271 18387 3207 1 4 . 1 1 128 128 ARG C C 128 177.113 177.113 177.953 -0.840 18387 3208 1 4 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.073 -0.683 18387 3209 1 4 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.339 2.273 18387 3210 1 4 . 1 1 128 128 ARG H H 128 7.929 7.929 8.474 -0.545 18387 3211 1 4 . 1 1 129 129 GLY N N 129 114.010 114.010 109.168 4.842 18387 3212 1 4 . 1 1 129 129 GLY C C 129 175.931 175.931 175.477 0.454 18387 3213 1 4 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.078 -1.617 18387 3214 1 4 . 1 1 129 129 GLY H H 129 10.649 10.649 8.876 1.773 18387 3215 1 4 . 1 1 130 130 ASP N N 130 123.975 123.975 120.085 3.890 18387 3216 1 4 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.498 0.034 18387 3217 1 4 . 1 1 130 130 ASP C C 130 177.507 177.507 177.148 0.359 18387 3218 1 4 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.052 0.320 18387 3219 1 4 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.590 0.312 18387 3220 1 4 . 1 1 130 130 ASP H H 130 8.540 8.540 8.221 0.319 18387 3221 1 4 . 1 1 131 131 ASP N N 131 116.806 116.806 120.974 -4.168 18387 3222 1 4 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.343 0.227 18387 3223 1 4 . 1 1 131 131 ASP C C 131 179.038 179.038 178.467 0.571 18387 3224 1 4 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.714 -0.731 18387 3225 1 4 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.550 0.384 18387 3226 1 4 . 1 1 131 131 ASP H H 131 7.907 7.907 8.350 -0.443 18387 3227 1 4 . 1 1 132 132 LEU N N 132 123.869 123.869 120.648 3.221 18387 3228 1 4 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.878 -0.087 18387 3229 1 4 . 1 1 132 132 LEU C C 132 176.343 176.343 178.381 -2.038 18387 3230 1 4 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.368 1.416 18387 3231 1 4 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.637 0.131 18387 3232 1 4 . 1 1 132 132 LEU H H 132 7.542 7.542 8.471 -0.929 18387 3233 1 4 . 1 1 133 133 TYR N N 133 120.042 120.042 119.755 0.287 18387 3234 1 4 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.150 -0.154 18387 3235 1 4 . 1 1 133 133 TYR C C 133 177.426 177.426 177.418 0.008 18387 3236 1 4 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.377 -0.244 18387 3237 1 4 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.686 -0.110 18387 3238 1 4 . 1 1 133 133 TYR H H 133 7.384 7.384 7.586 -0.202 18387 3239 1 4 . 1 1 134 134 ASN N N 134 114.936 114.936 115.454 -0.518 18387 3240 1 4 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.415 -0.012 18387 3241 1 4 . 1 1 134 134 ASN C C 134 178.703 178.703 177.636 1.067 18387 3242 1 4 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.192 -0.383 18387 3243 1 4 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.056 0.152 18387 3244 1 4 . 1 1 134 134 ASN H H 134 8.399 8.399 8.753 -0.354 18387 3245 1 4 . 1 1 135 135 THR N N 135 117.387 117.387 117.375 0.012 18387 3246 1 4 . 1 1 135 135 THR HA H 135 3.920 3.920 3.676 0.244 18387 3247 1 4 . 1 1 135 135 THR C C 135 175.323 175.323 176.346 -1.023 18387 3248 1 4 . 1 1 135 135 THR CA C 135 67.402 67.402 66.594 0.808 18387 3249 1 4 . 1 1 135 135 THR CB C 135 68.111 68.111 68.777 -0.666 18387 3250 1 4 . 1 1 135 135 THR H H 135 8.265 8.265 7.777 0.488 18387 3251 1 4 . 1 1 136 136 VAL N N 136 121.207 121.207 120.771 0.436 18387 3252 1 4 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.448 -0.433 18387 3253 1 4 . 1 1 136 136 VAL C C 136 176.457 176.457 177.150 -0.693 18387 3254 1 4 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.083 2.189 18387 3255 1 4 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.037 0.904 18387 3256 1 4 . 1 1 136 136 VAL H H 136 7.595 7.595 7.635 -0.040 18387 3257 1 4 . 1 1 137 137 GLU N N 137 118.266 118.266 119.682 -1.416 18387 3258 1 4 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.706 -1.024 18387 3259 1 4 . 1 1 137 137 GLU C C 137 177.482 177.482 179.004 -1.522 18387 3260 1 4 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.682 0.248 18387 3261 1 4 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.154 0.628 18387 3262 1 4 . 1 1 137 137 GLU H H 137 8.114 8.114 7.988 0.126 18387 3263 1 4 . 1 1 138 138 LYS N N 138 116.431 116.431 118.974 -2.543 18387 3264 1 4 . 1 1 138 138 LYS HA H 138 3.768 3.768 4.121 -0.353 18387 3265 1 4 . 1 1 138 138 LYS C C 138 179.193 179.193 178.263 0.930 18387 3266 1 4 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.420 0.620 18387 3267 1 4 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.992 0.166 18387 3268 1 4 . 1 1 138 138 LYS H H 138 7.133 7.133 7.691 -0.558 18387 3269 1 4 . 1 1 139 139 PHE N N 139 116.336 116.336 118.781 -2.445 18387 3270 1 4 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.329 -0.319 18387 3271 1 4 . 1 1 139 139 PHE C C 139 177.855 177.855 178.411 -0.556 18387 3272 1 4 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.602 1.782 18387 3273 1 4 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.109 0.242 18387 3274 1 4 . 1 1 139 139 PHE H H 139 7.338 7.338 7.476 -0.138 18387 3275 1 4 . 1 1 140 140 VAL N N 140 116.491 116.491 115.339 1.152 18387 3276 1 4 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.854 -0.330 18387 3277 1 4 . 1 1 140 140 VAL C C 140 177.747 177.747 176.493 1.254 18387 3278 1 4 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.433 0.809 18387 3279 1 4 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.205 0.185 18387 3280 1 4 . 1 1 140 140 VAL H H 140 8.332 8.332 8.260 0.072 18387 3281 1 4 . 1 1 141 141 ASN N N 141 116.956 116.956 117.817 -0.861 18387 3282 1 4 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.791 0.035 18387 3283 1 4 . 1 1 141 141 ASN C C 141 176.997 176.997 174.348 2.649 18387 3284 1 4 . 1 1 141 141 ASN CA C 141 53.677 53.677 52.161 1.516 18387 3285 1 4 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.551 -1.103 18387 3286 1 4 . 1 1 141 141 ASN H H 141 7.862 7.862 7.607 0.255 18387 3287 1 4 . 1 1 142 142 GLY N N 142 107.938 107.938 106.324 1.614 18387 3288 1 4 . 1 1 142 142 GLY C C 142 174.336 174.336 173.395 0.941 18387 3289 1 4 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.533 1.452 18387 3290 1 4 . 1 1 142 142 GLY H H 142 7.466 7.466 7.239 0.227 18387 3291 1 4 . 1 1 143 143 ALA N N 143 123.441 123.441 123.566 -0.125 18387 3292 1 4 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.270 0.071 18387 3293 1 4 . 1 1 143 143 ALA C C 143 178.212 178.212 178.155 0.057 18387 3294 1 4 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.112 -0.286 18387 3295 1 4 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.253 -0.009 18387 3296 1 4 . 1 1 143 143 ALA H H 143 7.950 7.950 8.528 -0.578 18387 3297 1 4 . 1 1 144 144 LYS N N 144 120.149 120.149 114.694 5.455 18387 3298 1 4 . 1 1 144 144 LYS HA H 144 4.295 4.295 3.938 0.357 18387 3299 1 4 . 1 1 144 144 LYS C C 144 176.945 176.945 175.772 1.173 18387 3300 1 4 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.610 -0.091 18387 3301 1 4 . 1 1 144 144 LYS CB C 144 33.030 33.030 30.527 2.503 18387 3302 1 4 . 1 1 144 144 LYS H H 144 8.187 8.187 8.333 -0.146 18387 3303 1 4 . 1 1 145 145 GLU N N 145 120.992 120.992 118.710 2.282 18387 3304 1 4 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.223 0.072 18387 3305 1 4 . 1 1 145 145 GLU C C 145 177.116 177.116 176.951 0.165 18387 3306 1 4 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.484 0.419 18387 3307 1 4 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.725 0.517 18387 3308 1 4 . 1 1 145 145 GLU H H 145 8.363 8.363 8.183 0.180 18387 3309 1 4 . 1 1 146 146 GLY N N 146 109.467 109.467 110.093 -0.626 18387 3310 1 4 . 1 1 146 146 GLY C C 146 174.108 174.108 174.180 -0.072 18387 3311 1 4 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.090 0.311 18387 3312 1 4 . 1 1 146 146 GLY H H 146 8.371 8.371 8.171 0.200 18387 3313 1 4 . 1 1 151 151 HIS HA H 151 4.609 4.609 3.756 0.853 18387 3314 1 4 . 1 1 151 151 HIS C C 151 174.258 174.258 174.178 0.080 18387 3315 1 4 . 1 1 151 151 HIS CA C 151 56.165 56.165 57.527 -1.362 18387 3316 1 4 . 1 1 151 151 HIS CB C 151 30.833 30.833 28.800 2.033 18387 3317 1 5 . 1 1 2 2 SER HA H 2 3.992 3.992 4.149 -0.157 18387 3318 1 5 . 1 1 2 2 SER CA C 2 57.555 57.555 59.086 -1.531 18387 3319 1 5 . 1 1 2 2 SER CB C 2 64.977 64.977 62.019 2.958 18387 3320 1 5 . 1 1 3 3 LEU HA H 3 4.439 4.439 3.898 0.541 18387 3321 1 5 . 1 1 3 3 LEU C C 3 176.631 176.631 175.358 1.273 18387 3322 1 5 . 1 1 3 3 LEU CA C 3 54.564 54.564 56.511 -1.947 18387 3323 1 5 . 1 1 3 3 LEU CB C 3 42.724 42.724 41.062 1.662 18387 3324 1 5 . 1 1 4 4 ALA N N 4 125.483 125.483 119.891 5.592 18387 3325 1 5 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.635 -0.256 18387 3326 1 5 . 1 1 4 4 ALA C C 4 179.642 179.642 176.208 3.434 18387 3327 1 5 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.341 0.394 18387 3328 1 5 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.239 -1.487 18387 3329 1 5 . 1 1 4 4 ALA H H 4 8.483 8.483 7.864 0.619 18387 3330 1 5 . 1 1 5 5 THR HA H 5 3.845 3.845 4.647 -0.802 18387 3331 1 5 . 1 1 5 5 THR C C 5 175.487 175.487 176.258 -0.771 18387 3332 1 5 . 1 1 5 5 THR CA C 5 64.531 64.531 61.769 2.762 18387 3333 1 5 . 1 1 5 5 THR CB C 5 68.108 68.108 68.073 0.035 18387 3334 1 5 . 1 1 6 6 GLY N N 6 114.298 114.298 115.594 -1.296 18387 3335 1 5 . 1 1 6 6 GLY C C 6 174.324 174.324 173.957 0.367 18387 3336 1 5 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.799 0.036 18387 3337 1 5 . 1 1 6 6 GLY H H 6 9.511 9.511 9.098 0.413 18387 3338 1 5 . 1 1 7 7 SER N N 7 115.270 115.270 117.103 -1.833 18387 3339 1 5 . 1 1 7 7 SER HA H 7 4.500 4.500 4.639 -0.139 18387 3340 1 5 . 1 1 7 7 SER C C 7 173.315 173.315 174.420 -1.105 18387 3341 1 5 . 1 1 7 7 SER CA C 7 58.915 58.915 58.081 0.834 18387 3342 1 5 . 1 1 7 7 SER CB C 7 64.308 64.308 64.243 0.065 18387 3343 1 5 . 1 1 7 7 SER H H 7 7.736 7.736 7.860 -0.124 18387 3344 1 5 . 1 1 8 8 VAL N N 8 123.708 123.708 125.565 -1.857 18387 3345 1 5 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.123 -0.291 18387 3346 1 5 . 1 1 8 8 VAL C C 8 176.673 176.673 176.102 0.571 18387 3347 1 5 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.915 0.758 18387 3348 1 5 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.645 0.577 18387 3349 1 5 . 1 1 8 8 VAL H H 8 8.632 8.632 8.554 0.078 18387 3350 1 5 . 1 1 9 9 ALA N N 9 133.040 133.040 132.458 0.582 18387 3351 1 5 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.749 -0.486 18387 3352 1 5 . 1 1 9 9 ALA C C 9 175.404 175.404 175.494 -0.090 18387 3353 1 5 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.601 1.354 18387 3354 1 5 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.818 -0.788 18387 3355 1 5 . 1 1 9 9 ALA H H 9 8.448 8.448 8.797 -0.349 18387 3356 1 5 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.349 -0.018 18387 3357 1 5 . 1 1 10 10 PRO C C 10 175.071 175.071 176.115 -1.044 18387 3358 1 5 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.567 0.074 18387 3359 1 5 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.266 0.058 18387 3360 1 5 . 1 1 11 11 ALA N N 11 124.172 124.172 125.324 -1.152 18387 3361 1 5 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.367 -0.123 18387 3362 1 5 . 1 1 11 11 ALA C C 11 177.688 177.688 177.090 0.598 18387 3363 1 5 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.649 1.972 18387 3364 1 5 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.581 0.746 18387 3365 1 5 . 1 1 11 11 ALA H H 11 8.221 8.221 8.278 -0.057 18387 3366 1 5 . 1 1 12 12 ILE N N 12 117.815 117.815 124.251 -6.436 18387 3367 1 5 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.277 0.051 18387 3368 1 5 . 1 1 12 12 ILE C C 12 175.013 175.013 175.673 -0.660 18387 3369 1 5 . 1 1 12 12 ILE CA C 12 62.166 62.166 59.661 2.505 18387 3370 1 5 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.940 5.350 18387 3371 1 5 . 1 1 12 12 ILE H H 12 7.693 7.693 7.948 -0.255 18387 3372 1 5 . 1 1 13 13 THR N N 13 121.186 121.186 120.183 1.003 18387 3373 1 5 . 1 1 13 13 THR HA H 13 4.840 4.840 5.053 -0.213 18387 3374 1 5 . 1 1 13 13 THR C C 13 172.625 172.625 173.383 -0.758 18387 3375 1 5 . 1 1 13 13 THR CA C 13 62.297 62.297 61.301 0.996 18387 3376 1 5 . 1 1 13 13 THR CB C 13 71.585 71.585 70.535 1.050 18387 3377 1 5 . 1 1 13 13 THR H H 13 8.363 8.363 8.457 -0.094 18387 3378 1 5 . 1 1 14 14 GLY N N 14 110.785 110.785 114.436 -3.651 18387 3379 1 5 . 1 1 14 14 GLY C C 14 170.040 170.040 172.238 -2.198 18387 3380 1 5 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.079 1.311 18387 3381 1 5 . 1 1 14 14 GLY H H 14 7.993 7.993 9.166 -1.173 18387 3382 1 5 . 1 1 15 15 ILE N N 15 119.088 119.088 121.245 -2.157 18387 3383 1 5 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.014 0.111 18387 3384 1 5 . 1 1 15 15 ILE C C 15 176.359 176.359 175.892 0.467 18387 3385 1 5 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.501 -1.887 18387 3386 1 5 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.958 -0.319 18387 3387 1 5 . 1 1 15 15 ILE H H 15 7.973 7.973 8.607 -0.634 18387 3388 1 5 . 1 1 16 16 ASP N N 16 126.633 126.633 127.458 -0.825 18387 3389 1 5 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.141 0.708 18387 3390 1 5 . 1 1 16 16 ASP C C 16 179.190 179.190 177.462 1.728 18387 3391 1 5 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.117 -0.237 18387 3392 1 5 . 1 1 16 16 ASP CB C 16 42.275 42.275 41.769 0.506 18387 3393 1 5 . 1 1 16 16 ASP H H 16 9.335 9.335 8.935 0.400 18387 3394 1 5 . 1 1 17 17 LEU N N 17 116.648 116.648 117.730 -1.082 18387 3395 1 5 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.280 -0.106 18387 3396 1 5 . 1 1 17 17 LEU C C 17 178.432 178.432 178.238 0.194 18387 3397 1 5 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.379 0.602 18387 3398 1 5 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.730 1.256 18387 3399 1 5 . 1 1 17 17 LEU H H 17 8.071 8.071 8.825 -0.754 18387 3400 1 5 . 1 1 18 18 LYS N N 18 117.401 117.401 117.131 0.270 18387 3401 1 5 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.301 0.208 18387 3402 1 5 . 1 1 18 18 LYS C C 18 176.793 176.793 177.574 -0.781 18387 3403 1 5 . 1 1 18 18 LYS CA C 18 55.435 55.435 56.996 -1.561 18387 3404 1 5 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.048 0.014 18387 3405 1 5 . 1 1 18 18 LYS H H 18 8.207 8.207 7.924 0.283 18387 3406 1 5 . 1 1 19 19 GLY N N 19 108.061 108.061 107.306 0.755 18387 3407 1 5 . 1 1 19 19 GLY C C 19 174.649 174.649 173.676 0.973 18387 3408 1 5 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.623 0.974 18387 3409 1 5 . 1 1 19 19 GLY H H 19 8.099 8.099 8.522 -0.423 18387 3410 1 5 . 1 1 20 20 ASN N N 20 121.012 121.012 120.039 0.973 18387 3411 1 5 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.975 -0.070 18387 3412 1 5 . 1 1 20 20 ASN C C 20 174.827 174.827 174.649 0.178 18387 3413 1 5 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.380 0.087 18387 3414 1 5 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.864 -1.188 18387 3415 1 5 . 1 1 20 20 ASN H H 20 8.945 8.945 9.047 -0.102 18387 3416 1 5 . 1 1 21 21 SER N N 21 117.285 117.285 118.247 -0.962 18387 3417 1 5 . 1 1 21 21 SER HA H 21 5.000 5.000 4.931 0.069 18387 3418 1 5 . 1 1 21 21 SER C C 21 174.911 174.911 174.642 0.269 18387 3419 1 5 . 1 1 21 21 SER CA C 21 58.730 58.730 58.233 0.498 18387 3420 1 5 . 1 1 21 21 SER CB C 21 63.162 63.162 62.659 0.503 18387 3421 1 5 . 1 1 21 21 SER H H 21 8.740 8.740 8.731 0.009 18387 3422 1 5 . 1 1 22 22 VAL N N 22 128.665 128.665 128.176 0.489 18387 3423 1 5 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.218 0.162 18387 3424 1 5 . 1 1 22 22 VAL C C 22 176.276 176.276 175.455 0.821 18387 3425 1 5 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.939 1.014 18387 3426 1 5 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.201 2.381 18387 3427 1 5 . 1 1 22 22 VAL H H 22 9.125 9.125 9.181 -0.056 18387 3428 1 5 . 1 1 23 23 SER N N 23 127.457 127.457 121.673 5.784 18387 3429 1 5 . 1 1 23 23 SER HA H 23 5.878 5.878 5.377 0.501 18387 3430 1 5 . 1 1 23 23 SER C C 23 174.436 174.436 175.617 -1.181 18387 3431 1 5 . 1 1 23 23 SER CA C 23 57.101 57.101 57.313 -0.212 18387 3432 1 5 . 1 1 23 23 SER CB C 23 66.078 66.078 65.083 0.995 18387 3433 1 5 . 1 1 23 23 SER H H 23 8.971 8.971 9.418 -0.447 18387 3434 1 5 . 1 1 24 24 LEU N N 24 126.734 126.734 123.768 2.966 18387 3435 1 5 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.777 -0.310 18387 3436 1 5 . 1 1 24 24 LEU C C 24 179.852 179.852 177.768 2.084 18387 3437 1 5 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.375 0.828 18387 3438 1 5 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.149 -0.171 18387 3439 1 5 . 1 1 24 24 LEU H H 24 8.450 8.450 8.910 -0.460 18387 3440 1 5 . 1 1 25 25 ASN N N 25 115.642 115.642 115.034 0.608 18387 3441 1 5 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.498 -0.256 18387 3442 1 5 . 1 1 25 25 ASN C C 25 176.246 176.246 176.414 -0.168 18387 3443 1 5 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.667 -0.297 18387 3444 1 5 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.478 0.293 18387 3445 1 5 . 1 1 25 25 ASN H H 25 8.505 8.505 8.789 -0.284 18387 3446 1 5 . 1 1 26 26 ASP N N 26 119.722 119.722 119.543 0.179 18387 3447 1 5 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.541 -0.336 18387 3448 1 5 . 1 1 26 26 ASP C C 26 176.708 176.708 176.325 0.383 18387 3449 1 5 . 1 1 26 26 ASP CA C 26 56.525 56.525 55.971 0.554 18387 3450 1 5 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.484 -1.204 18387 3451 1 5 . 1 1 26 26 ASP H H 26 7.731 7.731 7.782 -0.051 18387 3452 1 5 . 1 1 27 27 PHE N N 27 116.827 116.827 117.624 -0.797 18387 3453 1 5 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.617 -0.137 18387 3454 1 5 . 1 1 27 27 PHE C C 27 174.227 174.227 174.788 -0.561 18387 3455 1 5 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.341 -0.270 18387 3456 1 5 . 1 1 27 27 PHE CB C 27 39.719 39.719 40.034 -0.315 18387 3457 1 5 . 1 1 27 27 PHE H H 27 7.390 7.390 7.459 -0.069 18387 3458 1 5 . 1 1 28 28 LYS N N 28 120.357 120.357 121.237 -0.880 18387 3459 1 5 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.244 0.143 18387 3460 1 5 . 1 1 28 28 LYS C C 28 177.845 177.845 176.964 0.881 18387 3461 1 5 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.873 0.129 18387 3462 1 5 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.720 -0.176 18387 3463 1 5 . 1 1 28 28 LYS H H 28 6.883 6.883 7.279 -0.396 18387 3464 1 5 . 1 1 29 29 GLY N N 29 112.653 112.653 111.088 1.565 18387 3465 1 5 . 1 1 29 29 GLY C C 29 173.799 173.799 173.779 0.020 18387 3466 1 5 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.693 0.295 18387 3467 1 5 . 1 1 29 29 GLY H H 29 8.930 8.930 8.470 0.460 18387 3468 1 5 . 1 1 30 30 LYS N N 30 120.516 120.516 120.269 0.247 18387 3469 1 5 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.754 -0.119 18387 3470 1 5 . 1 1 30 30 LYS C C 30 176.505 176.505 175.540 0.965 18387 3471 1 5 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.333 0.847 18387 3472 1 5 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.411 -0.554 18387 3473 1 5 . 1 1 30 30 LYS H H 30 8.098 8.098 7.414 0.684 18387 3474 1 5 . 1 1 31 31 TYR N N 31 117.383 117.383 119.767 -2.384 18387 3475 1 5 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.792 -0.138 18387 3476 1 5 . 1 1 31 31 TYR C C 31 175.551 175.551 176.171 -0.620 18387 3477 1 5 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.090 1.075 18387 3478 1 5 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.635 2.558 18387 3479 1 5 . 1 1 31 31 TYR H H 31 8.263 8.263 9.107 -0.844 18387 3480 1 5 . 1 1 32 32 VAL N N 32 120.900 120.900 125.485 -4.585 18387 3481 1 5 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.271 0.168 18387 3482 1 5 . 1 1 32 32 VAL C C 32 175.975 175.975 175.298 0.677 18387 3483 1 5 . 1 1 32 32 VAL CA C 32 59.706 59.706 62.071 -2.365 18387 3484 1 5 . 1 1 32 32 VAL CB C 32 35.507 35.507 31.843 3.664 18387 3485 1 5 . 1 1 32 32 VAL H H 32 9.244 9.244 9.355 -0.111 18387 3486 1 5 . 1 1 33 33 LEU N N 33 130.058 130.058 131.289 -1.231 18387 3487 1 5 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.934 0.239 18387 3488 1 5 . 1 1 33 33 LEU C C 33 174.693 174.693 175.184 -0.491 18387 3489 1 5 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.348 -0.000 18387 3490 1 5 . 1 1 33 33 LEU CB C 33 44.321 44.321 41.767 2.554 18387 3491 1 5 . 1 1 33 33 LEU H H 33 8.161 8.161 8.909 -0.748 18387 3492 1 5 . 1 1 34 34 VAL N N 34 129.232 129.232 129.205 0.027 18387 3493 1 5 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.443 0.539 18387 3494 1 5 . 1 1 34 34 VAL C C 34 174.285 174.285 174.513 -0.228 18387 3495 1 5 . 1 1 34 34 VAL CA C 34 61.506 61.506 62.025 -0.519 18387 3496 1 5 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.113 0.265 18387 3497 1 5 . 1 1 34 34 VAL H H 34 9.296 9.296 9.114 0.182 18387 3498 1 5 . 1 1 35 35 ASP N N 35 123.675 123.675 128.096 -4.421 18387 3499 1 5 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.927 0.422 18387 3500 1 5 . 1 1 35 35 ASP C C 35 174.258 174.258 174.810 -0.552 18387 3501 1 5 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.285 -1.231 18387 3502 1 5 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.622 -2.160 18387 3503 1 5 . 1 1 35 35 ASP H H 35 8.015 8.015 8.328 -0.313 18387 3504 1 5 . 1 1 36 36 PHE N N 36 126.959 126.959 126.491 0.468 18387 3505 1 5 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.474 0.461 18387 3506 1 5 . 1 1 36 36 PHE C C 36 175.432 175.432 175.363 0.069 18387 3507 1 5 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.365 0.730 18387 3508 1 5 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.315 -0.285 18387 3509 1 5 . 1 1 36 36 PHE H H 36 9.171 9.171 8.564 0.607 18387 3510 1 5 . 1 1 37 37 TRP N N 37 120.839 120.839 122.318 -1.479 18387 3511 1 5 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.351 0.406 18387 3512 1 5 . 1 1 37 37 TRP C C 37 172.412 172.412 173.356 -0.944 18387 3513 1 5 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.604 0.305 18387 3514 1 5 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.971 -0.291 18387 3515 1 5 . 1 1 37 37 TRP H H 37 9.280 9.280 9.072 0.208 18387 3516 1 5 . 1 1 38 38 PHE N N 38 109.215 109.215 112.062 -2.847 18387 3517 1 5 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.464 -0.531 18387 3518 1 5 . 1 1 38 38 PHE C C 38 176.141 176.141 173.882 2.259 18387 3519 1 5 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.611 0.400 18387 3520 1 5 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.708 -1.089 18387 3521 1 5 . 1 1 38 38 PHE H H 38 7.062 7.062 7.894 -0.832 18387 3522 1 5 . 1 1 39 39 ALA N N 39 125.193 125.193 122.729 2.464 18387 3523 1 5 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.384 -0.319 18387 3524 1 5 . 1 1 39 39 ALA C C 39 179.349 179.349 176.860 2.489 18387 3525 1 5 . 1 1 39 39 ALA CA C 39 56.064 56.064 52.053 4.011 18387 3526 1 5 . 1 1 39 39 ALA CB C 39 19.897 19.897 16.893 3.004 18387 3527 1 5 . 1 1 39 39 ALA H H 39 10.355 10.355 9.258 1.097 18387 3528 1 5 . 1 1 40 40 GLY N N 40 103.437 103.437 108.053 -4.616 18387 3529 1 5 . 1 1 40 40 GLY C C 40 172.732 172.732 173.537 -0.805 18387 3530 1 5 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.934 -0.998 18387 3531 1 5 . 1 1 40 40 GLY H H 40 8.583 8.583 8.301 0.282 18387 3532 1 5 . 1 1 41 41 CYS N N 41 124.859 124.859 120.420 4.439 18387 3533 1 5 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.315 0.089 18387 3534 1 5 . 1 1 41 41 CYS C C 41 176.620 176.620 175.101 1.519 18387 3535 1 5 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.977 0.398 18387 3536 1 5 . 1 1 41 41 CYS CB C 41 28.376 28.376 26.200 2.176 18387 3537 1 5 . 1 1 41 41 CYS H H 41 6.946 6.946 6.651 0.295 18387 3538 1 5 . 1 1 42 42 SER HA H 42 4.040 4.040 4.055 -0.015 18387 3539 1 5 . 1 1 42 42 SER CA C 42 61.552 61.552 60.986 0.566 18387 3540 1 5 . 1 1 42 42 SER CB C 42 62.675 62.675 62.921 -0.246 18387 3541 1 5 . 1 1 43 43 TRP N N 43 129.748 129.748 120.710 9.038 18387 3542 1 5 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.505 0.044 18387 3543 1 5 . 1 1 43 43 TRP C C 43 180.400 180.400 177.846 2.554 18387 3544 1 5 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.265 1.984 18387 3545 1 5 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.292 0.300 18387 3546 1 5 . 1 1 44 44 CYS N N 44 124.462 124.462 117.474 6.988 18387 3547 1 5 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.129 0.122 18387 3548 1 5 . 1 1 44 44 CYS C C 44 178.643 178.643 177.117 1.526 18387 3549 1 5 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.660 2.189 18387 3550 1 5 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.152 2.269 18387 3551 1 5 . 1 1 44 44 CYS H H 44 9.591 9.591 7.811 1.780 18387 3552 1 5 . 1 1 45 45 ARG N N 45 117.248 117.248 118.444 -1.196 18387 3553 1 5 . 1 1 45 45 ARG HA H 45 4.176 4.176 3.965 0.211 18387 3554 1 5 . 1 1 45 45 ARG C C 45 180.302 180.302 179.002 1.300 18387 3555 1 5 . 1 1 45 45 ARG CA C 45 56.943 56.943 59.059 -2.116 18387 3556 1 5 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.866 -2.236 18387 3557 1 5 . 1 1 45 45 ARG H H 45 7.955 7.955 7.415 0.540 18387 3558 1 5 . 1 1 46 46 LYS N N 46 120.318 120.318 117.921 2.397 18387 3559 1 5 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.424 -0.152 18387 3560 1 5 . 1 1 46 46 LYS C C 46 177.755 177.755 177.955 -0.200 18387 3561 1 5 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.099 1.670 18387 3562 1 5 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.191 0.966 18387 3563 1 5 . 1 1 46 46 LYS H H 46 8.129 8.129 7.850 0.279 18387 3564 1 5 . 1 1 47 47 GLU N N 47 114.278 114.278 117.976 -3.698 18387 3565 1 5 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.810 0.081 18387 3566 1 5 . 1 1 47 47 GLU C C 47 178.701 178.701 177.870 0.831 18387 3567 1 5 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.771 -1.217 18387 3568 1 5 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.880 -0.113 18387 3569 1 5 . 1 1 47 47 GLU H H 47 7.386 7.386 7.811 -0.425 18387 3570 1 5 . 1 1 48 48 THR N N 48 115.665 115.665 117.599 -1.934 18387 3571 1 5 . 1 1 48 48 THR HA H 48 4.048 4.048 4.400 -0.352 18387 3572 1 5 . 1 1 48 48 THR C C 48 172.392 172.392 174.355 -1.963 18387 3573 1 5 . 1 1 48 48 THR CA C 48 69.426 69.426 68.761 0.665 18387 3574 1 5 . 1 1 48 48 THR CB C 48 66.906 66.906 66.621 0.285 18387 3575 1 5 . 1 1 48 48 THR H H 48 7.810 7.810 7.659 0.151 18387 3576 1 5 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.208 0.081 18387 3577 1 5 . 1 1 49 49 PRO C C 49 179.828 179.828 178.831 0.997 18387 3578 1 5 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.229 0.370 18387 3579 1 5 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.781 0.253 18387 3580 1 5 . 1 1 50 50 TYR N N 50 116.950 116.950 117.094 -0.144 18387 3581 1 5 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.369 -0.231 18387 3582 1 5 . 1 1 50 50 TYR C C 50 179.488 179.488 178.715 0.773 18387 3583 1 5 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.789 -0.654 18387 3584 1 5 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.825 0.476 18387 3585 1 5 . 1 1 50 50 TYR H H 50 7.071 7.071 7.201 -0.130 18387 3586 1 5 . 1 1 51 51 LEU N N 51 123.989 123.989 120.416 3.573 18387 3587 1 5 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.865 -0.195 18387 3588 1 5 . 1 1 51 51 LEU C C 51 178.072 178.072 179.097 -1.025 18387 3589 1 5 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.046 0.630 18387 3590 1 5 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.437 1.180 18387 3591 1 5 . 1 1 51 51 LEU H H 51 8.243 8.243 8.764 -0.521 18387 3592 1 5 . 1 1 52 52 LEU N N 52 119.857 119.857 120.364 -0.507 18387 3593 1 5 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.311 0.016 18387 3594 1 5 . 1 1 52 52 LEU C C 52 178.704 178.704 178.192 0.512 18387 3595 1 5 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.438 0.137 18387 3596 1 5 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.776 0.962 18387 3597 1 5 . 1 1 52 52 LEU H H 52 9.085 9.085 8.966 0.119 18387 3598 1 5 . 1 1 53 53 LYS N N 53 118.658 118.658 119.289 -0.631 18387 3599 1 5 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.930 0.179 18387 3600 1 5 . 1 1 53 53 LYS C C 53 179.786 179.786 178.973 0.813 18387 3601 1 5 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.108 -0.387 18387 3602 1 5 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.310 0.849 18387 3603 1 5 . 1 1 53 53 LYS H H 53 7.807 7.807 8.258 -0.451 18387 3604 1 5 . 1 1 54 54 THR N N 54 116.869 116.869 116.228 0.641 18387 3605 1 5 . 1 1 54 54 THR HA H 54 3.965 3.965 4.156 -0.191 18387 3606 1 5 . 1 1 54 54 THR C C 54 175.328 175.328 176.634 -1.306 18387 3607 1 5 . 1 1 54 54 THR CA C 54 67.683 67.683 66.815 0.868 18387 3608 1 5 . 1 1 54 54 THR CB C 54 68.452 68.452 69.111 -0.659 18387 3609 1 5 . 1 1 54 54 THR H H 54 7.771 7.771 8.203 -0.432 18387 3610 1 5 . 1 1 55 55 TYR N N 55 122.202 122.202 122.200 0.002 18387 3611 1 5 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.352 -0.080 18387 3612 1 5 . 1 1 55 55 TYR C C 55 176.809 176.809 177.337 -0.528 18387 3613 1 5 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.755 0.982 18387 3614 1 5 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.496 0.784 18387 3615 1 5 . 1 1 55 55 TYR H H 55 9.145 9.145 8.859 0.286 18387 3616 1 5 . 1 1 56 56 ASN N N 56 113.858 113.858 116.694 -2.836 18387 3617 1 5 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.194 0.070 18387 3618 1 5 . 1 1 56 56 ASN C C 56 177.427 177.427 176.723 0.704 18387 3619 1 5 . 1 1 56 56 ASN CA C 56 55.930 55.930 54.956 0.974 18387 3620 1 5 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.568 -0.614 18387 3621 1 5 . 1 1 56 56 ASN H H 56 8.850 8.850 8.485 0.365 18387 3622 1 5 . 1 1 57 57 ALA N N 57 118.829 118.829 119.428 -0.599 18387 3623 1 5 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.271 -0.207 18387 3624 1 5 . 1 1 57 57 ALA C C 57 180.445 180.445 177.902 2.543 18387 3625 1 5 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.756 0.595 18387 3626 1 5 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.433 -0.239 18387 3627 1 5 . 1 1 57 57 ALA H H 57 7.436 7.436 7.551 -0.115 18387 3628 1 5 . 1 1 58 58 PHE N N 58 112.082 112.082 114.868 -2.786 18387 3629 1 5 . 1 1 58 58 PHE HA H 58 4.921 4.921 5.041 -0.120 18387 3630 1 5 . 1 1 58 58 PHE C C 58 176.999 176.999 175.372 1.627 18387 3631 1 5 . 1 1 58 58 PHE CA C 58 58.067 58.067 56.116 1.951 18387 3632 1 5 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.304 1.186 18387 3633 1 5 . 1 1 58 58 PHE H H 58 7.480 7.480 7.798 -0.318 18387 3634 1 5 . 1 1 59 59 LYS N N 59 120.666 120.666 120.584 0.082 18387 3635 1 5 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.165 0.638 18387 3636 1 5 . 1 1 59 59 LYS C C 59 177.157 177.157 177.428 -0.271 18387 3637 1 5 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.162 -0.081 18387 3638 1 5 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.858 -1.290 18387 3639 1 5 . 1 1 59 59 LYS H H 59 8.411 8.411 7.522 0.889 18387 3640 1 5 . 1 1 60 60 ASP N N 60 118.908 118.908 117.157 1.751 18387 3641 1 5 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.489 0.636 18387 3642 1 5 . 1 1 60 60 ASP C C 60 176.889 176.889 176.901 -0.012 18387 3643 1 5 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.553 -0.904 18387 3644 1 5 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.268 0.444 18387 3645 1 5 . 1 1 60 60 ASP H H 60 8.574 8.574 8.694 -0.120 18387 3646 1 5 . 1 1 61 61 LYS N N 61 121.021 121.021 120.031 0.990 18387 3647 1 5 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.518 0.196 18387 3648 1 5 . 1 1 61 61 LYS C C 61 175.968 175.968 177.279 -1.311 18387 3649 1 5 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.547 -0.410 18387 3650 1 5 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.678 -0.600 18387 3651 1 5 . 1 1 61 61 LYS H H 61 8.278 8.278 7.389 0.889 18387 3652 1 5 . 1 1 62 62 GLY C C 62 173.837 173.837 173.482 0.355 18387 3653 1 5 . 1 1 62 62 GLY CA C 62 47.050 47.050 44.941 2.109 18387 3654 1 5 . 1 1 63 63 PHE N N 63 120.476 120.476 123.306 -2.830 18387 3655 1 5 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.667 0.366 18387 3656 1 5 . 1 1 63 63 PHE C C 63 173.613 173.613 173.181 0.432 18387 3657 1 5 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.650 -0.800 18387 3658 1 5 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.430 -0.755 18387 3659 1 5 . 1 1 63 63 PHE H H 63 7.413 7.413 8.409 -0.996 18387 3660 1 5 . 1 1 64 64 THR N N 64 119.903 119.903 117.209 2.694 18387 3661 1 5 . 1 1 64 64 THR HA H 64 4.097 4.097 4.468 -0.371 18387 3662 1 5 . 1 1 64 64 THR C C 64 170.397 170.397 171.915 -1.518 18387 3663 1 5 . 1 1 64 64 THR CA C 64 60.261 60.261 60.772 -0.511 18387 3664 1 5 . 1 1 64 64 THR CB C 64 69.507 69.507 71.346 -1.839 18387 3665 1 5 . 1 1 64 64 THR H H 64 7.665 7.665 8.209 -0.544 18387 3666 1 5 . 1 1 65 65 ILE N N 65 117.277 117.277 125.074 -7.797 18387 3667 1 5 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.224 0.252 18387 3668 1 5 . 1 1 65 65 ILE C C 65 173.056 173.056 173.777 -0.721 18387 3669 1 5 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.575 -0.867 18387 3670 1 5 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.387 0.458 18387 3671 1 5 . 1 1 65 65 ILE H H 65 7.321 7.321 8.299 -0.978 18387 3672 1 5 . 1 1 66 66 TYR N N 66 131.968 131.968 128.578 3.390 18387 3673 1 5 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.967 0.280 18387 3674 1 5 . 1 1 66 66 TYR C C 66 174.074 174.074 174.681 -0.607 18387 3675 1 5 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.014 -0.049 18387 3676 1 5 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.812 1.305 18387 3677 1 5 . 1 1 66 66 TYR H H 66 9.038 9.038 9.075 -0.037 18387 3678 1 5 . 1 1 67 67 GLY N N 67 114.364 114.364 115.596 -1.232 18387 3679 1 5 . 1 1 67 67 GLY C C 67 172.461 172.461 172.239 0.222 18387 3680 1 5 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.440 0.560 18387 3681 1 5 . 1 1 67 67 GLY H H 67 9.188 9.188 9.116 0.072 18387 3682 1 5 . 1 1 68 68 VAL N N 68 126.938 126.938 120.552 6.386 18387 3683 1 5 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.943 -0.807 18387 3684 1 5 . 1 1 68 68 VAL C C 68 173.822 173.822 173.842 -0.020 18387 3685 1 5 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.381 2.117 18387 3686 1 5 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.873 0.685 18387 3687 1 5 . 1 1 68 68 VAL H H 68 9.309 9.309 8.960 0.349 18387 3688 1 5 . 1 1 69 69 SER N N 69 118.813 118.813 120.471 -1.658 18387 3689 1 5 . 1 1 69 69 SER HA H 69 5.527 5.527 5.278 0.249 18387 3690 1 5 . 1 1 69 69 SER C C 69 175.753 175.753 173.348 2.405 18387 3691 1 5 . 1 1 69 69 SER CA C 69 54.407 54.407 55.288 -0.881 18387 3692 1 5 . 1 1 69 69 SER CB C 69 63.630 63.630 64.617 -0.987 18387 3693 1 5 . 1 1 69 69 SER H H 69 8.124 8.124 8.831 -0.707 18387 3694 1 5 . 1 1 70 70 THR N N 70 113.861 113.861 122.128 -8.267 18387 3695 1 5 . 1 1 70 70 THR HA H 70 4.381 4.381 4.395 -0.014 18387 3696 1 5 . 1 1 70 70 THR C C 70 175.001 175.001 173.281 1.720 18387 3697 1 5 . 1 1 70 70 THR CA C 70 60.259 60.259 59.447 0.812 18387 3698 1 5 . 1 1 70 70 THR CB C 70 67.291 67.291 68.544 -1.253 18387 3699 1 5 . 1 1 70 70 THR H H 70 7.656 7.656 7.942 -0.286 18387 3700 1 5 . 1 1 71 71 ASP N N 71 125.133 125.133 123.371 1.762 18387 3701 1 5 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.471 -0.401 18387 3702 1 5 . 1 1 71 71 ASP C C 71 175.685 175.685 177.138 -1.453 18387 3703 1 5 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.439 3.173 18387 3704 1 5 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.159 0.210 18387 3705 1 5 . 1 1 71 71 ASP H H 71 8.931 8.931 7.595 1.336 18387 3706 1 5 . 1 1 72 72 ARG N N 72 118.814 118.814 119.800 -0.986 18387 3707 1 5 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.100 0.095 18387 3708 1 5 . 1 1 72 72 ARG C C 72 177.300 177.300 176.625 0.675 18387 3709 1 5 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.442 -1.633 18387 3710 1 5 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.828 0.283 18387 3711 1 5 . 1 1 72 72 ARG H H 72 8.057 8.057 8.638 -0.581 18387 3712 1 5 . 1 1 73 73 ARG N N 73 118.174 118.174 116.105 2.069 18387 3713 1 5 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.572 0.182 18387 3714 1 5 . 1 1 73 73 ARG C C 73 176.503 176.503 175.765 0.738 18387 3715 1 5 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.334 0.202 18387 3716 1 5 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.990 -1.962 18387 3717 1 5 . 1 1 73 73 ARG H H 73 8.639 8.639 7.703 0.936 18387 3718 1 5 . 1 1 74 74 GLU N N 74 127.609 127.609 122.325 5.284 18387 3719 1 5 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.090 -0.011 18387 3720 1 5 . 1 1 74 74 GLU C C 74 178.107 178.107 178.088 0.019 18387 3721 1 5 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.585 -0.800 18387 3722 1 5 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.832 0.266 18387 3723 1 5 . 1 1 74 74 GLU H H 74 9.129 9.129 9.018 0.111 18387 3724 1 5 . 1 1 75 75 GLU N N 75 117.874 117.874 119.303 -1.429 18387 3725 1 5 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.168 -0.068 18387 3726 1 5 . 1 1 75 75 GLU C C 75 178.993 178.993 178.833 0.160 18387 3727 1 5 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.230 0.897 18387 3728 1 5 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.601 0.690 18387 3729 1 5 . 1 1 75 75 GLU H H 75 9.745 9.745 8.809 0.936 18387 3730 1 5 . 1 1 76 76 ASP N N 76 119.182 119.182 120.019 -0.837 18387 3731 1 5 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.437 -0.071 18387 3732 1 5 . 1 1 76 76 ASP C C 76 178.107 178.107 178.380 -0.273 18387 3733 1 5 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.516 -0.542 18387 3734 1 5 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.605 -0.085 18387 3735 1 5 . 1 1 76 76 ASP H H 76 7.004 7.004 8.431 -1.427 18387 3736 1 5 . 1 1 77 77 TRP N N 77 123.008 123.008 122.676 0.332 18387 3737 1 5 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.288 -0.139 18387 3738 1 5 . 1 1 77 77 TRP C C 77 176.236 176.236 177.942 -1.706 18387 3739 1 5 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.701 -0.218 18387 3740 1 5 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.112 -0.577 18387 3741 1 5 . 1 1 77 77 TRP H H 77 7.112 7.112 8.086 -0.974 18387 3742 1 5 . 1 1 78 78 LYS N N 78 115.727 115.727 118.755 -3.028 18387 3743 1 5 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.336 -0.091 18387 3744 1 5 . 1 1 78 78 LYS C C 78 179.426 179.426 179.021 0.405 18387 3745 1 5 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.595 0.837 18387 3746 1 5 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.661 1.084 18387 3747 1 5 . 1 1 78 78 LYS H H 78 8.431 8.431 8.483 -0.052 18387 3748 1 5 . 1 1 79 79 LYS N N 79 118.321 118.321 119.030 -0.709 18387 3749 1 5 . 1 1 79 79 LYS HA H 79 4.020 4.020 4.033 -0.013 18387 3750 1 5 . 1 1 79 79 LYS C C 79 178.239 178.239 178.687 -0.448 18387 3751 1 5 . 1 1 79 79 LYS CA C 79 59.067 59.067 58.903 0.164 18387 3752 1 5 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.476 -0.013 18387 3753 1 5 . 1 1 79 79 LYS H H 79 7.690 7.690 8.060 -0.370 18387 3754 1 5 . 1 1 80 80 ALA N N 80 120.679 120.679 122.142 -1.463 18387 3755 1 5 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.466 -0.311 18387 3756 1 5 . 1 1 80 80 ALA C C 80 178.811 178.811 180.083 -1.272 18387 3757 1 5 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.869 0.218 18387 3758 1 5 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.417 0.341 18387 3759 1 5 . 1 1 80 80 ALA H H 80 7.560 7.560 8.064 -0.504 18387 3760 1 5 . 1 1 81 81 ILE N N 81 118.019 118.019 118.900 -0.881 18387 3761 1 5 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.589 -0.187 18387 3762 1 5 . 1 1 81 81 ILE C C 81 178.113 178.113 178.237 -0.124 18387 3763 1 5 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.479 0.041 18387 3764 1 5 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.712 0.492 18387 3765 1 5 . 1 1 81 81 ILE H H 81 7.514 7.514 8.057 -0.543 18387 3766 1 5 . 1 1 82 82 GLU N N 82 117.252 117.252 119.643 -2.391 18387 3767 1 5 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.883 0.211 18387 3768 1 5 . 1 1 82 82 GLU C C 82 179.558 179.558 178.859 0.699 18387 3769 1 5 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.520 0.060 18387 3770 1 5 . 1 1 82 82 GLU CB C 82 29.383 29.383 28.843 0.539 18387 3771 1 5 . 1 1 82 82 GLU H H 82 7.401 7.401 7.612 -0.211 18387 3772 1 5 . 1 1 83 83 GLU N N 83 119.340 119.340 119.052 0.288 18387 3773 1 5 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.034 -0.136 18387 3774 1 5 . 1 1 83 83 GLU C C 83 178.740 178.740 178.005 0.735 18387 3775 1 5 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.922 0.076 18387 3776 1 5 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.688 0.232 18387 3777 1 5 . 1 1 83 83 GLU H H 83 8.191 8.191 8.038 0.153 18387 3778 1 5 . 1 1 84 84 ASP N N 84 118.449 118.449 116.325 2.124 18387 3779 1 5 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.648 -0.374 18387 3780 1 5 . 1 1 84 84 ASP C C 84 175.597 175.597 175.309 0.288 18387 3781 1 5 . 1 1 84 84 ASP CA C 84 55.047 55.047 53.948 1.099 18387 3782 1 5 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.655 -1.759 18387 3783 1 5 . 1 1 84 84 ASP H H 84 8.252 8.252 7.751 0.501 18387 3784 1 5 . 1 1 85 85 LYS N N 85 116.410 116.410 115.986 0.424 18387 3785 1 5 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.163 0.010 18387 3786 1 5 . 1 1 85 85 LYS C C 85 176.856 176.856 175.314 1.542 18387 3787 1 5 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.410 -0.437 18387 3788 1 5 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.501 -0.633 18387 3789 1 5 . 1 1 85 85 LYS H H 85 7.890 7.890 7.696 0.194 18387 3790 1 5 . 1 1 86 86 SER N N 86 112.295 112.295 113.634 -1.339 18387 3791 1 5 . 1 1 86 86 SER HA H 86 3.139 3.139 3.470 -0.331 18387 3792 1 5 . 1 1 86 86 SER C C 86 175.805 175.805 173.019 2.786 18387 3793 1 5 . 1 1 86 86 SER CA C 86 53.637 53.637 57.205 -3.568 18387 3794 1 5 . 1 1 86 86 SER CB C 86 60.736 60.736 61.269 -0.533 18387 3795 1 5 . 1 1 86 86 SER H H 86 7.327 7.327 7.185 0.142 18387 3796 1 5 . 1 1 87 87 TYR N N 87 120.962 120.962 124.306 -3.344 18387 3797 1 5 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.135 0.170 18387 3798 1 5 . 1 1 87 87 TYR C C 87 177.064 177.064 174.644 2.420 18387 3799 1 5 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.341 -1.118 18387 3800 1 5 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.511 -0.158 18387 3801 1 5 . 1 1 87 87 TYR H H 87 6.933 6.933 7.327 -0.394 18387 3802 1 5 . 1 1 88 88 TRP N N 88 118.597 118.597 119.499 -0.902 18387 3803 1 5 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.684 0.167 18387 3804 1 5 . 1 1 88 88 TRP C C 88 175.456 175.456 174.583 0.873 18387 3805 1 5 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.633 1.603 18387 3806 1 5 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.300 -3.573 18387 3807 1 5 . 1 1 88 88 TRP H H 88 6.552 6.552 6.988 -0.436 18387 3808 1 5 . 1 1 89 89 ASN N N 89 118.067 118.067 120.870 -2.803 18387 3809 1 5 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.843 0.206 18387 3810 1 5 . 1 1 89 89 ASN C C 89 173.773 173.773 174.861 -1.088 18387 3811 1 5 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.638 1.818 18387 3812 1 5 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.959 1.238 18387 3813 1 5 . 1 1 89 89 ASN H H 89 7.864 7.864 8.899 -1.035 18387 3814 1 5 . 1 1 90 90 GLN N N 90 125.392 125.392 121.788 3.604 18387 3815 1 5 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.502 -0.005 18387 3816 1 5 . 1 1 90 90 GLN C C 90 176.491 176.491 175.423 1.068 18387 3817 1 5 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.614 0.846 18387 3818 1 5 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.938 -1.711 18387 3819 1 5 . 1 1 90 90 GLN H H 90 7.904 7.904 8.249 -0.345 18387 3820 1 5 . 1 1 91 91 VAL N N 91 114.434 114.434 115.524 -1.090 18387 3821 1 5 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.868 0.612 18387 3822 1 5 . 1 1 91 91 VAL C C 91 174.248 174.248 172.920 1.328 18387 3823 1 5 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.232 -0.226 18387 3824 1 5 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.377 1.262 18387 3825 1 5 . 1 1 91 91 VAL H H 91 9.585 9.585 9.180 0.405 18387 3826 1 5 . 1 1 92 92 LEU N N 92 126.910 126.910 124.337 2.573 18387 3827 1 5 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.277 -0.208 18387 3828 1 5 . 1 1 92 92 LEU C C 92 177.696 177.696 175.670 2.026 18387 3829 1 5 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.507 0.338 18387 3830 1 5 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.450 0.497 18387 3831 1 5 . 1 1 92 92 LEU H H 92 8.941 8.941 8.348 0.593 18387 3832 1 5 . 1 1 93 93 LEU N N 93 125.673 125.673 128.738 -3.065 18387 3833 1 5 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.269 0.131 18387 3834 1 5 . 1 1 93 93 LEU C C 93 177.291 177.291 176.350 0.941 18387 3835 1 5 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.027 -0.076 18387 3836 1 5 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.989 1.190 18387 3837 1 5 . 1 1 93 93 LEU H H 93 8.038 8.038 8.391 -0.353 18387 3838 1 5 . 1 1 94 94 GLN N N 94 122.206 122.206 121.414 0.792 18387 3839 1 5 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.117 0.120 18387 3840 1 5 . 1 1 94 94 GLN C C 94 178.246 178.246 176.919 1.327 18387 3841 1 5 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.150 -0.375 18387 3842 1 5 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.405 -0.150 18387 3843 1 5 . 1 1 94 94 GLN H H 94 9.298 9.298 8.419 0.879 18387 3844 1 5 . 1 1 95 95 LYS N N 95 122.668 122.668 123.359 -0.691 18387 3845 1 5 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.992 -0.026 18387 3846 1 5 . 1 1 95 95 LYS C C 95 178.787 178.787 177.877 0.910 18387 3847 1 5 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.715 1.357 18387 3848 1 5 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.003 0.462 18387 3849 1 5 . 1 1 95 95 LYS H H 95 8.645 8.645 8.770 -0.125 18387 3850 1 5 . 1 1 96 96 ASP N N 96 116.775 116.775 118.456 -1.681 18387 3851 1 5 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.603 -0.023 18387 3852 1 5 . 1 1 96 96 ASP C C 96 176.220 176.220 177.616 -1.396 18387 3853 1 5 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.120 0.226 18387 3854 1 5 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.978 -0.421 18387 3855 1 5 . 1 1 96 96 ASP H H 96 8.606 8.606 8.054 0.552 18387 3856 1 5 . 1 1 97 97 ASP N N 97 118.213 118.213 119.994 -1.781 18387 3857 1 5 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.358 0.569 18387 3858 1 5 . 1 1 97 97 ASP C C 97 176.954 176.954 178.537 -1.583 18387 3859 1 5 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.934 -1.575 18387 3860 1 5 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.707 1.617 18387 3861 1 5 . 1 1 97 97 ASP H H 97 7.988 7.988 8.260 -0.272 18387 3862 1 5 . 1 1 98 98 VAL N N 98 118.907 118.907 119.690 -0.783 18387 3863 1 5 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.518 -0.102 18387 3864 1 5 . 1 1 98 98 VAL C C 98 176.470 176.470 177.382 -0.912 18387 3865 1 5 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.172 1.606 18387 3866 1 5 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.432 0.959 18387 3867 1 5 . 1 1 98 98 VAL H H 98 7.098 7.098 8.564 -1.466 18387 3868 1 5 . 1 1 99 99 LYS N N 99 117.909 117.909 120.615 -2.706 18387 3869 1 5 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.839 0.104 18387 3870 1 5 . 1 1 99 99 LYS C C 99 178.762 178.762 178.130 0.632 18387 3871 1 5 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.563 -0.418 18387 3872 1 5 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.011 0.001 18387 3873 1 5 . 1 1 99 99 LYS H H 99 8.304 8.304 7.737 0.567 18387 3874 1 5 . 1 1 100 100 ASP N N 100 117.843 117.843 119.081 -1.238 18387 3875 1 5 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.395 0.083 18387 3876 1 5 . 1 1 100 100 ASP C C 100 179.694 179.694 179.070 0.624 18387 3877 1 5 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.860 -0.334 18387 3878 1 5 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.469 0.359 18387 3879 1 5 . 1 1 100 100 ASP H H 100 8.024 8.024 7.750 0.274 18387 3880 1 5 . 1 1 101 101 VAL N N 101 122.202 122.202 120.674 1.528 18387 3881 1 5 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.745 0.250 18387 3882 1 5 . 1 1 101 101 VAL C C 101 178.533 178.533 177.945 0.588 18387 3883 1 5 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.992 0.010 18387 3884 1 5 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.928 0.109 18387 3885 1 5 . 1 1 101 101 VAL H H 101 8.205 8.205 8.091 0.114 18387 3886 1 5 . 1 1 102 102 LEU N N 102 118.798 118.798 118.887 -0.089 18387 3887 1 5 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.869 -0.089 18387 3888 1 5 . 1 1 102 102 LEU C C 102 180.254 180.254 179.040 1.214 18387 3889 1 5 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.030 0.911 18387 3890 1 5 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.425 -0.987 18387 3891 1 5 . 1 1 102 102 LEU H H 102 8.422 8.422 8.461 -0.039 18387 3892 1 5 . 1 1 103 103 GLU N N 103 116.915 116.915 119.756 -2.841 18387 3893 1 5 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.929 0.206 18387 3894 1 5 . 1 1 103 103 GLU C C 103 180.910 180.910 179.488 1.422 18387 3895 1 5 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.645 -0.242 18387 3896 1 5 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.777 -0.046 18387 3897 1 5 . 1 1 103 103 GLU H H 103 8.262 8.262 8.246 0.016 18387 3898 1 5 . 1 1 104 104 SER N N 104 117.866 117.866 116.457 1.409 18387 3899 1 5 . 1 1 104 104 SER HA H 104 4.216 4.216 4.107 0.109 18387 3900 1 5 . 1 1 104 104 SER C C 104 175.455 175.455 176.498 -1.043 18387 3901 1 5 . 1 1 104 104 SER CA C 104 62.019 62.019 62.094 -0.075 18387 3902 1 5 . 1 1 104 104 SER CB C 104 62.891 62.891 63.155 -0.264 18387 3903 1 5 . 1 1 104 104 SER H H 104 8.544 8.544 8.297 0.247 18387 3904 1 5 . 1 1 105 105 TYR N N 105 117.278 117.278 119.137 -1.859 18387 3905 1 5 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.463 -0.191 18387 3906 1 5 . 1 1 105 105 TYR C C 105 174.750 174.750 175.317 -0.567 18387 3907 1 5 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.661 1.198 18387 3908 1 5 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.259 2.452 18387 3909 1 5 . 1 1 105 105 TYR H H 105 7.691 7.691 7.702 -0.011 18387 3910 1 5 . 1 1 106 106 CYS N N 106 116.897 116.897 116.115 0.782 18387 3911 1 5 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.051 -0.156 18387 3912 1 5 . 1 1 106 106 CYS C C 106 174.056 174.056 173.826 0.230 18387 3913 1 5 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.423 -0.813 18387 3914 1 5 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.820 0.212 18387 3915 1 5 . 1 1 106 106 CYS H H 106 7.862 7.862 8.275 -0.413 18387 3916 1 5 . 1 1 107 107 ILE N N 107 118.885 118.885 119.781 -0.896 18387 3917 1 5 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.568 -0.229 18387 3918 1 5 . 1 1 107 107 ILE C C 107 176.793 176.793 174.955 1.838 18387 3919 1 5 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.935 0.810 18387 3920 1 5 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.038 1.041 18387 3921 1 5 . 1 1 107 107 ILE H H 107 7.707 7.707 8.021 -0.314 18387 3922 1 5 . 1 1 108 108 VAL N N 108 123.983 123.983 126.929 -2.946 18387 3923 1 5 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.165 0.109 18387 3924 1 5 . 1 1 108 108 VAL C C 108 175.476 175.476 175.124 0.352 18387 3925 1 5 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.427 0.197 18387 3926 1 5 . 1 1 108 108 VAL CB C 108 33.008 33.008 33.322 -0.314 18387 3927 1 5 . 1 1 108 108 VAL H H 108 8.656 8.656 8.085 0.571 18387 3928 1 5 . 1 1 109 109 GLY N N 109 110.120 110.120 106.515 3.605 18387 3929 1 5 . 1 1 109 109 GLY C C 109 169.982 169.982 172.034 -2.052 18387 3930 1 5 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.070 -0.467 18387 3931 1 5 . 1 1 109 109 GLY H H 109 7.500 7.500 7.053 0.447 18387 3932 1 5 . 1 1 110 110 PHE N N 110 115.276 115.276 118.269 -2.993 18387 3933 1 5 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.035 -0.261 18387 3934 1 5 . 1 1 110 110 PHE C C 110 174.361 174.361 174.093 0.268 18387 3935 1 5 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.881 -0.194 18387 3936 1 5 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.545 1.405 18387 3937 1 5 . 1 1 110 110 PHE H H 110 8.203 8.203 8.268 -0.065 18387 3938 1 5 . 1 1 111 111 PRO HA H 111 5.359 5.359 4.974 0.385 18387 3939 1 5 . 1 1 111 111 PRO C C 111 175.691 175.691 175.757 -0.066 18387 3940 1 5 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.008 0.149 18387 3941 1 5 . 1 1 111 111 PRO CB C 111 35.304 35.304 32.514 2.790 18387 3942 1 5 . 1 1 112 112 HIS N N 112 123.708 123.708 125.241 -1.533 18387 3943 1 5 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.995 -0.032 18387 3944 1 5 . 1 1 112 112 HIS C C 112 173.649 173.649 173.943 -0.294 18387 3945 1 5 . 1 1 112 112 HIS CA C 112 57.074 57.074 54.910 2.164 18387 3946 1 5 . 1 1 112 112 HIS CB C 112 32.197 32.197 30.950 1.247 18387 3947 1 5 . 1 1 112 112 HIS H H 112 8.952 8.952 8.966 -0.014 18387 3948 1 5 . 1 1 113 113 ILE N N 113 128.596 128.596 127.666 0.930 18387 3949 1 5 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.113 0.584 18387 3950 1 5 . 1 1 113 113 ILE C C 113 176.130 176.130 174.150 1.980 18387 3951 1 5 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.938 1.058 18387 3952 1 5 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.062 -3.007 18387 3953 1 5 . 1 1 113 113 ILE H H 113 8.808 8.808 8.222 0.586 18387 3954 1 5 . 1 1 114 114 ILE N N 114 119.668 119.668 121.249 -1.581 18387 3955 1 5 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.685 0.288 18387 3956 1 5 . 1 1 114 114 ILE C C 114 173.186 173.186 173.283 -0.097 18387 3957 1 5 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.982 -0.252 18387 3958 1 5 . 1 1 114 114 ILE CB C 114 42.540 42.540 41.996 0.544 18387 3959 1 5 . 1 1 114 114 ILE H H 114 8.721 8.721 8.774 -0.053 18387 3960 1 5 . 1 1 115 115 LEU N N 115 122.770 122.770 126.081 -3.311 18387 3961 1 5 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.164 0.111 18387 3962 1 5 . 1 1 115 115 LEU C C 115 173.601 173.601 174.704 -1.103 18387 3963 1 5 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.134 0.648 18387 3964 1 5 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.325 1.809 18387 3965 1 5 . 1 1 115 115 LEU H H 115 8.665 8.665 8.911 -0.246 18387 3966 1 5 . 1 1 116 116 VAL N N 116 130.411 130.411 128.638 1.773 18387 3967 1 5 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.009 -0.151 18387 3968 1 5 . 1 1 116 116 VAL C C 116 174.565 174.565 175.724 -1.159 18387 3969 1 5 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.735 0.069 18387 3970 1 5 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.569 0.346 18387 3971 1 5 . 1 1 116 116 VAL H H 116 9.472 9.472 9.182 0.290 18387 3972 1 5 . 1 1 117 117 ASP N N 117 127.896 127.896 126.931 0.965 18387 3973 1 5 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.520 -0.128 18387 3974 1 5 . 1 1 117 117 ASP C C 117 176.567 176.567 175.778 0.789 18387 3975 1 5 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.806 0.794 18387 3976 1 5 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.275 0.309 18387 3977 1 5 . 1 1 117 117 ASP H H 117 9.429 9.429 8.774 0.655 18387 3978 1 5 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.166 0.028 18387 3979 1 5 . 1 1 118 118 PRO C C 118 177.534 177.534 176.979 0.555 18387 3980 1 5 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.925 0.240 18387 3981 1 5 . 1 1 118 118 PRO CB C 118 32.813 32.813 32.009 0.804 18387 3982 1 5 . 1 1 119 119 GLU N N 119 114.015 114.015 116.835 -2.820 18387 3983 1 5 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.253 0.086 18387 3984 1 5 . 1 1 119 119 GLU C C 119 176.722 176.722 177.287 -0.565 18387 3985 1 5 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.390 -1.751 18387 3986 1 5 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.644 -0.067 18387 3987 1 5 . 1 1 119 119 GLU H H 119 7.733 7.733 7.879 -0.146 18387 3988 1 5 . 1 1 120 120 GLY N N 120 108.218 108.218 105.318 2.900 18387 3989 1 5 . 1 1 120 120 GLY C C 120 174.110 174.110 172.964 1.146 18387 3990 1 5 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.687 0.709 18387 3991 1 5 . 1 1 120 120 GLY H H 120 8.588 8.588 8.816 -0.228 18387 3992 1 5 . 1 1 121 121 LYS N N 121 121.778 121.778 120.306 1.472 18387 3993 1 5 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.044 -0.185 18387 3994 1 5 . 1 1 121 121 LYS C C 121 176.458 176.458 175.432 1.026 18387 3995 1 5 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.523 0.439 18387 3996 1 5 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.607 -2.155 18387 3997 1 5 . 1 1 121 121 LYS H H 121 8.600 8.600 8.775 -0.175 18387 3998 1 5 . 1 1 122 122 ILE N N 122 122.058 122.058 123.449 -1.391 18387 3999 1 5 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.495 -0.223 18387 4000 1 5 . 1 1 122 122 ILE C C 122 177.084 177.084 176.802 0.282 18387 4001 1 5 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.048 0.771 18387 4002 1 5 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.137 1.511 18387 4003 1 5 . 1 1 122 122 ILE H H 122 9.006 9.006 9.035 -0.029 18387 4004 1 5 . 1 1 123 123 VAL N N 123 120.561 120.561 130.285 -9.724 18387 4005 1 5 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.029 0.726 18387 4006 1 5 . 1 1 123 123 VAL C C 123 175.584 175.584 174.659 0.925 18387 4007 1 5 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.158 -2.007 18387 4008 1 5 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.824 0.577 18387 4009 1 5 . 1 1 123 123 VAL H H 123 9.054 9.054 8.398 0.656 18387 4010 1 5 . 1 1 124 124 ALA N N 124 121.102 121.102 118.450 2.652 18387 4011 1 5 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.475 0.182 18387 4012 1 5 . 1 1 124 124 ALA C C 124 174.832 174.832 174.440 0.392 18387 4013 1 5 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.462 0.998 18387 4014 1 5 . 1 1 124 124 ALA CB C 124 22.830 22.830 20.787 2.043 18387 4015 1 5 . 1 1 124 124 ALA H H 124 7.793 7.793 7.353 0.440 18387 4016 1 5 . 1 1 125 125 LYS N N 125 117.637 117.637 118.625 -0.988 18387 4017 1 5 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.561 0.472 18387 4018 1 5 . 1 1 125 125 LYS C C 125 173.417 173.417 175.550 -2.133 18387 4019 1 5 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.443 -0.302 18387 4020 1 5 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.065 1.587 18387 4021 1 5 . 1 1 125 125 LYS H H 125 8.872 8.872 8.091 0.781 18387 4022 1 5 . 1 1 126 126 GLU N N 126 115.236 115.236 114.866 0.370 18387 4023 1 5 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.931 0.067 18387 4024 1 5 . 1 1 126 126 GLU C C 126 175.998 175.998 175.545 0.453 18387 4025 1 5 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.529 -0.567 18387 4026 1 5 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.378 -0.943 18387 4027 1 5 . 1 1 126 126 GLU H H 126 7.941 7.941 8.697 -0.756 18387 4028 1 5 . 1 1 127 127 LEU N N 127 118.584 118.584 119.067 -0.483 18387 4029 1 5 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.016 0.366 18387 4030 1 5 . 1 1 127 127 LEU C C 127 176.766 176.766 176.978 -0.212 18387 4031 1 5 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.556 -0.947 18387 4032 1 5 . 1 1 127 127 LEU CB C 127 43.963 43.963 41.962 2.002 18387 4033 1 5 . 1 1 127 127 LEU H H 127 7.300 7.300 7.409 -0.109 18387 4034 1 5 . 1 1 128 128 ARG N N 128 118.625 118.625 122.086 -3.461 18387 4035 1 5 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.613 -0.138 18387 4036 1 5 . 1 1 128 128 ARG C C 128 177.113 177.113 176.733 0.380 18387 4037 1 5 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.449 -1.059 18387 4038 1 5 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.683 0.929 18387 4039 1 5 . 1 1 128 128 ARG H H 128 7.929 7.929 7.986 -0.057 18387 4040 1 5 . 1 1 129 129 GLY N N 129 114.010 114.010 113.957 0.053 18387 4041 1 5 . 1 1 129 129 GLY C C 129 175.931 175.931 174.789 1.142 18387 4042 1 5 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.373 -0.912 18387 4043 1 5 . 1 1 129 129 GLY H H 129 10.649 10.649 9.322 1.327 18387 4044 1 5 . 1 1 130 130 ASP N N 130 123.975 123.975 122.472 1.503 18387 4045 1 5 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.549 -0.017 18387 4046 1 5 . 1 1 130 130 ASP C C 130 177.507 177.507 177.529 -0.022 18387 4047 1 5 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.514 0.858 18387 4048 1 5 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.956 -0.053 18387 4049 1 5 . 1 1 130 130 ASP H H 130 8.540 8.540 8.300 0.240 18387 4050 1 5 . 1 1 131 131 ASP N N 131 116.806 116.806 121.156 -4.350 18387 4051 1 5 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.438 0.132 18387 4052 1 5 . 1 1 131 131 ASP C C 131 179.038 179.038 178.279 0.759 18387 4053 1 5 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.842 0.141 18387 4054 1 5 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.818 0.116 18387 4055 1 5 . 1 1 131 131 ASP H H 131 7.907 7.907 7.964 -0.057 18387 4056 1 5 . 1 1 132 132 LEU N N 132 123.869 123.869 120.409 3.460 18387 4057 1 5 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.851 -0.060 18387 4058 1 5 . 1 1 132 132 LEU C C 132 176.343 176.343 178.570 -2.227 18387 4059 1 5 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.385 1.399 18387 4060 1 5 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.494 0.274 18387 4061 1 5 . 1 1 132 132 LEU H H 132 7.542 7.542 7.522 0.020 18387 4062 1 5 . 1 1 133 133 TYR N N 133 120.042 120.042 118.870 1.172 18387 4063 1 5 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.201 -0.205 18387 4064 1 5 . 1 1 133 133 TYR C C 133 177.426 177.426 177.578 -0.152 18387 4065 1 5 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.928 0.205 18387 4066 1 5 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.430 0.146 18387 4067 1 5 . 1 1 133 133 TYR H H 133 7.384 7.384 7.694 -0.310 18387 4068 1 5 . 1 1 134 134 ASN N N 134 114.936 114.936 116.755 -1.819 18387 4069 1 5 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.558 -0.155 18387 4070 1 5 . 1 1 134 134 ASN C C 134 178.703 178.703 178.015 0.688 18387 4071 1 5 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.337 -0.529 18387 4072 1 5 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.108 0.100 18387 4073 1 5 . 1 1 134 134 ASN H H 134 8.399 8.399 8.632 -0.233 18387 4074 1 5 . 1 1 135 135 THR N N 135 117.387 117.387 117.414 -0.027 18387 4075 1 5 . 1 1 135 135 THR HA H 135 3.920 3.920 4.185 -0.265 18387 4076 1 5 . 1 1 135 135 THR C C 135 175.323 175.323 175.935 -0.612 18387 4077 1 5 . 1 1 135 135 THR CA C 135 67.402 67.402 66.641 0.761 18387 4078 1 5 . 1 1 135 135 THR CB C 135 68.111 68.111 68.603 -0.492 18387 4079 1 5 . 1 1 135 135 THR H H 135 8.265 8.265 8.555 -0.290 18387 4080 1 5 . 1 1 136 136 VAL N N 136 121.207 121.207 121.366 -0.159 18387 4081 1 5 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.244 -0.229 18387 4082 1 5 . 1 1 136 136 VAL C C 136 176.457 176.457 177.082 -0.625 18387 4083 1 5 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.141 2.131 18387 4084 1 5 . 1 1 136 136 VAL CB C 136 30.941 30.941 29.958 0.983 18387 4085 1 5 . 1 1 136 136 VAL H H 136 7.595 7.595 7.480 0.115 18387 4086 1 5 . 1 1 137 137 GLU N N 137 118.266 118.266 118.207 0.059 18387 4087 1 5 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.673 -0.991 18387 4088 1 5 . 1 1 137 137 GLU C C 137 177.482 177.482 177.874 -0.392 18387 4089 1 5 . 1 1 137 137 GLU CA C 137 59.930 59.930 58.700 1.230 18387 4090 1 5 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.184 0.598 18387 4091 1 5 . 1 1 137 137 GLU H H 137 8.114 8.114 7.335 0.779 18387 4092 1 5 . 1 1 138 138 LYS N N 138 116.431 116.431 118.646 -2.215 18387 4093 1 5 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.965 -0.197 18387 4094 1 5 . 1 1 138 138 LYS C C 138 179.193 179.193 178.216 0.977 18387 4095 1 5 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.100 -0.060 18387 4096 1 5 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.624 -0.466 18387 4097 1 5 . 1 1 138 138 LYS H H 138 7.133 7.133 7.329 -0.196 18387 4098 1 5 . 1 1 139 139 PHE N N 139 116.336 116.336 115.166 1.170 18387 4099 1 5 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.272 -0.262 18387 4100 1 5 . 1 1 139 139 PHE C C 139 177.855 177.855 177.592 0.263 18387 4101 1 5 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.222 1.162 18387 4102 1 5 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.482 -0.130 18387 4103 1 5 . 1 1 139 139 PHE H H 139 7.338 7.338 8.381 -1.043 18387 4104 1 5 . 1 1 140 140 VAL N N 140 116.491 116.491 118.098 -1.607 18387 4105 1 5 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.059 0.465 18387 4106 1 5 . 1 1 140 140 VAL C C 140 177.747 177.747 177.431 0.316 18387 4107 1 5 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.122 0.120 18387 4108 1 5 . 1 1 140 140 VAL CB C 140 31.390 31.390 30.867 0.523 18387 4109 1 5 . 1 1 140 140 VAL H H 140 8.332 8.332 7.568 0.764 18387 4110 1 5 . 1 1 141 141 ASN N N 141 116.956 116.956 116.443 0.513 18387 4111 1 5 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.557 0.269 18387 4112 1 5 . 1 1 141 141 ASN C C 141 176.997 176.997 176.187 0.810 18387 4113 1 5 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.501 -0.824 18387 4114 1 5 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.382 -0.934 18387 4115 1 5 . 1 1 141 141 ASN H H 141 7.862 7.862 7.930 -0.068 18387 4116 1 5 . 1 1 142 142 GLY N N 142 107.938 107.938 107.277 0.661 18387 4117 1 5 . 1 1 142 142 GLY C C 142 174.336 174.336 174.540 -0.204 18387 4118 1 5 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.447 0.538 18387 4119 1 5 . 1 1 142 142 GLY H H 142 7.466 7.466 8.133 -0.667 18387 4120 1 5 . 1 1 143 143 ALA N N 143 123.441 123.441 121.332 2.109 18387 4121 1 5 . 1 1 143 143 ALA HA H 143 4.341 4.341 3.910 0.431 18387 4122 1 5 . 1 1 143 143 ALA C C 143 178.212 178.212 176.624 1.588 18387 4123 1 5 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.722 0.104 18387 4124 1 5 . 1 1 143 143 ALA CB C 143 19.244 19.244 17.603 1.641 18387 4125 1 5 . 1 1 143 143 ALA H H 143 7.950 7.950 7.974 -0.024 18387 4126 1 5 . 1 1 144 144 LYS N N 144 120.149 120.149 118.566 1.583 18387 4127 1 5 . 1 1 144 144 LYS HA H 144 4.295 4.295 3.947 0.348 18387 4128 1 5 . 1 1 144 144 LYS C C 144 176.945 176.945 175.170 1.775 18387 4129 1 5 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.738 -0.219 18387 4130 1 5 . 1 1 144 144 LYS CB C 144 33.030 33.030 31.053 1.977 18387 4131 1 5 . 1 1 144 144 LYS H H 144 8.187 8.187 8.112 0.075 18387 4132 1 5 . 1 1 145 145 GLU N N 145 120.992 120.992 122.401 -1.409 18387 4133 1 5 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.495 -0.200 18387 4134 1 5 . 1 1 145 145 GLU C C 145 177.116 177.116 176.373 0.743 18387 4135 1 5 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.652 1.251 18387 4136 1 5 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.692 -0.449 18387 4137 1 5 . 1 1 145 145 GLU H H 145 8.363 8.363 8.338 0.025 18387 4138 1 5 . 1 1 146 146 GLY N N 146 109.467 109.467 111.415 -1.948 18387 4139 1 5 . 1 1 146 146 GLY C C 146 174.108 174.108 173.782 0.326 18387 4140 1 5 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.883 0.518 18387 4141 1 5 . 1 1 146 146 GLY H H 146 8.371 8.371 8.921 -0.550 18387 4142 1 5 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.606 0.003 18387 4143 1 5 . 1 1 151 151 HIS C C 151 174.258 174.258 174.410 -0.152 18387 4144 1 5 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.713 0.452 18387 4145 1 5 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.680 0.153 18387 4146 1 6 . 1 1 2 2 SER HA H 2 3.992 3.992 4.103 -0.111 18387 4147 1 6 . 1 1 2 2 SER CA C 2 57.555 57.555 58.651 -1.096 18387 4148 1 6 . 1 1 2 2 SER CB C 2 64.977 64.977 63.196 1.781 18387 4149 1 6 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.357 0.082 18387 4150 1 6 . 1 1 3 3 LEU C C 3 176.631 176.631 177.045 -0.414 18387 4151 1 6 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.573 -0.009 18387 4152 1 6 . 1 1 3 3 LEU CB C 3 42.724 42.724 39.997 2.727 18387 4153 1 6 . 1 1 4 4 ALA N N 4 125.483 125.483 129.862 -4.379 18387 4154 1 6 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.525 -0.146 18387 4155 1 6 . 1 1 4 4 ALA C C 4 179.642 179.642 176.679 2.963 18387 4156 1 6 . 1 1 4 4 ALA CA C 4 51.735 51.735 53.209 -1.474 18387 4157 1 6 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.265 -0.513 18387 4158 1 6 . 1 1 4 4 ALA H H 4 8.483 8.483 8.396 0.087 18387 4159 1 6 . 1 1 5 5 THR HA H 5 3.845 3.845 4.847 -1.002 18387 4160 1 6 . 1 1 5 5 THR C C 5 175.487 175.487 175.284 0.203 18387 4161 1 6 . 1 1 5 5 THR CA C 5 64.531 64.531 60.814 3.717 18387 4162 1 6 . 1 1 5 5 THR CB C 5 68.108 68.108 70.925 -2.817 18387 4163 1 6 . 1 1 6 6 GLY N N 6 114.298 114.298 113.973 0.325 18387 4164 1 6 . 1 1 6 6 GLY C C 6 174.324 174.324 174.623 -0.299 18387 4165 1 6 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.430 -0.595 18387 4166 1 6 . 1 1 6 6 GLY H H 6 9.511 9.511 9.142 0.369 18387 4167 1 6 . 1 1 7 7 SER N N 7 115.270 115.270 118.001 -2.731 18387 4168 1 6 . 1 1 7 7 SER HA H 7 4.500 4.500 4.447 0.053 18387 4169 1 6 . 1 1 7 7 SER C C 7 173.315 173.315 174.321 -1.006 18387 4170 1 6 . 1 1 7 7 SER CA C 7 58.915 58.915 58.836 0.079 18387 4171 1 6 . 1 1 7 7 SER CB C 7 64.308 64.308 63.603 0.705 18387 4172 1 6 . 1 1 7 7 SER H H 7 7.736 7.736 7.903 -0.167 18387 4173 1 6 . 1 1 8 8 VAL N N 8 123.708 123.708 126.593 -2.885 18387 4174 1 6 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.053 -0.221 18387 4175 1 6 . 1 1 8 8 VAL C C 8 176.673 176.673 175.578 1.095 18387 4176 1 6 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.748 1.925 18387 4177 1 6 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.846 -0.624 18387 4178 1 6 . 1 1 8 8 VAL H H 8 8.632 8.632 8.541 0.091 18387 4179 1 6 . 1 1 9 9 ALA N N 9 133.040 133.040 132.186 0.854 18387 4180 1 6 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.599 -0.336 18387 4181 1 6 . 1 1 9 9 ALA C C 9 175.404 175.404 175.098 0.306 18387 4182 1 6 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.560 1.395 18387 4183 1 6 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.718 -0.688 18387 4184 1 6 . 1 1 9 9 ALA H H 9 8.448 8.448 8.832 -0.384 18387 4185 1 6 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.351 -0.020 18387 4186 1 6 . 1 1 10 10 PRO C C 10 175.071 175.071 175.746 -0.675 18387 4187 1 6 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.391 0.250 18387 4188 1 6 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.420 -0.096 18387 4189 1 6 . 1 1 11 11 ALA N N 11 124.172 124.172 122.973 1.199 18387 4190 1 6 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.517 -0.273 18387 4191 1 6 . 1 1 11 11 ALA C C 11 177.688 177.688 177.604 0.084 18387 4192 1 6 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.561 2.060 18387 4193 1 6 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.563 -0.236 18387 4194 1 6 . 1 1 11 11 ALA H H 11 8.221 8.221 8.254 -0.033 18387 4195 1 6 . 1 1 12 12 ILE N N 12 117.815 117.815 125.556 -7.741 18387 4196 1 6 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.262 0.066 18387 4197 1 6 . 1 1 12 12 ILE C C 12 175.013 175.013 175.632 -0.619 18387 4198 1 6 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.395 0.771 18387 4199 1 6 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.142 5.148 18387 4200 1 6 . 1 1 12 12 ILE H H 12 7.693 7.693 8.600 -0.907 18387 4201 1 6 . 1 1 13 13 THR N N 13 121.186 121.186 122.882 -1.696 18387 4202 1 6 . 1 1 13 13 THR HA H 13 4.840 4.840 5.047 -0.207 18387 4203 1 6 . 1 1 13 13 THR C C 13 172.625 172.625 173.954 -1.329 18387 4204 1 6 . 1 1 13 13 THR CA C 13 62.297 62.297 61.538 0.759 18387 4205 1 6 . 1 1 13 13 THR CB C 13 71.585 71.585 69.134 2.451 18387 4206 1 6 . 1 1 13 13 THR H H 13 8.363 8.363 8.685 -0.322 18387 4207 1 6 . 1 1 14 14 GLY N N 14 110.785 110.785 111.663 -0.878 18387 4208 1 6 . 1 1 14 14 GLY C C 14 170.040 170.040 172.244 -2.204 18387 4209 1 6 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.817 1.573 18387 4210 1 6 . 1 1 14 14 GLY H H 14 7.993 7.993 9.091 -1.098 18387 4211 1 6 . 1 1 15 15 ILE N N 15 119.088 119.088 121.631 -2.543 18387 4212 1 6 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.101 0.024 18387 4213 1 6 . 1 1 15 15 ILE C C 15 176.359 176.359 176.335 0.024 18387 4214 1 6 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.950 -2.336 18387 4215 1 6 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.934 -0.296 18387 4216 1 6 . 1 1 15 15 ILE H H 15 7.973 7.973 8.881 -0.908 18387 4217 1 6 . 1 1 16 16 ASP N N 16 126.633 126.633 127.377 -0.744 18387 4218 1 6 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.011 0.838 18387 4219 1 6 . 1 1 16 16 ASP C C 16 179.190 179.190 177.546 1.644 18387 4220 1 6 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.339 -0.459 18387 4221 1 6 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.620 -0.345 18387 4222 1 6 . 1 1 16 16 ASP H H 16 9.335 9.335 8.737 0.598 18387 4223 1 6 . 1 1 17 17 LEU N N 17 116.648 116.648 118.261 -1.613 18387 4224 1 6 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.081 0.093 18387 4225 1 6 . 1 1 17 17 LEU C C 17 178.432 178.432 179.143 -0.711 18387 4226 1 6 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.565 0.416 18387 4227 1 6 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.679 1.307 18387 4228 1 6 . 1 1 17 17 LEU H H 17 8.071 8.071 8.779 -0.708 18387 4229 1 6 . 1 1 18 18 LYS N N 18 117.401 117.401 118.004 -0.603 18387 4230 1 6 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.224 0.285 18387 4231 1 6 . 1 1 18 18 LYS C C 18 176.793 176.793 177.586 -0.793 18387 4232 1 6 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.891 -2.456 18387 4233 1 6 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.477 -0.414 18387 4234 1 6 . 1 1 18 18 LYS H H 18 8.207 8.207 8.992 -0.785 18387 4235 1 6 . 1 1 19 19 GLY N N 19 108.061 108.061 106.402 1.659 18387 4236 1 6 . 1 1 19 19 GLY C C 19 174.649 174.649 173.877 0.772 18387 4237 1 6 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.618 0.979 18387 4238 1 6 . 1 1 19 19 GLY H H 19 8.099 8.099 8.597 -0.498 18387 4239 1 6 . 1 1 20 20 ASN N N 20 121.012 121.012 119.833 1.179 18387 4240 1 6 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.094 -0.189 18387 4241 1 6 . 1 1 20 20 ASN C C 20 174.827 174.827 174.915 -0.088 18387 4242 1 6 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.234 0.233 18387 4243 1 6 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.290 -1.614 18387 4244 1 6 . 1 1 20 20 ASN H H 20 8.945 8.945 9.374 -0.429 18387 4245 1 6 . 1 1 21 21 SER N N 21 117.285 117.285 117.112 0.173 18387 4246 1 6 . 1 1 21 21 SER HA H 21 5.000 5.000 4.757 0.243 18387 4247 1 6 . 1 1 21 21 SER C C 21 174.911 174.911 174.131 0.780 18387 4248 1 6 . 1 1 21 21 SER CA C 21 58.730 58.730 58.358 0.372 18387 4249 1 6 . 1 1 21 21 SER CB C 21 63.162 63.162 62.860 0.302 18387 4250 1 6 . 1 1 21 21 SER H H 21 8.740 8.740 8.609 0.131 18387 4251 1 6 . 1 1 22 22 VAL N N 22 128.665 128.665 127.571 1.094 18387 4252 1 6 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.259 0.121 18387 4253 1 6 . 1 1 22 22 VAL C C 22 176.276 176.276 175.040 1.236 18387 4254 1 6 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.109 0.844 18387 4255 1 6 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.681 1.901 18387 4256 1 6 . 1 1 22 22 VAL H H 22 9.125 9.125 9.124 0.001 18387 4257 1 6 . 1 1 23 23 SER N N 23 127.457 127.457 119.186 8.271 18387 4258 1 6 . 1 1 23 23 SER HA H 23 5.878 5.878 5.679 0.199 18387 4259 1 6 . 1 1 23 23 SER C C 23 174.436 174.436 175.968 -1.532 18387 4260 1 6 . 1 1 23 23 SER CA C 23 57.101 57.101 56.185 0.916 18387 4261 1 6 . 1 1 23 23 SER CB C 23 66.078 66.078 65.817 0.261 18387 4262 1 6 . 1 1 23 23 SER H H 23 8.971 8.971 9.072 -0.102 18387 4263 1 6 . 1 1 24 24 LEU N N 24 126.734 126.734 124.339 2.395 18387 4264 1 6 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.996 -0.529 18387 4265 1 6 . 1 1 24 24 LEU C C 24 179.852 179.852 177.660 2.192 18387 4266 1 6 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.415 0.788 18387 4267 1 6 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.024 -0.046 18387 4268 1 6 . 1 1 24 24 LEU H H 24 8.450 8.450 8.796 -0.346 18387 4269 1 6 . 1 1 25 25 ASN N N 25 115.642 115.642 115.431 0.211 18387 4270 1 6 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.435 -0.193 18387 4271 1 6 . 1 1 25 25 ASN C C 25 176.246 176.246 176.442 -0.196 18387 4272 1 6 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.595 -0.225 18387 4273 1 6 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.591 1.180 18387 4274 1 6 . 1 1 25 25 ASN H H 25 8.505 8.505 8.678 -0.173 18387 4275 1 6 . 1 1 26 26 ASP N N 26 119.722 119.722 120.525 -0.803 18387 4276 1 6 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.333 -0.129 18387 4277 1 6 . 1 1 26 26 ASP C C 26 176.708 176.708 176.037 0.671 18387 4278 1 6 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.589 -0.064 18387 4279 1 6 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.501 -1.220 18387 4280 1 6 . 1 1 26 26 ASP H H 26 7.731 7.731 7.946 -0.215 18387 4281 1 6 . 1 1 27 27 PHE N N 27 116.827 116.827 115.839 0.988 18387 4282 1 6 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.623 -0.143 18387 4283 1 6 . 1 1 27 27 PHE C C 27 174.227 174.227 175.418 -1.191 18387 4284 1 6 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.151 -0.081 18387 4285 1 6 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.620 0.099 18387 4286 1 6 . 1 1 27 27 PHE H H 27 7.390 7.390 7.281 0.109 18387 4287 1 6 . 1 1 28 28 LYS N N 28 120.357 120.357 119.974 0.383 18387 4288 1 6 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.069 0.318 18387 4289 1 6 . 1 1 28 28 LYS C C 28 177.845 177.845 177.541 0.304 18387 4290 1 6 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.359 0.643 18387 4291 1 6 . 1 1 28 28 LYS CB C 28 32.544 32.544 33.056 -0.512 18387 4292 1 6 . 1 1 28 28 LYS H H 28 6.883 6.883 7.274 -0.391 18387 4293 1 6 . 1 1 29 29 GLY N N 29 112.653 112.653 107.446 5.207 18387 4294 1 6 . 1 1 29 29 GLY C C 29 173.799 173.799 173.084 0.715 18387 4295 1 6 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.482 -0.494 18387 4296 1 6 . 1 1 29 29 GLY H H 29 8.930 8.930 8.595 0.335 18387 4297 1 6 . 1 1 30 30 LYS N N 30 120.516 120.516 117.171 3.345 18387 4298 1 6 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.619 0.016 18387 4299 1 6 . 1 1 30 30 LYS C C 30 176.505 176.505 175.198 1.307 18387 4300 1 6 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.437 0.743 18387 4301 1 6 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.072 -1.215 18387 4302 1 6 . 1 1 30 30 LYS H H 30 8.098 8.098 7.275 0.823 18387 4303 1 6 . 1 1 31 31 TYR N N 31 117.383 117.383 121.087 -3.704 18387 4304 1 6 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.744 -0.090 18387 4305 1 6 . 1 1 31 31 TYR C C 31 175.551 175.551 175.426 0.125 18387 4306 1 6 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.767 1.398 18387 4307 1 6 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.406 2.787 18387 4308 1 6 . 1 1 31 31 TYR H H 31 8.263 8.263 9.088 -0.825 18387 4309 1 6 . 1 1 32 32 VAL N N 32 120.900 120.900 124.423 -3.523 18387 4310 1 6 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.648 -0.209 18387 4311 1 6 . 1 1 32 32 VAL C C 32 175.975 175.975 175.293 0.682 18387 4312 1 6 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.595 -0.889 18387 4313 1 6 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.646 2.861 18387 4314 1 6 . 1 1 32 32 VAL H H 32 9.244 9.244 9.174 0.070 18387 4315 1 6 . 1 1 33 33 LEU N N 33 130.058 130.058 129.832 0.226 18387 4316 1 6 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.926 0.247 18387 4317 1 6 . 1 1 33 33 LEU C C 33 174.693 174.693 176.475 -1.782 18387 4318 1 6 . 1 1 33 33 LEU CA C 33 53.348 53.348 54.146 -0.798 18387 4319 1 6 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.127 2.194 18387 4320 1 6 . 1 1 33 33 LEU H H 33 8.161 8.161 8.683 -0.522 18387 4321 1 6 . 1 1 34 34 VAL N N 34 129.232 129.232 126.459 2.773 18387 4322 1 6 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.231 0.751 18387 4323 1 6 . 1 1 34 34 VAL C C 34 174.285 174.285 174.543 -0.258 18387 4324 1 6 . 1 1 34 34 VAL CA C 34 61.506 61.506 62.109 -0.603 18387 4325 1 6 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.206 0.171 18387 4326 1 6 . 1 1 34 34 VAL H H 34 9.296 9.296 9.162 0.134 18387 4327 1 6 . 1 1 35 35 ASP N N 35 123.675 123.675 128.833 -5.158 18387 4328 1 6 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.947 0.402 18387 4329 1 6 . 1 1 35 35 ASP C C 35 174.258 174.258 174.390 -0.132 18387 4330 1 6 . 1 1 35 35 ASP CA C 35 51.054 51.054 51.997 -0.943 18387 4331 1 6 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.837 -2.375 18387 4332 1 6 . 1 1 35 35 ASP H H 35 8.015 8.015 8.872 -0.857 18387 4333 1 6 . 1 1 36 36 PHE N N 36 126.959 126.959 126.352 0.607 18387 4334 1 6 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.584 0.351 18387 4335 1 6 . 1 1 36 36 PHE C C 36 175.432 175.432 175.269 0.163 18387 4336 1 6 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.479 0.616 18387 4337 1 6 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.518 -0.488 18387 4338 1 6 . 1 1 36 36 PHE H H 36 9.171 9.171 8.388 0.783 18387 4339 1 6 . 1 1 37 37 TRP N N 37 120.839 120.839 121.915 -1.076 18387 4340 1 6 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.287 0.470 18387 4341 1 6 . 1 1 37 37 TRP C C 37 172.412 172.412 173.391 -0.979 18387 4342 1 6 . 1 1 37 37 TRP CA C 37 55.909 55.909 56.114 -0.205 18387 4343 1 6 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.845 -0.165 18387 4344 1 6 . 1 1 37 37 TRP H H 37 9.280 9.280 9.304 -0.024 18387 4345 1 6 . 1 1 38 38 PHE N N 38 109.215 109.215 112.156 -2.941 18387 4346 1 6 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.481 -0.548 18387 4347 1 6 . 1 1 38 38 PHE C C 38 176.141 176.141 173.863 2.278 18387 4348 1 6 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.506 0.505 18387 4349 1 6 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.070 -0.451 18387 4350 1 6 . 1 1 38 38 PHE H H 38 7.062 7.062 8.263 -1.201 18387 4351 1 6 . 1 1 39 39 ALA N N 39 125.193 125.193 121.806 3.387 18387 4352 1 6 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.095 -0.030 18387 4353 1 6 . 1 1 39 39 ALA C C 39 179.349 179.349 178.814 0.535 18387 4354 1 6 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.563 1.501 18387 4355 1 6 . 1 1 39 39 ALA CB C 39 19.897 19.897 19.129 0.768 18387 4356 1 6 . 1 1 39 39 ALA H H 39 10.355 10.355 9.261 1.094 18387 4357 1 6 . 1 1 40 40 GLY N N 40 103.437 103.437 106.747 -3.310 18387 4358 1 6 . 1 1 40 40 GLY C C 40 172.732 172.732 173.935 -1.203 18387 4359 1 6 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.760 -0.824 18387 4360 1 6 . 1 1 40 40 GLY H H 40 8.583 8.583 8.321 0.262 18387 4361 1 6 . 1 1 41 41 CYS N N 41 124.859 124.859 121.583 3.276 18387 4362 1 6 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.004 0.400 18387 4363 1 6 . 1 1 41 41 CYS C C 41 176.620 176.620 174.633 1.987 18387 4364 1 6 . 1 1 41 41 CYS CA C 41 58.375 58.375 59.227 -0.852 18387 4365 1 6 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.369 1.007 18387 4366 1 6 . 1 1 41 41 CYS H H 41 6.946 6.946 6.674 0.272 18387 4367 1 6 . 1 1 42 42 SER HA H 42 4.040 4.040 4.239 -0.199 18387 4368 1 6 . 1 1 42 42 SER CA C 42 61.552 61.552 59.518 2.034 18387 4369 1 6 . 1 1 42 42 SER CB C 42 62.675 62.675 63.070 -0.395 18387 4370 1 6 . 1 1 43 43 TRP N N 43 129.748 129.748 121.890 7.858 18387 4371 1 6 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.445 0.104 18387 4372 1 6 . 1 1 43 43 TRP C C 43 180.400 180.400 177.985 2.415 18387 4373 1 6 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.149 1.100 18387 4374 1 6 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.007 0.585 18387 4375 1 6 . 1 1 44 44 CYS N N 44 124.462 124.462 117.747 6.715 18387 4376 1 6 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.225 0.026 18387 4377 1 6 . 1 1 44 44 CYS C C 44 178.643 178.643 176.951 1.692 18387 4378 1 6 . 1 1 44 44 CYS CA C 44 64.849 64.849 61.360 3.489 18387 4379 1 6 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.553 1.869 18387 4380 1 6 . 1 1 44 44 CYS H H 44 9.591 9.591 8.294 1.297 18387 4381 1 6 . 1 1 45 45 ARG N N 45 117.248 117.248 116.765 0.483 18387 4382 1 6 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.306 -0.130 18387 4383 1 6 . 1 1 45 45 ARG C C 45 180.302 180.302 176.681 3.621 18387 4384 1 6 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.803 -0.861 18387 4385 1 6 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.946 -2.315 18387 4386 1 6 . 1 1 45 45 ARG H H 45 7.955 7.955 8.248 -0.293 18387 4387 1 6 . 1 1 46 46 LYS N N 46 120.318 120.318 118.509 1.809 18387 4388 1 6 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.320 -0.048 18387 4389 1 6 . 1 1 46 46 LYS C C 46 177.755 177.755 178.039 -0.284 18387 4390 1 6 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.911 0.858 18387 4391 1 6 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.971 0.186 18387 4392 1 6 . 1 1 46 46 LYS H H 46 8.129 8.129 7.691 0.438 18387 4393 1 6 . 1 1 47 47 GLU N N 47 114.278 114.278 118.033 -3.755 18387 4394 1 6 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.704 0.187 18387 4395 1 6 . 1 1 47 47 GLU C C 47 178.701 178.701 178.263 0.438 18387 4396 1 6 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.867 -1.313 18387 4397 1 6 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.716 0.050 18387 4398 1 6 . 1 1 47 47 GLU H H 47 7.386 7.386 7.969 -0.583 18387 4399 1 6 . 1 1 48 48 THR N N 48 115.665 115.665 117.186 -1.521 18387 4400 1 6 . 1 1 48 48 THR HA H 48 4.048 4.048 4.276 -0.228 18387 4401 1 6 . 1 1 48 48 THR C C 48 172.392 172.392 174.493 -2.101 18387 4402 1 6 . 1 1 48 48 THR CA C 48 69.426 69.426 68.697 0.729 18387 4403 1 6 . 1 1 48 48 THR CB C 48 66.906 66.906 66.421 0.485 18387 4404 1 6 . 1 1 48 48 THR H H 48 7.810 7.810 7.538 0.272 18387 4405 1 6 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.149 0.140 18387 4406 1 6 . 1 1 49 49 PRO C C 49 179.828 179.828 178.729 1.099 18387 4407 1 6 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.574 0.025 18387 4408 1 6 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.024 0.010 18387 4409 1 6 . 1 1 50 50 TYR N N 50 116.950 116.950 116.736 0.214 18387 4410 1 6 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.166 -0.028 18387 4411 1 6 . 1 1 50 50 TYR C C 50 179.488 179.488 178.567 0.921 18387 4412 1 6 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.795 -0.660 18387 4413 1 6 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.914 0.386 18387 4414 1 6 . 1 1 50 50 TYR H H 50 7.071 7.071 7.329 -0.258 18387 4415 1 6 . 1 1 51 51 LEU N N 51 123.989 123.989 120.055 3.934 18387 4416 1 6 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.780 -0.110 18387 4417 1 6 . 1 1 51 51 LEU C C 51 178.072 178.072 179.075 -1.003 18387 4418 1 6 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.896 0.780 18387 4419 1 6 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.150 1.467 18387 4420 1 6 . 1 1 51 51 LEU H H 51 8.243 8.243 8.349 -0.106 18387 4421 1 6 . 1 1 52 52 LEU N N 52 119.857 119.857 119.839 0.018 18387 4422 1 6 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.341 -0.014 18387 4423 1 6 . 1 1 52 52 LEU C C 52 178.704 178.704 178.262 0.442 18387 4424 1 6 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.526 0.049 18387 4425 1 6 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.838 0.900 18387 4426 1 6 . 1 1 52 52 LEU H H 52 9.085 9.085 8.746 0.339 18387 4427 1 6 . 1 1 53 53 LYS N N 53 118.658 118.658 119.030 -0.372 18387 4428 1 6 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.968 0.141 18387 4429 1 6 . 1 1 53 53 LYS C C 53 179.786 179.786 178.976 0.810 18387 4430 1 6 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.874 -0.153 18387 4431 1 6 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.170 0.989 18387 4432 1 6 . 1 1 53 53 LYS H H 53 7.807 7.807 8.097 -0.290 18387 4433 1 6 . 1 1 54 54 THR N N 54 116.869 116.869 116.715 0.154 18387 4434 1 6 . 1 1 54 54 THR HA H 54 3.965 3.965 4.369 -0.404 18387 4435 1 6 . 1 1 54 54 THR C C 54 175.328 175.328 176.839 -1.511 18387 4436 1 6 . 1 1 54 54 THR CA C 54 67.683 67.683 67.010 0.673 18387 4437 1 6 . 1 1 54 54 THR CB C 54 68.452 68.452 68.947 -0.495 18387 4438 1 6 . 1 1 54 54 THR H H 54 7.771 7.771 8.329 -0.558 18387 4439 1 6 . 1 1 55 55 TYR N N 55 122.202 122.202 122.971 -0.769 18387 4440 1 6 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.326 -0.054 18387 4441 1 6 . 1 1 55 55 TYR C C 55 176.809 176.809 177.441 -0.632 18387 4442 1 6 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.999 0.738 18387 4443 1 6 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.546 0.734 18387 4444 1 6 . 1 1 55 55 TYR H H 55 9.145 9.145 8.803 0.342 18387 4445 1 6 . 1 1 56 56 ASN N N 56 113.858 113.858 117.705 -3.847 18387 4446 1 6 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.256 0.007 18387 4447 1 6 . 1 1 56 56 ASN C C 56 177.427 177.427 177.448 -0.021 18387 4448 1 6 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.183 -0.253 18387 4449 1 6 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.162 -0.208 18387 4450 1 6 . 1 1 56 56 ASN H H 56 8.850 8.850 8.553 0.297 18387 4451 1 6 . 1 1 57 57 ALA N N 57 118.829 118.829 121.397 -2.568 18387 4452 1 6 . 1 1 57 57 ALA HA H 57 4.064 4.064 3.877 0.187 18387 4453 1 6 . 1 1 57 57 ALA C C 57 180.445 180.445 178.029 2.416 18387 4454 1 6 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.818 -0.467 18387 4455 1 6 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.462 0.732 18387 4456 1 6 . 1 1 57 57 ALA H H 57 7.436 7.436 8.011 -0.575 18387 4457 1 6 . 1 1 58 58 PHE N N 58 112.082 112.082 114.082 -2.000 18387 4458 1 6 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.787 0.134 18387 4459 1 6 . 1 1 58 58 PHE C C 58 176.999 176.999 176.977 0.022 18387 4460 1 6 . 1 1 58 58 PHE CA C 58 58.067 58.067 56.976 1.091 18387 4461 1 6 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.250 1.240 18387 4462 1 6 . 1 1 58 58 PHE H H 58 7.480 7.480 7.773 -0.293 18387 4463 1 6 . 1 1 59 59 LYS N N 59 120.666 120.666 121.510 -0.844 18387 4464 1 6 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.287 0.516 18387 4465 1 6 . 1 1 59 59 LYS C C 59 177.157 177.157 176.935 0.222 18387 4466 1 6 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.232 -0.151 18387 4467 1 6 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.718 -1.150 18387 4468 1 6 . 1 1 59 59 LYS H H 59 8.411 8.411 7.814 0.597 18387 4469 1 6 . 1 1 60 60 ASP N N 60 118.908 118.908 115.629 3.279 18387 4470 1 6 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.779 0.346 18387 4471 1 6 . 1 1 60 60 ASP C C 60 176.889 176.889 176.615 0.274 18387 4472 1 6 . 1 1 60 60 ASP CA C 60 54.649 54.649 54.675 -0.026 18387 4473 1 6 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.926 0.786 18387 4474 1 6 . 1 1 60 60 ASP H H 60 8.574 8.574 8.364 0.210 18387 4475 1 6 . 1 1 61 61 LYS N N 61 121.021 121.021 119.546 1.475 18387 4476 1 6 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.705 0.009 18387 4477 1 6 . 1 1 61 61 LYS C C 61 175.968 175.968 176.245 -0.277 18387 4478 1 6 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.497 -0.360 18387 4479 1 6 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.425 0.652 18387 4480 1 6 . 1 1 61 61 LYS H H 61 8.278 8.278 7.741 0.537 18387 4481 1 6 . 1 1 62 62 GLY C C 62 173.837 173.837 173.643 0.194 18387 4482 1 6 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.499 1.551 18387 4483 1 6 . 1 1 63 63 PHE N N 63 120.476 120.476 119.924 0.552 18387 4484 1 6 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.753 0.280 18387 4485 1 6 . 1 1 63 63 PHE C C 63 173.613 173.613 173.061 0.552 18387 4486 1 6 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.424 -0.574 18387 4487 1 6 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.047 -0.372 18387 4488 1 6 . 1 1 63 63 PHE H H 63 7.413 7.413 7.823 -0.410 18387 4489 1 6 . 1 1 64 64 THR N N 64 119.903 119.903 117.415 2.488 18387 4490 1 6 . 1 1 64 64 THR HA H 64 4.097 4.097 4.647 -0.550 18387 4491 1 6 . 1 1 64 64 THR C C 64 170.397 170.397 172.092 -1.695 18387 4492 1 6 . 1 1 64 64 THR CA C 64 60.261 60.261 60.290 -0.029 18387 4493 1 6 . 1 1 64 64 THR CB C 64 69.507 69.507 71.740 -2.233 18387 4494 1 6 . 1 1 64 64 THR H H 64 7.665 7.665 8.547 -0.882 18387 4495 1 6 . 1 1 65 65 ILE N N 65 117.277 117.277 123.665 -6.388 18387 4496 1 6 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.294 0.182 18387 4497 1 6 . 1 1 65 65 ILE C C 65 173.056 173.056 173.757 -0.701 18387 4498 1 6 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.643 -0.935 18387 4499 1 6 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.949 -0.104 18387 4500 1 6 . 1 1 65 65 ILE H H 65 7.321 7.321 8.564 -1.243 18387 4501 1 6 . 1 1 66 66 TYR N N 66 131.968 131.968 129.582 2.386 18387 4502 1 6 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.899 0.348 18387 4503 1 6 . 1 1 66 66 TYR C C 66 174.074 174.074 174.657 -0.583 18387 4504 1 6 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.380 -0.415 18387 4505 1 6 . 1 1 66 66 TYR CB C 66 41.117 41.117 38.996 2.121 18387 4506 1 6 . 1 1 66 66 TYR H H 66 9.038 9.038 9.248 -0.210 18387 4507 1 6 . 1 1 67 67 GLY N N 67 114.364 114.364 115.904 -1.540 18387 4508 1 6 . 1 1 67 67 GLY C C 67 172.461 172.461 172.948 -0.487 18387 4509 1 6 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.469 0.531 18387 4510 1 6 . 1 1 67 67 GLY H H 67 9.188 9.188 8.887 0.301 18387 4511 1 6 . 1 1 68 68 VAL N N 68 126.938 126.938 127.826 -0.888 18387 4512 1 6 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.404 -0.268 18387 4513 1 6 . 1 1 68 68 VAL C C 68 173.822 173.822 174.500 -0.678 18387 4514 1 6 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.305 0.193 18387 4515 1 6 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.162 1.396 18387 4516 1 6 . 1 1 68 68 VAL H H 68 9.309 9.309 9.291 0.018 18387 4517 1 6 . 1 1 69 69 SER N N 69 118.813 118.813 121.786 -2.973 18387 4518 1 6 . 1 1 69 69 SER HA H 69 5.527 5.527 5.095 0.432 18387 4519 1 6 . 1 1 69 69 SER C C 69 175.753 175.753 173.692 2.061 18387 4520 1 6 . 1 1 69 69 SER CA C 69 54.407 54.407 55.577 -1.170 18387 4521 1 6 . 1 1 69 69 SER CB C 69 63.630 63.630 65.089 -1.459 18387 4522 1 6 . 1 1 69 69 SER H H 69 8.124 8.124 9.004 -0.880 18387 4523 1 6 . 1 1 70 70 THR N N 70 113.861 113.861 120.194 -6.333 18387 4524 1 6 . 1 1 70 70 THR HA H 70 4.381 4.381 4.444 -0.063 18387 4525 1 6 . 1 1 70 70 THR C C 70 175.001 175.001 173.739 1.262 18387 4526 1 6 . 1 1 70 70 THR CA C 70 60.259 60.259 59.818 0.441 18387 4527 1 6 . 1 1 70 70 THR CB C 70 67.291 67.291 68.843 -1.552 18387 4528 1 6 . 1 1 70 70 THR H H 70 7.656 7.656 7.916 -0.260 18387 4529 1 6 . 1 1 71 71 ASP N N 71 125.133 125.133 123.390 1.743 18387 4530 1 6 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.358 -0.288 18387 4531 1 6 . 1 1 71 71 ASP C C 71 175.685 175.685 176.778 -1.093 18387 4532 1 6 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.807 1.805 18387 4533 1 6 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.078 0.291 18387 4534 1 6 . 1 1 71 71 ASP H H 71 8.931 8.931 7.554 1.377 18387 4535 1 6 . 1 1 72 72 ARG N N 72 118.814 118.814 119.117 -0.303 18387 4536 1 6 . 1 1 72 72 ARG HA H 72 4.195 4.195 3.906 0.289 18387 4537 1 6 . 1 1 72 72 ARG C C 72 177.300 177.300 177.822 -0.522 18387 4538 1 6 . 1 1 72 72 ARG CA C 72 56.809 56.809 59.274 -2.465 18387 4539 1 6 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.484 0.627 18387 4540 1 6 . 1 1 72 72 ARG H H 72 8.057 8.057 8.508 -0.451 18387 4541 1 6 . 1 1 73 73 ARG N N 73 118.174 118.174 117.155 1.019 18387 4542 1 6 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.540 0.214 18387 4543 1 6 . 1 1 73 73 ARG C C 73 176.503 176.503 176.815 -0.312 18387 4544 1 6 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.387 -0.851 18387 4545 1 6 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.026 -0.998 18387 4546 1 6 . 1 1 73 73 ARG H H 73 8.639 8.639 8.128 0.511 18387 4547 1 6 . 1 1 74 74 GLU N N 74 127.609 127.609 121.898 5.711 18387 4548 1 6 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.277 -0.198 18387 4549 1 6 . 1 1 74 74 GLU C C 74 178.107 178.107 178.440 -0.333 18387 4550 1 6 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.872 -0.087 18387 4551 1 6 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.815 0.283 18387 4552 1 6 . 1 1 74 74 GLU H H 74 9.129 9.129 8.919 0.210 18387 4553 1 6 . 1 1 75 75 GLU N N 75 117.874 117.874 119.614 -1.740 18387 4554 1 6 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.090 0.010 18387 4555 1 6 . 1 1 75 75 GLU C C 75 178.993 178.993 178.503 0.490 18387 4556 1 6 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.062 0.065 18387 4557 1 6 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.783 0.508 18387 4558 1 6 . 1 1 75 75 GLU H H 75 9.745 9.745 8.867 0.878 18387 4559 1 6 . 1 1 76 76 ASP N N 76 119.182 119.182 120.159 -0.977 18387 4560 1 6 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.409 -0.043 18387 4561 1 6 . 1 1 76 76 ASP C C 76 178.107 178.107 178.304 -0.197 18387 4562 1 6 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.181 -0.208 18387 4563 1 6 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.263 0.257 18387 4564 1 6 . 1 1 76 76 ASP H H 76 7.004 7.004 8.361 -1.357 18387 4565 1 6 . 1 1 77 77 TRP N N 77 123.008 123.008 122.472 0.536 18387 4566 1 6 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.231 -0.082 18387 4567 1 6 . 1 1 77 77 TRP C C 77 176.236 176.236 178.113 -1.877 18387 4568 1 6 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.533 -0.050 18387 4569 1 6 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.113 -0.579 18387 4570 1 6 . 1 1 77 77 TRP H H 77 7.112 7.112 7.939 -0.827 18387 4571 1 6 . 1 1 78 78 LYS N N 78 115.727 115.727 118.528 -2.801 18387 4572 1 6 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.535 -0.290 18387 4573 1 6 . 1 1 78 78 LYS C C 78 179.426 179.426 179.197 0.229 18387 4574 1 6 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.299 1.133 18387 4575 1 6 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.815 0.930 18387 4576 1 6 . 1 1 78 78 LYS H H 78 8.431 8.431 8.367 0.064 18387 4577 1 6 . 1 1 79 79 LYS N N 79 118.321 118.321 119.459 -1.138 18387 4578 1 6 . 1 1 79 79 LYS HA H 79 4.020 4.020 4.056 -0.036 18387 4579 1 6 . 1 1 79 79 LYS C C 79 178.239 178.239 178.614 -0.375 18387 4580 1 6 . 1 1 79 79 LYS CA C 79 59.067 59.067 58.688 0.379 18387 4581 1 6 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.407 0.056 18387 4582 1 6 . 1 1 79 79 LYS H H 79 7.690 7.690 7.950 -0.260 18387 4583 1 6 . 1 1 80 80 ALA N N 80 120.679 120.679 122.482 -1.803 18387 4584 1 6 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.314 -0.159 18387 4585 1 6 . 1 1 80 80 ALA C C 80 178.811 178.811 179.855 -1.044 18387 4586 1 6 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.039 0.048 18387 4587 1 6 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.513 0.245 18387 4588 1 6 . 1 1 80 80 ALA H H 80 7.560 7.560 8.268 -0.708 18387 4589 1 6 . 1 1 81 81 ILE N N 81 118.019 118.019 118.469 -0.450 18387 4590 1 6 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.823 -0.421 18387 4591 1 6 . 1 1 81 81 ILE C C 81 178.113 178.113 178.198 -0.085 18387 4592 1 6 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.552 -0.032 18387 4593 1 6 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.434 0.770 18387 4594 1 6 . 1 1 81 81 ILE H H 81 7.514 7.514 7.873 -0.359 18387 4595 1 6 . 1 1 82 82 GLU N N 82 117.252 117.252 120.029 -2.777 18387 4596 1 6 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.940 0.154 18387 4597 1 6 . 1 1 82 82 GLU C C 82 179.558 179.558 178.162 1.396 18387 4598 1 6 . 1 1 82 82 GLU CA C 82 58.580 58.580 59.703 -1.123 18387 4599 1 6 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.236 0.147 18387 4600 1 6 . 1 1 82 82 GLU H H 82 7.401 7.401 7.931 -0.530 18387 4601 1 6 . 1 1 83 83 GLU N N 83 119.340 119.340 118.821 0.519 18387 4602 1 6 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.079 -0.181 18387 4603 1 6 . 1 1 83 83 GLU C C 83 178.740 178.740 178.803 -0.063 18387 4604 1 6 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.922 0.077 18387 4605 1 6 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.974 -0.053 18387 4606 1 6 . 1 1 83 83 GLU H H 83 8.191 8.191 7.831 0.360 18387 4607 1 6 . 1 1 84 84 ASP N N 84 118.449 118.449 116.086 2.363 18387 4608 1 6 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.396 -0.122 18387 4609 1 6 . 1 1 84 84 ASP C C 84 175.597 175.597 176.657 -1.060 18387 4610 1 6 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.684 0.363 18387 4611 1 6 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.776 -0.880 18387 4612 1 6 . 1 1 84 84 ASP H H 84 8.252 8.252 8.005 0.247 18387 4613 1 6 . 1 1 85 85 LYS N N 85 116.410 116.410 114.503 1.907 18387 4614 1 6 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.382 -0.209 18387 4615 1 6 . 1 1 85 85 LYS C C 85 176.856 176.856 175.086 1.770 18387 4616 1 6 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.236 -0.263 18387 4617 1 6 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.115 -0.247 18387 4618 1 6 . 1 1 85 85 LYS H H 85 7.890 7.890 7.896 -0.006 18387 4619 1 6 . 1 1 86 86 SER N N 86 112.295 112.295 114.811 -2.516 18387 4620 1 6 . 1 1 86 86 SER HA H 86 3.139 3.139 3.323 -0.184 18387 4621 1 6 . 1 1 86 86 SER C C 86 175.805 175.805 173.024 2.781 18387 4622 1 6 . 1 1 86 86 SER CA C 86 53.637 53.637 58.153 -4.516 18387 4623 1 6 . 1 1 86 86 SER CB C 86 60.736 60.736 61.825 -1.089 18387 4624 1 6 . 1 1 86 86 SER H H 86 7.327 7.327 8.132 -0.805 18387 4625 1 6 . 1 1 87 87 TYR N N 87 120.962 120.962 126.032 -5.070 18387 4626 1 6 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.358 -0.053 18387 4627 1 6 . 1 1 87 87 TYR C C 87 177.064 177.064 174.107 2.957 18387 4628 1 6 . 1 1 87 87 TYR CA C 87 57.223 57.223 56.580 0.643 18387 4629 1 6 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.728 -1.375 18387 4630 1 6 . 1 1 87 87 TYR H H 87 6.933 6.933 7.431 -0.498 18387 4631 1 6 . 1 1 88 88 TRP N N 88 118.597 118.597 120.303 -1.706 18387 4632 1 6 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.362 0.489 18387 4633 1 6 . 1 1 88 88 TRP C C 88 175.456 175.456 175.209 0.247 18387 4634 1 6 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.214 2.022 18387 4635 1 6 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.126 -3.399 18387 4636 1 6 . 1 1 88 88 TRP H H 88 6.552 6.552 8.018 -1.466 18387 4637 1 6 . 1 1 89 89 ASN N N 89 118.067 118.067 120.620 -2.553 18387 4638 1 6 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.670 0.379 18387 4639 1 6 . 1 1 89 89 ASN C C 89 173.773 173.773 174.773 -1.000 18387 4640 1 6 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.582 1.874 18387 4641 1 6 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.593 1.605 18387 4642 1 6 . 1 1 89 89 ASN H H 89 7.864 7.864 8.300 -0.436 18387 4643 1 6 . 1 1 90 90 GLN N N 90 125.392 125.392 121.852 3.540 18387 4644 1 6 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.110 0.387 18387 4645 1 6 . 1 1 90 90 GLN C C 90 176.491 176.491 175.920 0.571 18387 4646 1 6 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.991 0.469 18387 4647 1 6 . 1 1 90 90 GLN CB C 90 31.227 31.227 29.187 2.040 18387 4648 1 6 . 1 1 90 90 GLN H H 90 7.904 7.904 8.240 -0.336 18387 4649 1 6 . 1 1 91 91 VAL N N 91 114.434 114.434 118.927 -4.493 18387 4650 1 6 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.856 0.624 18387 4651 1 6 . 1 1 91 91 VAL C C 91 174.248 174.248 173.057 1.191 18387 4652 1 6 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.780 -0.774 18387 4653 1 6 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.337 1.301 18387 4654 1 6 . 1 1 91 91 VAL H H 91 9.585 9.585 9.002 0.583 18387 4655 1 6 . 1 1 92 92 LEU N N 92 126.910 126.910 125.104 1.806 18387 4656 1 6 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.458 -0.389 18387 4657 1 6 . 1 1 92 92 LEU C C 92 177.696 177.696 175.619 2.077 18387 4658 1 6 . 1 1 92 92 LEU CA C 92 52.844 52.844 51.972 0.872 18387 4659 1 6 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.755 -0.808 18387 4660 1 6 . 1 1 92 92 LEU H H 92 8.941 8.941 8.353 0.588 18387 4661 1 6 . 1 1 93 93 LEU N N 93 125.673 125.673 127.765 -2.092 18387 4662 1 6 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.172 0.228 18387 4663 1 6 . 1 1 93 93 LEU C C 93 177.291 177.291 176.193 1.098 18387 4664 1 6 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.425 -0.474 18387 4665 1 6 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.618 1.561 18387 4666 1 6 . 1 1 93 93 LEU H H 93 8.038 8.038 8.820 -0.782 18387 4667 1 6 . 1 1 94 94 GLN N N 94 122.206 122.206 122.693 -0.487 18387 4668 1 6 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.137 0.100 18387 4669 1 6 . 1 1 94 94 GLN C C 94 178.246 178.246 176.758 1.488 18387 4670 1 6 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.034 -0.259 18387 4671 1 6 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.347 -0.092 18387 4672 1 6 . 1 1 94 94 GLN H H 94 9.298 9.298 8.602 0.696 18387 4673 1 6 . 1 1 95 95 LYS N N 95 122.668 122.668 120.653 2.015 18387 4674 1 6 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.027 -0.061 18387 4675 1 6 . 1 1 95 95 LYS C C 95 178.787 178.787 177.711 1.076 18387 4676 1 6 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.535 1.537 18387 4677 1 6 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.777 0.688 18387 4678 1 6 . 1 1 95 95 LYS H H 95 8.645 8.645 8.740 -0.095 18387 4679 1 6 . 1 1 96 96 ASP N N 96 116.775 116.775 118.907 -2.132 18387 4680 1 6 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.538 0.042 18387 4681 1 6 . 1 1 96 96 ASP C C 96 176.220 176.220 177.909 -1.689 18387 4682 1 6 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.441 -0.094 18387 4683 1 6 . 1 1 96 96 ASP CB C 96 40.557 40.557 41.068 -0.511 18387 4684 1 6 . 1 1 96 96 ASP H H 96 8.606 8.606 8.287 0.319 18387 4685 1 6 . 1 1 97 97 ASP N N 97 118.213 118.213 120.677 -2.464 18387 4686 1 6 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.571 0.356 18387 4687 1 6 . 1 1 97 97 ASP C C 97 176.954 176.954 178.351 -1.397 18387 4688 1 6 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.976 -1.617 18387 4689 1 6 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.691 1.633 18387 4690 1 6 . 1 1 97 97 ASP H H 97 7.988 7.988 8.242 -0.254 18387 4691 1 6 . 1 1 98 98 VAL N N 98 118.907 118.907 119.619 -0.712 18387 4692 1 6 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.509 -0.093 18387 4693 1 6 . 1 1 98 98 VAL C C 98 176.470 176.470 177.800 -1.330 18387 4694 1 6 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.741 1.037 18387 4695 1 6 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.560 0.831 18387 4696 1 6 . 1 1 98 98 VAL H H 98 7.098 7.098 8.526 -1.428 18387 4697 1 6 . 1 1 99 99 LYS N N 99 117.909 117.909 119.269 -1.360 18387 4698 1 6 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.924 0.019 18387 4699 1 6 . 1 1 99 99 LYS C C 99 178.762 178.762 178.557 0.205 18387 4700 1 6 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.013 0.132 18387 4701 1 6 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.028 -0.016 18387 4702 1 6 . 1 1 99 99 LYS H H 99 8.304 8.304 7.616 0.688 18387 4703 1 6 . 1 1 100 100 ASP N N 100 117.843 117.843 117.694 0.149 18387 4704 1 6 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.490 -0.012 18387 4705 1 6 . 1 1 100 100 ASP C C 100 179.694 179.694 178.732 0.962 18387 4706 1 6 . 1 1 100 100 ASP CA C 100 57.526 57.526 56.530 0.996 18387 4707 1 6 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.508 0.320 18387 4708 1 6 . 1 1 100 100 ASP H H 100 8.024 8.024 7.826 0.198 18387 4709 1 6 . 1 1 101 101 VAL N N 101 122.202 122.202 121.242 0.960 18387 4710 1 6 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.984 0.011 18387 4711 1 6 . 1 1 101 101 VAL C C 101 178.533 178.533 178.124 0.409 18387 4712 1 6 . 1 1 101 101 VAL CA C 101 67.002 67.002 65.968 1.034 18387 4713 1 6 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.612 0.425 18387 4714 1 6 . 1 1 101 101 VAL H H 101 8.205 8.205 8.010 0.195 18387 4715 1 6 . 1 1 102 102 LEU N N 102 118.798 118.798 119.585 -0.787 18387 4716 1 6 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.600 0.180 18387 4717 1 6 . 1 1 102 102 LEU C C 102 180.254 180.254 178.889 1.365 18387 4718 1 6 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.144 0.797 18387 4719 1 6 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.312 -0.873 18387 4720 1 6 . 1 1 102 102 LEU H H 102 8.422 8.422 8.034 0.388 18387 4721 1 6 . 1 1 103 103 GLU N N 103 116.915 116.915 119.093 -2.178 18387 4722 1 6 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.883 0.252 18387 4723 1 6 . 1 1 103 103 GLU C C 103 180.910 180.910 179.226 1.684 18387 4724 1 6 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.450 -0.047 18387 4725 1 6 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.259 0.472 18387 4726 1 6 . 1 1 103 103 GLU H H 103 8.262 8.262 7.801 0.461 18387 4727 1 6 . 1 1 104 104 SER N N 104 117.866 117.866 115.026 2.840 18387 4728 1 6 . 1 1 104 104 SER HA H 104 4.216 4.216 4.216 0.000 18387 4729 1 6 . 1 1 104 104 SER C C 104 175.455 175.455 176.576 -1.121 18387 4730 1 6 . 1 1 104 104 SER CA C 104 62.019 62.019 60.413 1.606 18387 4731 1 6 . 1 1 104 104 SER CB C 104 62.891 62.891 62.924 -0.033 18387 4732 1 6 . 1 1 104 104 SER H H 104 8.544 8.544 7.716 0.828 18387 4733 1 6 . 1 1 105 105 TYR N N 105 117.278 117.278 119.155 -1.877 18387 4734 1 6 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.453 -0.181 18387 4735 1 6 . 1 1 105 105 TYR C C 105 174.750 174.750 174.943 -0.193 18387 4736 1 6 . 1 1 105 105 TYR CA C 105 59.859 59.859 59.322 0.537 18387 4737 1 6 . 1 1 105 105 TYR CB C 105 39.711 39.711 38.162 1.549 18387 4738 1 6 . 1 1 105 105 TYR H H 105 7.691 7.691 7.818 -0.127 18387 4739 1 6 . 1 1 106 106 CYS N N 106 116.897 116.897 116.462 0.435 18387 4740 1 6 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.071 -0.176 18387 4741 1 6 . 1 1 106 106 CYS C C 106 174.056 174.056 173.826 0.230 18387 4742 1 6 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.032 -0.422 18387 4743 1 6 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.992 0.040 18387 4744 1 6 . 1 1 106 106 CYS H H 106 7.862 7.862 8.126 -0.264 18387 4745 1 6 . 1 1 107 107 ILE N N 107 118.885 118.885 121.262 -2.377 18387 4746 1 6 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.513 -0.174 18387 4747 1 6 . 1 1 107 107 ILE C C 107 176.793 176.793 175.561 1.232 18387 4748 1 6 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.822 0.923 18387 4749 1 6 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.091 0.988 18387 4750 1 6 . 1 1 107 107 ILE H H 107 7.707 7.707 7.753 -0.046 18387 4751 1 6 . 1 1 108 108 VAL N N 108 123.983 123.983 126.874 -2.891 18387 4752 1 6 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.193 0.081 18387 4753 1 6 . 1 1 108 108 VAL C C 108 175.476 175.476 175.268 0.208 18387 4754 1 6 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.560 0.063 18387 4755 1 6 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.756 0.252 18387 4756 1 6 . 1 1 108 108 VAL H H 108 8.656 8.656 8.226 0.430 18387 4757 1 6 . 1 1 109 109 GLY N N 109 110.120 110.120 107.405 2.715 18387 4758 1 6 . 1 1 109 109 GLY C C 109 169.982 169.982 172.443 -2.461 18387 4759 1 6 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.308 -0.705 18387 4760 1 6 . 1 1 109 109 GLY H H 109 7.500 7.500 7.325 0.175 18387 4761 1 6 . 1 1 110 110 PHE N N 110 115.276 115.276 119.365 -4.089 18387 4762 1 6 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.186 -0.412 18387 4763 1 6 . 1 1 110 110 PHE C C 110 174.361 174.361 173.700 0.661 18387 4764 1 6 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.246 0.441 18387 4765 1 6 . 1 1 110 110 PHE CB C 110 41.951 41.951 42.522 -0.571 18387 4766 1 6 . 1 1 110 110 PHE H H 110 8.203 8.203 8.580 -0.377 18387 4767 1 6 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.279 0.080 18387 4768 1 6 . 1 1 111 111 PRO C C 111 175.691 175.691 175.930 -0.239 18387 4769 1 6 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.643 0.514 18387 4770 1 6 . 1 1 111 111 PRO CB C 111 35.304 35.304 32.928 2.376 18387 4771 1 6 . 1 1 112 112 HIS N N 112 123.708 123.708 125.136 -1.428 18387 4772 1 6 . 1 1 112 112 HIS HA H 112 4.963 4.963 5.172 -0.209 18387 4773 1 6 . 1 1 112 112 HIS C C 112 173.649 173.649 174.649 -1.000 18387 4774 1 6 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.165 1.909 18387 4775 1 6 . 1 1 112 112 HIS CB C 112 32.197 32.197 29.358 2.839 18387 4776 1 6 . 1 1 112 112 HIS H H 112 8.952 8.952 8.526 0.426 18387 4777 1 6 . 1 1 113 113 ILE N N 113 128.596 128.596 129.394 -0.798 18387 4778 1 6 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.108 0.589 18387 4779 1 6 . 1 1 113 113 ILE C C 113 176.130 176.130 174.501 1.629 18387 4780 1 6 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.111 0.884 18387 4781 1 6 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.013 -0.958 18387 4782 1 6 . 1 1 113 113 ILE H H 113 8.808 8.808 8.060 0.748 18387 4783 1 6 . 1 1 114 114 ILE N N 114 119.668 119.668 122.052 -2.384 18387 4784 1 6 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.720 0.253 18387 4785 1 6 . 1 1 114 114 ILE C C 114 173.186 173.186 173.689 -0.503 18387 4786 1 6 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.745 -0.015 18387 4787 1 6 . 1 1 114 114 ILE CB C 114 42.540 42.540 41.255 1.284 18387 4788 1 6 . 1 1 114 114 ILE H H 114 8.721 8.721 8.861 -0.140 18387 4789 1 6 . 1 1 115 115 LEU N N 115 122.770 122.770 125.696 -2.926 18387 4790 1 6 . 1 1 115 115 LEU HA H 115 5.275 5.275 4.750 0.525 18387 4791 1 6 . 1 1 115 115 LEU C C 115 173.601 173.601 175.089 -1.488 18387 4792 1 6 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.976 -0.194 18387 4793 1 6 . 1 1 115 115 LEU CB C 115 46.134 46.134 43.196 2.938 18387 4794 1 6 . 1 1 115 115 LEU H H 115 8.665 8.665 8.769 -0.104 18387 4795 1 6 . 1 1 116 116 VAL N N 116 130.411 130.411 127.577 2.834 18387 4796 1 6 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.752 0.106 18387 4797 1 6 . 1 1 116 116 VAL C C 116 174.565 174.565 175.194 -0.629 18387 4798 1 6 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.819 -0.015 18387 4799 1 6 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.980 -0.065 18387 4800 1 6 . 1 1 116 116 VAL H H 116 9.472 9.472 9.232 0.240 18387 4801 1 6 . 1 1 117 117 ASP N N 117 127.896 127.896 127.323 0.573 18387 4802 1 6 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.714 -0.322 18387 4803 1 6 . 1 1 117 117 ASP C C 117 176.567 176.567 175.662 0.905 18387 4804 1 6 . 1 1 117 117 ASP CA C 117 52.600 52.600 53.337 -0.737 18387 4805 1 6 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.871 -0.287 18387 4806 1 6 . 1 1 117 117 ASP H H 117 9.429 9.429 8.981 0.448 18387 4807 1 6 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.373 -0.179 18387 4808 1 6 . 1 1 118 118 PRO C C 118 177.534 177.534 177.985 -0.451 18387 4809 1 6 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.286 -0.121 18387 4810 1 6 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.654 1.159 18387 4811 1 6 . 1 1 119 119 GLU N N 119 114.015 114.015 115.431 -1.416 18387 4812 1 6 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.300 0.039 18387 4813 1 6 . 1 1 119 119 GLU C C 119 176.722 176.722 176.982 -0.260 18387 4814 1 6 . 1 1 119 119 GLU CA C 119 55.639 55.639 55.956 -0.317 18387 4815 1 6 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.055 0.522 18387 4816 1 6 . 1 1 119 119 GLU H H 119 7.733 7.733 8.695 -0.962 18387 4817 1 6 . 1 1 120 120 GLY N N 120 108.218 108.218 108.609 -0.391 18387 4818 1 6 . 1 1 120 120 GLY C C 120 174.110 174.110 173.437 0.673 18387 4819 1 6 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.500 -0.104 18387 4820 1 6 . 1 1 120 120 GLY H H 120 8.588 8.588 8.294 0.294 18387 4821 1 6 . 1 1 121 121 LYS N N 121 121.778 121.778 119.927 1.851 18387 4822 1 6 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.034 -0.175 18387 4823 1 6 . 1 1 121 121 LYS C C 121 176.458 176.458 175.842 0.616 18387 4824 1 6 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.409 0.553 18387 4825 1 6 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.483 -2.031 18387 4826 1 6 . 1 1 121 121 LYS H H 121 8.600 8.600 8.810 -0.210 18387 4827 1 6 . 1 1 122 122 ILE N N 122 122.058 122.058 125.525 -3.467 18387 4828 1 6 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.187 0.085 18387 4829 1 6 . 1 1 122 122 ILE C C 122 177.084 177.084 176.354 0.730 18387 4830 1 6 . 1 1 122 122 ILE CA C 122 62.819 62.819 63.087 -0.268 18387 4831 1 6 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.316 1.331 18387 4832 1 6 . 1 1 122 122 ILE H H 122 9.006 9.006 9.093 -0.087 18387 4833 1 6 . 1 1 123 123 VAL N N 123 120.561 120.561 129.104 -8.543 18387 4834 1 6 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.099 0.656 18387 4835 1 6 . 1 1 123 123 VAL C C 123 175.584 175.584 175.494 0.090 18387 4836 1 6 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.317 -2.166 18387 4837 1 6 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.463 0.938 18387 4838 1 6 . 1 1 123 123 VAL H H 123 9.054 9.054 9.157 -0.103 18387 4839 1 6 . 1 1 124 124 ALA N N 124 121.102 121.102 119.933 1.169 18387 4840 1 6 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.699 -0.042 18387 4841 1 6 . 1 1 124 124 ALA C C 124 174.832 174.832 174.640 0.192 18387 4842 1 6 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.322 1.138 18387 4843 1 6 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.527 1.303 18387 4844 1 6 . 1 1 124 124 ALA H H 124 7.793 7.793 7.649 0.144 18387 4845 1 6 . 1 1 125 125 LYS N N 125 117.637 117.637 117.970 -0.333 18387 4846 1 6 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.491 0.542 18387 4847 1 6 . 1 1 125 125 LYS C C 125 173.417 173.417 175.470 -2.053 18387 4848 1 6 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.494 -0.353 18387 4849 1 6 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.233 1.418 18387 4850 1 6 . 1 1 125 125 LYS H H 125 8.872 8.872 8.289 0.583 18387 4851 1 6 . 1 1 126 126 GLU N N 126 115.236 115.236 116.393 -1.157 18387 4852 1 6 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.950 0.048 18387 4853 1 6 . 1 1 126 126 GLU C C 126 175.998 175.998 175.741 0.257 18387 4854 1 6 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.385 -0.423 18387 4855 1 6 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.353 -0.918 18387 4856 1 6 . 1 1 126 126 GLU H H 126 7.941 7.941 8.500 -0.559 18387 4857 1 6 . 1 1 127 127 LEU N N 127 118.584 118.584 118.970 -0.386 18387 4858 1 6 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.306 0.076 18387 4859 1 6 . 1 1 127 127 LEU C C 127 176.766 176.766 177.237 -0.471 18387 4860 1 6 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.561 -0.952 18387 4861 1 6 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.141 1.822 18387 4862 1 6 . 1 1 127 127 LEU H H 127 7.300 7.300 7.556 -0.256 18387 4863 1 6 . 1 1 128 128 ARG N N 128 118.625 118.625 122.086 -3.461 18387 4864 1 6 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.594 -0.119 18387 4865 1 6 . 1 1 128 128 ARG C C 128 177.113 177.113 177.657 -0.544 18387 4866 1 6 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.929 -0.539 18387 4867 1 6 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.383 2.229 18387 4868 1 6 . 1 1 128 128 ARG H H 128 7.929 7.929 8.630 -0.701 18387 4869 1 6 . 1 1 129 129 GLY N N 129 114.010 114.010 110.662 3.348 18387 4870 1 6 . 1 1 129 129 GLY C C 129 175.931 175.931 175.079 0.852 18387 4871 1 6 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.637 -2.176 18387 4872 1 6 . 1 1 129 129 GLY H H 129 10.649 10.649 9.397 1.252 18387 4873 1 6 . 1 1 130 130 ASP N N 130 123.975 123.975 120.013 3.962 18387 4874 1 6 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.112 0.420 18387 4875 1 6 . 1 1 130 130 ASP C C 130 177.507 177.507 177.621 -0.114 18387 4876 1 6 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.535 0.837 18387 4877 1 6 . 1 1 130 130 ASP CB C 130 40.903 40.903 39.597 1.306 18387 4878 1 6 . 1 1 130 130 ASP H H 130 8.540 8.540 8.034 0.506 18387 4879 1 6 . 1 1 131 131 ASP N N 131 116.806 116.806 121.838 -5.032 18387 4880 1 6 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.271 0.298 18387 4881 1 6 . 1 1 131 131 ASP C C 131 179.038 179.038 178.235 0.803 18387 4882 1 6 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.209 -0.226 18387 4883 1 6 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.758 0.176 18387 4884 1 6 . 1 1 131 131 ASP H H 131 7.907 7.907 8.146 -0.239 18387 4885 1 6 . 1 1 132 132 LEU N N 132 123.869 123.869 118.047 5.822 18387 4886 1 6 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.120 -0.329 18387 4887 1 6 . 1 1 132 132 LEU C C 132 176.343 176.343 178.389 -2.046 18387 4888 1 6 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.350 1.434 18387 4889 1 6 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.784 0.984 18387 4890 1 6 . 1 1 132 132 LEU H H 132 7.542 7.542 8.479 -0.937 18387 4891 1 6 . 1 1 133 133 TYR N N 133 120.042 120.042 120.779 -0.737 18387 4892 1 6 . 1 1 133 133 TYR HA H 133 3.996 3.996 3.994 0.002 18387 4893 1 6 . 1 1 133 133 TYR C C 133 177.426 177.426 177.240 0.186 18387 4894 1 6 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.694 -0.561 18387 4895 1 6 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.641 -0.065 18387 4896 1 6 . 1 1 133 133 TYR H H 133 7.384 7.384 7.483 -0.099 18387 4897 1 6 . 1 1 134 134 ASN N N 134 114.936 114.936 116.946 -2.010 18387 4898 1 6 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.263 0.140 18387 4899 1 6 . 1 1 134 134 ASN C C 134 178.703 178.703 178.122 0.581 18387 4900 1 6 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.364 -0.555 18387 4901 1 6 . 1 1 134 134 ASN CB C 134 38.208 38.208 37.924 0.284 18387 4902 1 6 . 1 1 134 134 ASN H H 134 8.399 8.399 8.876 -0.477 18387 4903 1 6 . 1 1 135 135 THR N N 135 117.387 117.387 117.626 -0.239 18387 4904 1 6 . 1 1 135 135 THR HA H 135 3.920 3.920 3.873 0.047 18387 4905 1 6 . 1 1 135 135 THR C C 135 175.323 175.323 176.518 -1.195 18387 4906 1 6 . 1 1 135 135 THR CA C 135 67.402 67.402 66.577 0.825 18387 4907 1 6 . 1 1 135 135 THR CB C 135 68.111 68.111 68.765 -0.654 18387 4908 1 6 . 1 1 135 135 THR H H 135 8.265 8.265 8.146 0.119 18387 4909 1 6 . 1 1 136 136 VAL N N 136 121.207 121.207 121.770 -0.563 18387 4910 1 6 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.347 -0.332 18387 4911 1 6 . 1 1 136 136 VAL C C 136 176.457 176.457 176.777 -0.320 18387 4912 1 6 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.783 1.489 18387 4913 1 6 . 1 1 136 136 VAL CB C 136 30.941 30.941 31.040 -0.099 18387 4914 1 6 . 1 1 136 136 VAL H H 136 7.595 7.595 8.240 -0.645 18387 4915 1 6 . 1 1 137 137 GLU N N 137 118.266 118.266 119.286 -1.020 18387 4916 1 6 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.440 -0.758 18387 4917 1 6 . 1 1 137 137 GLU C C 137 177.482 177.482 178.077 -0.595 18387 4918 1 6 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.473 0.457 18387 4919 1 6 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.066 0.716 18387 4920 1 6 . 1 1 137 137 GLU H H 137 8.114 8.114 8.169 -0.055 18387 4921 1 6 . 1 1 138 138 LYS N N 138 116.431 116.431 118.942 -2.511 18387 4922 1 6 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.822 -0.054 18387 4923 1 6 . 1 1 138 138 LYS C C 138 179.193 179.193 178.907 0.286 18387 4924 1 6 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.090 -0.050 18387 4925 1 6 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.892 0.266 18387 4926 1 6 . 1 1 138 138 LYS H H 138 7.133 7.133 7.395 -0.262 18387 4927 1 6 . 1 1 139 139 PHE N N 139 116.336 116.336 117.316 -0.980 18387 4928 1 6 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.204 -0.194 18387 4929 1 6 . 1 1 139 139 PHE C C 139 177.855 177.855 177.723 0.132 18387 4930 1 6 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.948 1.436 18387 4931 1 6 . 1 1 139 139 PHE CB C 139 39.352 39.352 38.999 0.353 18387 4932 1 6 . 1 1 139 139 PHE H H 139 7.338 7.338 7.254 0.084 18387 4933 1 6 . 1 1 140 140 VAL N N 140 116.491 116.491 116.374 0.117 18387 4934 1 6 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.601 -0.077 18387 4935 1 6 . 1 1 140 140 VAL C C 140 177.747 177.747 177.532 0.215 18387 4936 1 6 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.122 0.120 18387 4937 1 6 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.544 -0.154 18387 4938 1 6 . 1 1 140 140 VAL H H 140 8.332 8.332 8.117 0.215 18387 4939 1 6 . 1 1 141 141 ASN N N 141 116.956 116.956 117.102 -0.146 18387 4940 1 6 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.059 0.767 18387 4941 1 6 . 1 1 141 141 ASN C C 141 176.997 176.997 175.538 1.459 18387 4942 1 6 . 1 1 141 141 ASN CA C 141 53.677 53.677 52.594 1.083 18387 4943 1 6 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.585 -1.137 18387 4944 1 6 . 1 1 141 141 ASN H H 141 7.862 7.862 7.305 0.557 18387 4945 1 6 . 1 1 142 142 GLY N N 142 107.938 107.938 107.404 0.534 18387 4946 1 6 . 1 1 142 142 GLY C C 142 174.336 174.336 173.520 0.816 18387 4947 1 6 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.732 1.253 18387 4948 1 6 . 1 1 142 142 GLY H H 142 7.466 7.466 7.946 -0.480 18387 4949 1 6 . 1 1 143 143 ALA N N 143 123.441 123.441 123.068 0.373 18387 4950 1 6 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.464 -0.123 18387 4951 1 6 . 1 1 143 143 ALA C C 143 178.212 178.212 177.573 0.639 18387 4952 1 6 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.237 0.589 18387 4953 1 6 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.242 0.002 18387 4954 1 6 . 1 1 143 143 ALA H H 143 7.950 7.950 8.702 -0.752 18387 4955 1 6 . 1 1 144 144 LYS N N 144 120.149 120.149 120.308 -0.159 18387 4956 1 6 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.133 0.162 18387 4957 1 6 . 1 1 144 144 LYS C C 144 176.945 176.945 176.327 0.618 18387 4958 1 6 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.138 0.381 18387 4959 1 6 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.808 0.222 18387 4960 1 6 . 1 1 144 144 LYS H H 144 8.187 8.187 7.895 0.292 18387 4961 1 6 . 1 1 145 145 GLU N N 145 120.992 120.992 126.282 -5.290 18387 4962 1 6 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.252 0.043 18387 4963 1 6 . 1 1 145 145 GLU C C 145 177.116 177.116 177.508 -0.392 18387 4964 1 6 . 1 1 145 145 GLU CA C 145 56.903 56.903 58.007 -1.104 18387 4965 1 6 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.977 0.265 18387 4966 1 6 . 1 1 145 145 GLU H H 145 8.363 8.363 8.528 -0.165 18387 4967 1 6 . 1 1 146 146 GLY N N 146 109.467 109.467 114.245 -4.778 18387 4968 1 6 . 1 1 146 146 GLY C C 146 174.108 174.108 174.917 -0.809 18387 4969 1 6 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.331 0.070 18387 4970 1 6 . 1 1 146 146 GLY H H 146 8.371 8.371 8.719 -0.348 18387 4971 1 6 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.812 -0.203 18387 4972 1 6 . 1 1 151 151 HIS C C 151 174.258 174.258 173.576 0.682 18387 4973 1 6 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.054 1.111 18387 4974 1 6 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.566 0.267 18387 4975 1 7 . 1 1 2 2 SER HA H 2 3.992 3.992 4.567 -0.575 18387 4976 1 7 . 1 1 2 2 SER CA C 2 57.555 57.555 58.160 -0.605 18387 4977 1 7 . 1 1 2 2 SER CB C 2 64.977 64.977 63.497 1.480 18387 4978 1 7 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.527 -0.088 18387 4979 1 7 . 1 1 3 3 LEU C C 3 176.631 176.631 175.208 1.423 18387 4980 1 7 . 1 1 3 3 LEU CA C 3 54.564 54.564 53.999 0.565 18387 4981 1 7 . 1 1 3 3 LEU CB C 3 42.724 42.724 44.074 -1.350 18387 4982 1 7 . 1 1 4 4 ALA N N 4 125.483 125.483 122.441 3.042 18387 4983 1 7 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.684 -0.305 18387 4984 1 7 . 1 1 4 4 ALA C C 4 179.642 179.642 176.428 3.214 18387 4985 1 7 . 1 1 4 4 ALA CA C 4 51.735 51.735 52.105 -0.370 18387 4986 1 7 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.188 -1.436 18387 4987 1 7 . 1 1 4 4 ALA H H 4 8.483 8.483 8.203 0.280 18387 4988 1 7 . 1 1 5 5 THR HA H 5 3.845 3.845 5.041 -1.196 18387 4989 1 7 . 1 1 5 5 THR C C 5 175.487 175.487 175.326 0.161 18387 4990 1 7 . 1 1 5 5 THR CA C 5 64.531 64.531 61.462 3.068 18387 4991 1 7 . 1 1 5 5 THR CB C 5 68.108 68.108 70.623 -2.514 18387 4992 1 7 . 1 1 6 6 GLY N N 6 114.298 114.298 116.146 -1.848 18387 4993 1 7 . 1 1 6 6 GLY C C 6 174.324 174.324 174.383 -0.059 18387 4994 1 7 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.562 -0.727 18387 4995 1 7 . 1 1 6 6 GLY H H 6 9.511 9.511 8.922 0.589 18387 4996 1 7 . 1 1 7 7 SER N N 7 115.270 115.270 117.878 -2.608 18387 4997 1 7 . 1 1 7 7 SER HA H 7 4.500 4.500 4.543 -0.043 18387 4998 1 7 . 1 1 7 7 SER C C 7 173.315 173.315 174.225 -0.910 18387 4999 1 7 . 1 1 7 7 SER CA C 7 58.915 58.915 58.361 0.554 18387 5000 1 7 . 1 1 7 7 SER CB C 7 64.308 64.308 63.739 0.569 18387 5001 1 7 . 1 1 7 7 SER H H 7 7.736 7.736 7.793 -0.057 18387 5002 1 7 . 1 1 8 8 VAL N N 8 123.708 123.708 126.421 -2.713 18387 5003 1 7 . 1 1 8 8 VAL HA H 8 3.832 3.832 3.998 -0.166 18387 5004 1 7 . 1 1 8 8 VAL C C 8 176.673 176.673 175.917 0.756 18387 5005 1 7 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.381 0.292 18387 5006 1 7 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.921 0.301 18387 5007 1 7 . 1 1 8 8 VAL H H 8 8.632 8.632 8.712 -0.080 18387 5008 1 7 . 1 1 9 9 ALA N N 9 133.040 133.040 131.517 1.523 18387 5009 1 7 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.709 -0.446 18387 5010 1 7 . 1 1 9 9 ALA C C 9 175.404 175.404 175.378 0.026 18387 5011 1 7 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.522 1.433 18387 5012 1 7 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.814 -0.784 18387 5013 1 7 . 1 1 9 9 ALA H H 9 8.448 8.448 8.867 -0.419 18387 5014 1 7 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.396 -0.065 18387 5015 1 7 . 1 1 10 10 PRO C C 10 175.071 175.071 175.903 -0.832 18387 5016 1 7 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.277 0.364 18387 5017 1 7 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.320 0.004 18387 5018 1 7 . 1 1 11 11 ALA N N 11 124.172 124.172 123.384 0.788 18387 5019 1 7 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.545 -0.301 18387 5020 1 7 . 1 1 11 11 ALA C C 11 177.688 177.688 177.684 0.004 18387 5021 1 7 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.392 2.229 18387 5022 1 7 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.453 -0.126 18387 5023 1 7 . 1 1 11 11 ALA H H 11 8.221 8.221 8.290 -0.069 18387 5024 1 7 . 1 1 12 12 ILE N N 12 117.815 117.815 125.940 -8.125 18387 5025 1 7 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.172 0.156 18387 5026 1 7 . 1 1 12 12 ILE C C 12 175.013 175.013 176.062 -1.049 18387 5027 1 7 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.769 0.397 18387 5028 1 7 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.976 5.314 18387 5029 1 7 . 1 1 12 12 ILE H H 12 7.693 7.693 8.577 -0.884 18387 5030 1 7 . 1 1 13 13 THR N N 13 121.186 121.186 122.791 -1.605 18387 5031 1 7 . 1 1 13 13 THR HA H 13 4.840 4.840 4.994 -0.154 18387 5032 1 7 . 1 1 13 13 THR C C 13 172.625 172.625 173.826 -1.201 18387 5033 1 7 . 1 1 13 13 THR CA C 13 62.297 62.297 61.565 0.732 18387 5034 1 7 . 1 1 13 13 THR CB C 13 71.585 71.585 69.176 2.409 18387 5035 1 7 . 1 1 13 13 THR H H 13 8.363 8.363 9.317 -0.954 18387 5036 1 7 . 1 1 14 14 GLY N N 14 110.785 110.785 112.572 -1.787 18387 5037 1 7 . 1 1 14 14 GLY C C 14 170.040 170.040 171.814 -1.774 18387 5038 1 7 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.102 1.288 18387 5039 1 7 . 1 1 14 14 GLY H H 14 7.993 7.993 9.330 -1.337 18387 5040 1 7 . 1 1 15 15 ILE N N 15 119.088 119.088 120.610 -1.522 18387 5041 1 7 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.117 0.008 18387 5042 1 7 . 1 1 15 15 ILE C C 15 176.359 176.359 175.755 0.604 18387 5043 1 7 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.137 -1.523 18387 5044 1 7 . 1 1 15 15 ILE CB C 15 38.639 38.639 39.752 -1.113 18387 5045 1 7 . 1 1 15 15 ILE H H 15 7.973 7.973 8.418 -0.445 18387 5046 1 7 . 1 1 16 16 ASP N N 16 126.633 126.633 127.241 -0.608 18387 5047 1 7 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.225 0.624 18387 5048 1 7 . 1 1 16 16 ASP C C 16 179.190 179.190 177.721 1.469 18387 5049 1 7 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.873 0.007 18387 5050 1 7 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.727 -0.452 18387 5051 1 7 . 1 1 16 16 ASP H H 16 9.335 9.335 8.771 0.564 18387 5052 1 7 . 1 1 17 17 LEU N N 17 116.648 116.648 118.822 -2.174 18387 5053 1 7 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.116 0.058 18387 5054 1 7 . 1 1 17 17 LEU C C 17 178.432 178.432 179.157 -0.725 18387 5055 1 7 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.583 0.398 18387 5056 1 7 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.847 1.139 18387 5057 1 7 . 1 1 17 17 LEU H H 17 8.071 8.071 8.810 -0.739 18387 5058 1 7 . 1 1 18 18 LYS N N 18 117.401 117.401 118.386 -0.985 18387 5059 1 7 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.175 0.334 18387 5060 1 7 . 1 1 18 18 LYS C C 18 176.793 176.793 177.400 -0.607 18387 5061 1 7 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.901 -2.466 18387 5062 1 7 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.967 0.097 18387 5063 1 7 . 1 1 18 18 LYS H H 18 8.207 8.207 8.705 -0.498 18387 5064 1 7 . 1 1 19 19 GLY N N 19 108.061 108.061 106.705 1.356 18387 5065 1 7 . 1 1 19 19 GLY C C 19 174.649 174.649 173.951 0.698 18387 5066 1 7 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.546 1.051 18387 5067 1 7 . 1 1 19 19 GLY H H 19 8.099 8.099 8.039 0.060 18387 5068 1 7 . 1 1 20 20 ASN N N 20 121.012 121.012 120.110 0.902 18387 5069 1 7 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.962 -0.057 18387 5070 1 7 . 1 1 20 20 ASN C C 20 174.827 174.827 174.671 0.156 18387 5071 1 7 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.585 -0.118 18387 5072 1 7 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.767 -1.091 18387 5073 1 7 . 1 1 20 20 ASN H H 20 8.945 8.945 9.213 -0.268 18387 5074 1 7 . 1 1 21 21 SER N N 21 117.285 117.285 118.491 -1.206 18387 5075 1 7 . 1 1 21 21 SER HA H 21 5.000 5.000 4.931 0.069 18387 5076 1 7 . 1 1 21 21 SER C C 21 174.911 174.911 174.245 0.666 18387 5077 1 7 . 1 1 21 21 SER CA C 21 58.730 58.730 58.161 0.569 18387 5078 1 7 . 1 1 21 21 SER CB C 21 63.162 63.162 63.119 0.043 18387 5079 1 7 . 1 1 21 21 SER H H 21 8.740 8.740 8.696 0.044 18387 5080 1 7 . 1 1 22 22 VAL N N 22 128.665 128.665 126.374 2.291 18387 5081 1 7 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.480 -0.100 18387 5082 1 7 . 1 1 22 22 VAL C C 22 176.276 176.276 173.942 2.334 18387 5083 1 7 . 1 1 22 22 VAL CA C 22 62.953 62.953 60.091 2.862 18387 5084 1 7 . 1 1 22 22 VAL CB C 22 35.582 35.582 35.855 -0.273 18387 5085 1 7 . 1 1 22 22 VAL H H 22 9.125 9.125 9.066 0.059 18387 5086 1 7 . 1 1 23 23 SER N N 23 127.457 127.457 121.986 5.471 18387 5087 1 7 . 1 1 23 23 SER HA H 23 5.878 5.878 5.546 0.332 18387 5088 1 7 . 1 1 23 23 SER C C 23 174.436 174.436 175.687 -1.251 18387 5089 1 7 . 1 1 23 23 SER CA C 23 57.101 57.101 56.831 0.270 18387 5090 1 7 . 1 1 23 23 SER CB C 23 66.078 66.078 65.226 0.852 18387 5091 1 7 . 1 1 23 23 SER H H 23 8.971 8.971 9.379 -0.408 18387 5092 1 7 . 1 1 24 24 LEU N N 24 126.734 126.734 124.413 2.321 18387 5093 1 7 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.725 -0.258 18387 5094 1 7 . 1 1 24 24 LEU C C 24 179.852 179.852 177.657 2.195 18387 5095 1 7 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.928 1.275 18387 5096 1 7 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.922 0.056 18387 5097 1 7 . 1 1 24 24 LEU H H 24 8.450 8.450 8.988 -0.538 18387 5098 1 7 . 1 1 25 25 ASN N N 25 115.642 115.642 116.449 -0.807 18387 5099 1 7 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.389 -0.147 18387 5100 1 7 . 1 1 25 25 ASN C C 25 176.246 176.246 176.598 -0.352 18387 5101 1 7 . 1 1 25 25 ASN CA C 25 55.370 55.370 56.185 -0.815 18387 5102 1 7 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.349 0.423 18387 5103 1 7 . 1 1 25 25 ASN H H 25 8.505 8.505 8.757 -0.252 18387 5104 1 7 . 1 1 26 26 ASP N N 26 119.722 119.722 119.244 0.478 18387 5105 1 7 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.346 -0.141 18387 5106 1 7 . 1 1 26 26 ASP C C 26 176.708 176.708 176.572 0.136 18387 5107 1 7 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.297 0.228 18387 5108 1 7 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.362 -1.082 18387 5109 1 7 . 1 1 26 26 ASP H H 26 7.731 7.731 7.849 -0.118 18387 5110 1 7 . 1 1 27 27 PHE N N 27 116.827 116.827 116.978 -0.151 18387 5111 1 7 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.637 -0.157 18387 5112 1 7 . 1 1 27 27 PHE C C 27 174.227 174.227 175.920 -1.693 18387 5113 1 7 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.124 -0.053 18387 5114 1 7 . 1 1 27 27 PHE CB C 27 39.719 39.719 40.096 -0.377 18387 5115 1 7 . 1 1 27 27 PHE H H 27 7.390 7.390 7.410 -0.020 18387 5116 1 7 . 1 1 28 28 LYS N N 28 120.357 120.357 120.965 -0.608 18387 5117 1 7 . 1 1 28 28 LYS HA H 28 4.387 4.387 3.974 0.413 18387 5118 1 7 . 1 1 28 28 LYS C C 28 177.845 177.845 177.445 0.400 18387 5119 1 7 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.905 0.097 18387 5120 1 7 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.738 -0.194 18387 5121 1 7 . 1 1 28 28 LYS H H 28 6.883 6.883 7.418 -0.535 18387 5122 1 7 . 1 1 29 29 GLY N N 29 112.653 112.653 106.736 5.917 18387 5123 1 7 . 1 1 29 29 GLY C C 29 173.799 173.799 173.336 0.463 18387 5124 1 7 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.531 -0.543 18387 5125 1 7 . 1 1 29 29 GLY H H 29 8.930 8.930 8.528 0.402 18387 5126 1 7 . 1 1 30 30 LYS N N 30 120.516 120.516 117.747 2.769 18387 5127 1 7 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.657 -0.022 18387 5128 1 7 . 1 1 30 30 LYS C C 30 176.505 176.505 175.381 1.124 18387 5129 1 7 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.275 0.905 18387 5130 1 7 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.881 -1.024 18387 5131 1 7 . 1 1 30 30 LYS H H 30 8.098 8.098 7.299 0.799 18387 5132 1 7 . 1 1 31 31 TYR N N 31 117.383 117.383 120.532 -3.149 18387 5133 1 7 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.778 -0.124 18387 5134 1 7 . 1 1 31 31 TYR C C 31 175.551 175.551 175.756 -0.205 18387 5135 1 7 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.156 1.009 18387 5136 1 7 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.692 2.501 18387 5137 1 7 . 1 1 31 31 TYR H H 31 8.263 8.263 8.937 -0.674 18387 5138 1 7 . 1 1 32 32 VAL N N 32 120.900 120.900 125.407 -4.507 18387 5139 1 7 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.586 -0.147 18387 5140 1 7 . 1 1 32 32 VAL C C 32 175.975 175.975 174.720 1.255 18387 5141 1 7 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.907 -1.201 18387 5142 1 7 . 1 1 32 32 VAL CB C 32 35.507 35.507 33.234 2.273 18387 5143 1 7 . 1 1 32 32 VAL H H 32 9.244 9.244 9.236 0.008 18387 5144 1 7 . 1 1 33 33 LEU N N 33 130.058 130.058 131.393 -1.335 18387 5145 1 7 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.169 0.004 18387 5146 1 7 . 1 1 33 33 LEU C C 33 174.693 174.693 175.147 -0.454 18387 5147 1 7 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.693 -0.345 18387 5148 1 7 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.534 0.787 18387 5149 1 7 . 1 1 33 33 LEU H H 33 8.161 8.161 8.816 -0.655 18387 5150 1 7 . 1 1 34 34 VAL N N 34 129.232 129.232 128.549 0.683 18387 5151 1 7 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.805 0.177 18387 5152 1 7 . 1 1 34 34 VAL C C 34 174.285 174.285 174.801 -0.516 18387 5153 1 7 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.431 1.075 18387 5154 1 7 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.225 0.153 18387 5155 1 7 . 1 1 34 34 VAL H H 34 9.296 9.296 9.323 -0.027 18387 5156 1 7 . 1 1 35 35 ASP N N 35 123.675 123.675 126.314 -2.639 18387 5157 1 7 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.137 0.212 18387 5158 1 7 . 1 1 35 35 ASP C C 35 174.258 174.258 175.184 -0.926 18387 5159 1 7 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.404 -1.350 18387 5160 1 7 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.770 -1.308 18387 5161 1 7 . 1 1 35 35 ASP H H 35 8.015 8.015 8.342 -0.327 18387 5162 1 7 . 1 1 36 36 PHE N N 36 126.959 126.959 123.790 3.169 18387 5163 1 7 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.831 0.104 18387 5164 1 7 . 1 1 36 36 PHE C C 36 175.432 175.432 175.945 -0.513 18387 5165 1 7 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.344 0.751 18387 5166 1 7 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.363 -0.333 18387 5167 1 7 . 1 1 36 36 PHE H H 36 9.171 9.171 9.483 -0.312 18387 5168 1 7 . 1 1 37 37 TRP N N 37 120.839 120.839 122.805 -1.966 18387 5169 1 7 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.341 0.416 18387 5170 1 7 . 1 1 37 37 TRP C C 37 172.412 172.412 173.607 -1.195 18387 5171 1 7 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.563 0.346 18387 5172 1 7 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.803 -0.123 18387 5173 1 7 . 1 1 37 37 TRP H H 37 9.280 9.280 8.921 0.359 18387 5174 1 7 . 1 1 38 38 PHE N N 38 109.215 109.215 112.112 -2.897 18387 5175 1 7 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.377 -0.444 18387 5176 1 7 . 1 1 38 38 PHE C C 38 176.141 176.141 174.472 1.669 18387 5177 1 7 . 1 1 38 38 PHE CA C 38 57.011 57.011 55.891 1.120 18387 5178 1 7 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.466 -0.847 18387 5179 1 7 . 1 1 38 38 PHE H H 38 7.062 7.062 7.826 -0.764 18387 5180 1 7 . 1 1 39 39 ALA N N 39 125.193 125.193 122.443 2.750 18387 5181 1 7 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.434 -0.369 18387 5182 1 7 . 1 1 39 39 ALA C C 39 179.349 179.349 177.544 1.805 18387 5183 1 7 . 1 1 39 39 ALA CA C 39 56.064 56.064 52.989 3.075 18387 5184 1 7 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.694 1.203 18387 5185 1 7 . 1 1 39 39 ALA H H 39 10.355 10.355 9.390 0.965 18387 5186 1 7 . 1 1 40 40 GLY N N 40 103.437 103.437 105.299 -1.862 18387 5187 1 7 . 1 1 40 40 GLY C C 40 172.732 172.732 174.137 -1.405 18387 5188 1 7 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.579 0.357 18387 5189 1 7 . 1 1 40 40 GLY H H 40 8.583 8.583 7.750 0.833 18387 5190 1 7 . 1 1 41 41 CYS N N 41 124.859 124.859 120.465 4.394 18387 5191 1 7 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.605 -0.201 18387 5192 1 7 . 1 1 41 41 CYS C C 41 176.620 176.620 175.037 1.583 18387 5193 1 7 . 1 1 41 41 CYS CA C 41 58.375 58.375 56.837 1.538 18387 5194 1 7 . 1 1 41 41 CYS CB C 41 28.376 28.376 29.297 -0.921 18387 5195 1 7 . 1 1 41 41 CYS H H 41 6.946 6.946 6.870 0.076 18387 5196 1 7 . 1 1 42 42 SER HA H 42 4.040 4.040 4.072 -0.032 18387 5197 1 7 . 1 1 42 42 SER CA C 42 61.552 61.552 61.877 -0.325 18387 5198 1 7 . 1 1 42 42 SER CB C 42 62.675 62.675 62.662 0.013 18387 5199 1 7 . 1 1 43 43 TRP N N 43 129.748 129.748 121.167 8.581 18387 5200 1 7 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.456 0.093 18387 5201 1 7 . 1 1 43 43 TRP C C 43 180.400 180.400 178.322 2.078 18387 5202 1 7 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.168 1.081 18387 5203 1 7 . 1 1 43 43 TRP CB C 43 29.592 29.592 28.828 0.764 18387 5204 1 7 . 1 1 44 44 CYS N N 44 124.462 124.462 116.214 8.248 18387 5205 1 7 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.287 -0.036 18387 5206 1 7 . 1 1 44 44 CYS C C 44 178.643 178.643 176.572 2.071 18387 5207 1 7 . 1 1 44 44 CYS CA C 44 64.849 64.849 63.101 1.748 18387 5208 1 7 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.170 2.252 18387 5209 1 7 . 1 1 44 44 CYS H H 44 9.591 9.591 7.761 1.830 18387 5210 1 7 . 1 1 45 45 ARG N N 45 117.248 117.248 116.731 0.517 18387 5211 1 7 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.164 0.012 18387 5212 1 7 . 1 1 45 45 ARG C C 45 180.302 180.302 176.494 3.808 18387 5213 1 7 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.317 -0.374 18387 5214 1 7 . 1 1 45 45 ARG CB C 45 27.631 27.631 30.287 -2.656 18387 5215 1 7 . 1 1 45 45 ARG H H 45 7.955 7.955 7.417 0.538 18387 5216 1 7 . 1 1 46 46 LYS N N 46 120.318 120.318 117.744 2.574 18387 5217 1 7 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.329 -0.057 18387 5218 1 7 . 1 1 46 46 LYS C C 46 177.755 177.755 178.527 -0.772 18387 5219 1 7 . 1 1 46 46 LYS CA C 46 58.769 58.769 58.145 0.624 18387 5220 1 7 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.017 1.140 18387 5221 1 7 . 1 1 46 46 LYS H H 46 8.129 8.129 7.361 0.768 18387 5222 1 7 . 1 1 47 47 GLU N N 47 114.278 114.278 118.325 -4.047 18387 5223 1 7 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.636 0.255 18387 5224 1 7 . 1 1 47 47 GLU C C 47 178.701 178.701 178.534 0.167 18387 5225 1 7 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.589 -2.035 18387 5226 1 7 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.341 0.425 18387 5227 1 7 . 1 1 47 47 GLU H H 47 7.386 7.386 7.867 -0.481 18387 5228 1 7 . 1 1 48 48 THR N N 48 115.665 115.665 116.925 -1.260 18387 5229 1 7 . 1 1 48 48 THR HA H 48 4.048 4.048 4.238 -0.190 18387 5230 1 7 . 1 1 48 48 THR C C 48 172.392 172.392 174.609 -2.217 18387 5231 1 7 . 1 1 48 48 THR CA C 48 69.426 69.426 68.759 0.667 18387 5232 1 7 . 1 1 48 48 THR CB C 48 66.906 66.906 66.467 0.439 18387 5233 1 7 . 1 1 48 48 THR H H 48 7.810 7.810 7.749 0.061 18387 5234 1 7 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.210 0.079 18387 5235 1 7 . 1 1 49 49 PRO C C 49 179.828 179.828 178.687 1.141 18387 5236 1 7 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.467 0.132 18387 5237 1 7 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.100 -0.066 18387 5238 1 7 . 1 1 50 50 TYR N N 50 116.950 116.950 116.092 0.858 18387 5239 1 7 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.253 -0.115 18387 5240 1 7 . 1 1 50 50 TYR C C 50 179.488 179.488 178.248 1.240 18387 5241 1 7 . 1 1 50 50 TYR CA C 50 61.135 61.135 62.064 -0.929 18387 5242 1 7 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.770 0.531 18387 5243 1 7 . 1 1 50 50 TYR H H 50 7.071 7.071 7.231 -0.160 18387 5244 1 7 . 1 1 51 51 LEU N N 51 123.989 123.989 120.245 3.744 18387 5245 1 7 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.834 -0.164 18387 5246 1 7 . 1 1 51 51 LEU C C 51 178.072 178.072 178.863 -0.791 18387 5247 1 7 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.932 0.744 18387 5248 1 7 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.334 1.283 18387 5249 1 7 . 1 1 51 51 LEU H H 51 8.243 8.243 8.588 -0.345 18387 5250 1 7 . 1 1 52 52 LEU N N 52 119.857 119.857 119.905 -0.048 18387 5251 1 7 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.042 0.285 18387 5252 1 7 . 1 1 52 52 LEU C C 52 178.704 178.704 178.160 0.544 18387 5253 1 7 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.239 0.336 18387 5254 1 7 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.671 1.067 18387 5255 1 7 . 1 1 52 52 LEU H H 52 9.085 9.085 8.665 0.420 18387 5256 1 7 . 1 1 53 53 LYS N N 53 118.658 118.658 119.002 -0.344 18387 5257 1 7 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.934 0.175 18387 5258 1 7 . 1 1 53 53 LYS C C 53 179.786 179.786 178.955 0.831 18387 5259 1 7 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.136 -0.415 18387 5260 1 7 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.258 0.901 18387 5261 1 7 . 1 1 53 53 LYS H H 53 7.807 7.807 8.413 -0.606 18387 5262 1 7 . 1 1 54 54 THR N N 54 116.869 116.869 116.371 0.498 18387 5263 1 7 . 1 1 54 54 THR HA H 54 3.965 3.965 4.417 -0.452 18387 5264 1 7 . 1 1 54 54 THR C C 54 175.328 175.328 176.681 -1.353 18387 5265 1 7 . 1 1 54 54 THR CA C 54 67.683 67.683 67.081 0.602 18387 5266 1 7 . 1 1 54 54 THR CB C 54 68.452 68.452 68.912 -0.460 18387 5267 1 7 . 1 1 54 54 THR H H 54 7.771 7.771 7.883 -0.112 18387 5268 1 7 . 1 1 55 55 TYR N N 55 122.202 122.202 122.799 -0.597 18387 5269 1 7 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.277 -0.005 18387 5270 1 7 . 1 1 55 55 TYR C C 55 176.809 176.809 177.217 -0.408 18387 5271 1 7 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.916 0.821 18387 5272 1 7 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.540 0.740 18387 5273 1 7 . 1 1 55 55 TYR H H 55 9.145 9.145 8.770 0.375 18387 5274 1 7 . 1 1 56 56 ASN N N 56 113.858 113.858 117.287 -3.429 18387 5275 1 7 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.365 -0.102 18387 5276 1 7 . 1 1 56 56 ASN C C 56 177.427 177.427 177.364 0.063 18387 5277 1 7 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.536 0.394 18387 5278 1 7 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.198 -0.244 18387 5279 1 7 . 1 1 56 56 ASN H H 56 8.850 8.850 8.635 0.215 18387 5280 1 7 . 1 1 57 57 ALA N N 57 118.829 118.829 121.494 -2.665 18387 5281 1 7 . 1 1 57 57 ALA HA H 57 4.064 4.064 3.954 0.110 18387 5282 1 7 . 1 1 57 57 ALA C C 57 180.445 180.445 177.937 2.508 18387 5283 1 7 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.902 -0.551 18387 5284 1 7 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.803 0.391 18387 5285 1 7 . 1 1 57 57 ALA H H 57 7.436 7.436 7.680 -0.244 18387 5286 1 7 . 1 1 58 58 PHE N N 58 112.082 112.082 114.223 -2.141 18387 5287 1 7 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.724 0.197 18387 5288 1 7 . 1 1 58 58 PHE C C 58 176.999 176.999 176.801 0.198 18387 5289 1 7 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.452 0.615 18387 5290 1 7 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.647 0.843 18387 5291 1 7 . 1 1 58 58 PHE H H 58 7.480 7.480 7.940 -0.460 18387 5292 1 7 . 1 1 59 59 LYS N N 59 120.666 120.666 122.211 -1.545 18387 5293 1 7 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.444 0.359 18387 5294 1 7 . 1 1 59 59 LYS C C 59 177.157 177.157 177.275 -0.118 18387 5295 1 7 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.251 -0.170 18387 5296 1 7 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.444 -0.876 18387 5297 1 7 . 1 1 59 59 LYS H H 59 8.411 8.411 7.699 0.712 18387 5298 1 7 . 1 1 60 60 ASP N N 60 118.908 118.908 115.975 2.933 18387 5299 1 7 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.678 0.447 18387 5300 1 7 . 1 1 60 60 ASP C C 60 176.889 176.889 176.822 0.067 18387 5301 1 7 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.321 -0.672 18387 5302 1 7 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.667 1.045 18387 5303 1 7 . 1 1 60 60 ASP H H 60 8.574 8.574 8.432 0.142 18387 5304 1 7 . 1 1 61 61 LYS N N 61 121.021 121.021 118.712 2.309 18387 5305 1 7 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.615 0.099 18387 5306 1 7 . 1 1 61 61 LYS C C 61 175.968 175.968 176.341 -0.373 18387 5307 1 7 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.520 -0.383 18387 5308 1 7 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.643 0.435 18387 5309 1 7 . 1 1 61 61 LYS H H 61 8.278 8.278 7.589 0.689 18387 5310 1 7 . 1 1 62 62 GLY C C 62 173.837 173.837 173.392 0.445 18387 5311 1 7 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.485 1.565 18387 5312 1 7 . 1 1 63 63 PHE N N 63 120.476 120.476 120.160 0.316 18387 5313 1 7 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.844 0.189 18387 5314 1 7 . 1 1 63 63 PHE C C 63 173.613 173.613 173.236 0.377 18387 5315 1 7 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.321 -0.471 18387 5316 1 7 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.871 -0.196 18387 5317 1 7 . 1 1 63 63 PHE H H 63 7.413 7.413 7.683 -0.270 18387 5318 1 7 . 1 1 64 64 THR N N 64 119.903 119.903 118.054 1.849 18387 5319 1 7 . 1 1 64 64 THR HA H 64 4.097 4.097 4.588 -0.491 18387 5320 1 7 . 1 1 64 64 THR C C 64 170.397 170.397 171.905 -1.508 18387 5321 1 7 . 1 1 64 64 THR CA C 64 60.261 60.261 60.020 0.241 18387 5322 1 7 . 1 1 64 64 THR CB C 64 69.507 69.507 71.606 -2.099 18387 5323 1 7 . 1 1 64 64 THR H H 64 7.665 7.665 8.666 -1.001 18387 5324 1 7 . 1 1 65 65 ILE N N 65 117.277 117.277 123.633 -6.356 18387 5325 1 7 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.430 0.046 18387 5326 1 7 . 1 1 65 65 ILE C C 65 173.056 173.056 174.037 -0.981 18387 5327 1 7 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.328 -0.620 18387 5328 1 7 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.556 0.289 18387 5329 1 7 . 1 1 65 65 ILE H H 65 7.321 7.321 8.592 -1.271 18387 5330 1 7 . 1 1 66 66 TYR N N 66 131.968 131.968 129.425 2.543 18387 5331 1 7 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.067 0.180 18387 5332 1 7 . 1 1 66 66 TYR C C 66 174.074 174.074 174.851 -0.777 18387 5333 1 7 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.696 -0.730 18387 5334 1 7 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.881 1.236 18387 5335 1 7 . 1 1 66 66 TYR H H 66 9.038 9.038 9.116 -0.078 18387 5336 1 7 . 1 1 67 67 GLY N N 67 114.364 114.364 115.527 -1.163 18387 5337 1 7 . 1 1 67 67 GLY C C 67 172.461 172.461 172.707 -0.246 18387 5338 1 7 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.306 0.694 18387 5339 1 7 . 1 1 67 67 GLY H H 67 9.188 9.188 8.622 0.566 18387 5340 1 7 . 1 1 68 68 VAL N N 68 126.938 126.938 119.346 7.592 18387 5341 1 7 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.243 -1.107 18387 5342 1 7 . 1 1 68 68 VAL C C 68 173.822 173.822 174.099 -0.277 18387 5343 1 7 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.194 2.304 18387 5344 1 7 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.976 0.582 18387 5345 1 7 . 1 1 68 68 VAL H H 68 9.309 9.309 9.091 0.218 18387 5346 1 7 . 1 1 69 69 SER N N 69 118.813 118.813 120.973 -2.160 18387 5347 1 7 . 1 1 69 69 SER HA H 69 5.527 5.527 5.204 0.323 18387 5348 1 7 . 1 1 69 69 SER C C 69 175.753 175.753 173.274 2.479 18387 5349 1 7 . 1 1 69 69 SER CA C 69 54.407 54.407 55.461 -1.054 18387 5350 1 7 . 1 1 69 69 SER CB C 69 63.630 63.630 64.740 -1.110 18387 5351 1 7 . 1 1 69 69 SER H H 69 8.124 8.124 8.272 -0.148 18387 5352 1 7 . 1 1 70 70 THR N N 70 113.861 113.861 119.419 -5.558 18387 5353 1 7 . 1 1 70 70 THR HA H 70 4.381 4.381 4.430 -0.049 18387 5354 1 7 . 1 1 70 70 THR C C 70 175.001 175.001 173.160 1.841 18387 5355 1 7 . 1 1 70 70 THR CA C 70 60.259 60.259 59.347 0.912 18387 5356 1 7 . 1 1 70 70 THR CB C 70 67.291 67.291 68.708 -1.417 18387 5357 1 7 . 1 1 70 70 THR H H 70 7.656 7.656 7.897 -0.241 18387 5358 1 7 . 1 1 71 71 ASP N N 71 125.133 125.133 122.634 2.499 18387 5359 1 7 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.361 -0.291 18387 5360 1 7 . 1 1 71 71 ASP C C 71 175.685 175.685 177.651 -1.966 18387 5361 1 7 . 1 1 71 71 ASP CA C 71 57.612 57.612 56.046 1.566 18387 5362 1 7 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.762 0.607 18387 5363 1 7 . 1 1 71 71 ASP H H 71 8.931 8.931 7.225 1.706 18387 5364 1 7 . 1 1 72 72 ARG N N 72 118.814 118.814 120.020 -1.206 18387 5365 1 7 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.064 0.131 18387 5366 1 7 . 1 1 72 72 ARG C C 72 177.300 177.300 176.806 0.494 18387 5367 1 7 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.901 -2.092 18387 5368 1 7 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.791 0.320 18387 5369 1 7 . 1 1 72 72 ARG H H 72 8.057 8.057 8.393 -0.336 18387 5370 1 7 . 1 1 73 73 ARG N N 73 118.174 118.174 115.622 2.552 18387 5371 1 7 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.617 0.137 18387 5372 1 7 . 1 1 73 73 ARG C C 73 176.503 176.503 175.476 1.027 18387 5373 1 7 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.022 -0.486 18387 5374 1 7 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.432 -2.404 18387 5375 1 7 . 1 1 73 73 ARG H H 73 8.639 8.639 7.611 1.028 18387 5376 1 7 . 1 1 74 74 GLU N N 74 127.609 127.609 122.214 5.395 18387 5377 1 7 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.145 -0.066 18387 5378 1 7 . 1 1 74 74 GLU C C 74 178.107 178.107 177.923 0.184 18387 5379 1 7 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.141 -0.356 18387 5380 1 7 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.863 0.235 18387 5381 1 7 . 1 1 74 74 GLU H H 74 9.129 9.129 9.031 0.098 18387 5382 1 7 . 1 1 75 75 GLU N N 75 117.874 117.874 118.983 -1.109 18387 5383 1 7 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.112 -0.012 18387 5384 1 7 . 1 1 75 75 GLU C C 75 178.993 178.993 178.531 0.462 18387 5385 1 7 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.549 0.578 18387 5386 1 7 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.924 0.367 18387 5387 1 7 . 1 1 75 75 GLU H H 75 9.745 9.745 8.780 0.964 18387 5388 1 7 . 1 1 76 76 ASP N N 76 119.182 119.182 119.774 -0.592 18387 5389 1 7 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.450 -0.084 18387 5390 1 7 . 1 1 76 76 ASP C C 76 178.107 178.107 177.876 0.231 18387 5391 1 7 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.860 0.113 18387 5392 1 7 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.455 0.065 18387 5393 1 7 . 1 1 76 76 ASP H H 76 7.004 7.004 8.206 -1.202 18387 5394 1 7 . 1 1 77 77 TRP N N 77 123.008 123.008 122.266 0.742 18387 5395 1 7 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.394 -0.245 18387 5396 1 7 . 1 1 77 77 TRP C C 77 176.236 176.236 178.305 -2.069 18387 5397 1 7 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.765 -0.282 18387 5398 1 7 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.277 -0.742 18387 5399 1 7 . 1 1 77 77 TRP H H 77 7.112 7.112 8.232 -1.120 18387 5400 1 7 . 1 1 78 78 LYS N N 78 115.727 115.727 118.081 -2.354 18387 5401 1 7 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.376 -0.131 18387 5402 1 7 . 1 1 78 78 LYS C C 78 179.426 179.426 178.683 0.743 18387 5403 1 7 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.258 1.174 18387 5404 1 7 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.759 0.986 18387 5405 1 7 . 1 1 78 78 LYS H H 78 8.431 8.431 8.511 -0.080 18387 5406 1 7 . 1 1 79 79 LYS N N 79 118.321 118.321 119.726 -1.405 18387 5407 1 7 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.965 0.055 18387 5408 1 7 . 1 1 79 79 LYS C C 79 178.239 178.239 178.491 -0.252 18387 5409 1 7 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.071 -0.004 18387 5410 1 7 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.083 0.380 18387 5411 1 7 . 1 1 79 79 LYS H H 79 7.690 7.690 7.777 -0.087 18387 5412 1 7 . 1 1 80 80 ALA N N 80 120.679 120.679 121.932 -1.253 18387 5413 1 7 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.367 -0.212 18387 5414 1 7 . 1 1 80 80 ALA C C 80 178.811 178.811 179.898 -1.087 18387 5415 1 7 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.869 0.218 18387 5416 1 7 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.524 0.234 18387 5417 1 7 . 1 1 80 80 ALA H H 80 7.560 7.560 7.941 -0.381 18387 5418 1 7 . 1 1 81 81 ILE N N 81 118.019 118.019 118.728 -0.709 18387 5419 1 7 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.767 -0.365 18387 5420 1 7 . 1 1 81 81 ILE C C 81 178.113 178.113 178.269 -0.156 18387 5421 1 7 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.604 -0.084 18387 5422 1 7 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.287 0.917 18387 5423 1 7 . 1 1 81 81 ILE H H 81 7.514 7.514 7.748 -0.234 18387 5424 1 7 . 1 1 82 82 GLU N N 82 117.252 117.252 119.499 -2.247 18387 5425 1 7 . 1 1 82 82 GLU HA H 82 4.094 4.094 4.014 0.080 18387 5426 1 7 . 1 1 82 82 GLU C C 82 179.558 179.558 177.469 2.089 18387 5427 1 7 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.965 -0.385 18387 5428 1 7 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.569 -0.186 18387 5429 1 7 . 1 1 82 82 GLU H H 82 7.401 7.401 7.674 -0.273 18387 5430 1 7 . 1 1 83 83 GLU N N 83 119.340 119.340 117.830 1.510 18387 5431 1 7 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.168 -0.270 18387 5432 1 7 . 1 1 83 83 GLU C C 83 178.740 178.740 178.279 0.461 18387 5433 1 7 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.739 0.260 18387 5434 1 7 . 1 1 83 83 GLU CB C 83 29.920 29.920 30.127 -0.207 18387 5435 1 7 . 1 1 83 83 GLU H H 83 8.191 8.191 7.334 0.857 18387 5436 1 7 . 1 1 84 84 ASP N N 84 118.449 118.449 116.882 1.567 18387 5437 1 7 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.509 -0.235 18387 5438 1 7 . 1 1 84 84 ASP C C 84 175.597 175.597 176.538 -0.941 18387 5439 1 7 . 1 1 84 84 ASP CA C 84 55.047 55.047 53.899 1.148 18387 5440 1 7 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.033 -1.137 18387 5441 1 7 . 1 1 84 84 ASP H H 84 8.252 8.252 8.271 -0.019 18387 5442 1 7 . 1 1 85 85 LYS N N 85 116.410 116.410 116.830 -0.420 18387 5443 1 7 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.958 -0.785 18387 5444 1 7 . 1 1 85 85 LYS C C 85 176.856 176.856 176.111 0.745 18387 5445 1 7 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.644 -0.671 18387 5446 1 7 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.677 -0.809 18387 5447 1 7 . 1 1 85 85 LYS H H 85 7.890 7.890 8.142 -0.252 18387 5448 1 7 . 1 1 86 86 SER N N 86 112.295 112.295 114.588 -2.293 18387 5449 1 7 . 1 1 86 86 SER HA H 86 3.139 3.139 3.511 -0.372 18387 5450 1 7 . 1 1 86 86 SER C C 86 175.805 175.805 172.847 2.958 18387 5451 1 7 . 1 1 86 86 SER CA C 86 53.637 53.637 57.876 -4.239 18387 5452 1 7 . 1 1 86 86 SER CB C 86 60.736 60.736 61.123 -0.387 18387 5453 1 7 . 1 1 86 86 SER H H 86 7.327 7.327 8.062 -0.735 18387 5454 1 7 . 1 1 87 87 TYR N N 87 120.962 120.962 124.724 -3.762 18387 5455 1 7 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.117 0.188 18387 5456 1 7 . 1 1 87 87 TYR C C 87 177.064 177.064 174.264 2.800 18387 5457 1 7 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.905 -0.682 18387 5458 1 7 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.087 -0.734 18387 5459 1 7 . 1 1 87 87 TYR H H 87 6.933 6.933 7.842 -0.909 18387 5460 1 7 . 1 1 88 88 TRP N N 88 118.597 118.597 121.158 -2.561 18387 5461 1 7 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.625 0.226 18387 5462 1 7 . 1 1 88 88 TRP C C 88 175.456 175.456 175.340 0.116 18387 5463 1 7 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.971 1.265 18387 5464 1 7 . 1 1 88 88 TRP CB C 88 25.727 25.727 28.860 -3.133 18387 5465 1 7 . 1 1 88 88 TRP H H 88 6.552 6.552 6.869 -0.317 18387 5466 1 7 . 1 1 89 89 ASN N N 89 118.067 118.067 120.358 -2.291 18387 5467 1 7 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.578 0.471 18387 5468 1 7 . 1 1 89 89 ASN C C 89 173.773 173.773 174.162 -0.389 18387 5469 1 7 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.506 1.950 18387 5470 1 7 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.365 1.832 18387 5471 1 7 . 1 1 89 89 ASN H H 89 7.864 7.864 8.495 -0.631 18387 5472 1 7 . 1 1 90 90 GLN N N 90 125.392 125.392 122.707 2.685 18387 5473 1 7 . 1 1 90 90 GLN HA H 90 5.497 5.497 4.664 0.833 18387 5474 1 7 . 1 1 90 90 GLN C C 90 176.491 176.491 175.118 1.373 18387 5475 1 7 . 1 1 90 90 GLN CA C 90 55.460 55.460 55.127 0.333 18387 5476 1 7 . 1 1 90 90 GLN CB C 90 31.227 31.227 29.678 1.549 18387 5477 1 7 . 1 1 90 90 GLN H H 90 7.904 7.904 8.246 -0.342 18387 5478 1 7 . 1 1 91 91 VAL N N 91 114.434 114.434 120.573 -6.139 18387 5479 1 7 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.985 0.495 18387 5480 1 7 . 1 1 91 91 VAL C C 91 174.248 174.248 172.881 1.367 18387 5481 1 7 . 1 1 91 91 VAL CA C 91 59.006 59.006 58.743 0.263 18387 5482 1 7 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.557 1.081 18387 5483 1 7 . 1 1 91 91 VAL H H 91 9.585 9.585 9.073 0.512 18387 5484 1 7 . 1 1 92 92 LEU N N 92 126.910 126.910 123.183 3.727 18387 5485 1 7 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.091 -0.022 18387 5486 1 7 . 1 1 92 92 LEU C C 92 177.696 177.696 175.641 2.055 18387 5487 1 7 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.377 0.468 18387 5488 1 7 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.090 -0.143 18387 5489 1 7 . 1 1 92 92 LEU H H 92 8.941 8.941 8.103 0.838 18387 5490 1 7 . 1 1 93 93 LEU N N 93 125.673 125.673 127.497 -1.824 18387 5491 1 7 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.226 0.174 18387 5492 1 7 . 1 1 93 93 LEU C C 93 177.291 177.291 176.666 0.625 18387 5493 1 7 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.055 -0.104 18387 5494 1 7 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.210 1.969 18387 5495 1 7 . 1 1 93 93 LEU H H 93 8.038 8.038 8.734 -0.696 18387 5496 1 7 . 1 1 94 94 GLN N N 94 122.206 122.206 124.174 -1.968 18387 5497 1 7 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.113 0.124 18387 5498 1 7 . 1 1 94 94 GLN C C 94 178.246 178.246 176.591 1.655 18387 5499 1 7 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.200 -0.425 18387 5500 1 7 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.312 -0.057 18387 5501 1 7 . 1 1 94 94 GLN H H 94 9.298 9.298 8.393 0.905 18387 5502 1 7 . 1 1 95 95 LYS N N 95 122.668 122.668 122.271 0.397 18387 5503 1 7 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.026 -0.060 18387 5504 1 7 . 1 1 95 95 LYS C C 95 178.787 178.787 177.318 1.469 18387 5505 1 7 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.612 1.460 18387 5506 1 7 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.815 0.650 18387 5507 1 7 . 1 1 95 95 LYS H H 95 8.645 8.645 8.824 -0.179 18387 5508 1 7 . 1 1 96 96 ASP N N 96 116.775 116.775 119.734 -2.959 18387 5509 1 7 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.515 0.065 18387 5510 1 7 . 1 1 96 96 ASP C C 96 176.220 176.220 177.807 -1.587 18387 5511 1 7 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.533 -0.187 18387 5512 1 7 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.702 -0.145 18387 5513 1 7 . 1 1 96 96 ASP H H 96 8.606 8.606 8.097 0.509 18387 5514 1 7 . 1 1 97 97 ASP N N 97 118.213 118.213 121.817 -3.604 18387 5515 1 7 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.334 0.593 18387 5516 1 7 . 1 1 97 97 ASP C C 97 176.954 176.954 178.346 -1.392 18387 5517 1 7 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.177 -1.818 18387 5518 1 7 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.746 1.578 18387 5519 1 7 . 1 1 97 97 ASP H H 97 7.988 7.988 8.371 -0.383 18387 5520 1 7 . 1 1 98 98 VAL N N 98 118.907 118.907 119.652 -0.745 18387 5521 1 7 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.488 -0.072 18387 5522 1 7 . 1 1 98 98 VAL C C 98 176.470 176.470 177.937 -1.467 18387 5523 1 7 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.221 1.558 18387 5524 1 7 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.587 0.804 18387 5525 1 7 . 1 1 98 98 VAL H H 98 7.098 7.098 8.470 -1.372 18387 5526 1 7 . 1 1 99 99 LYS N N 99 117.909 117.909 119.692 -1.783 18387 5527 1 7 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.915 0.028 18387 5528 1 7 . 1 1 99 99 LYS C C 99 178.762 178.762 178.572 0.190 18387 5529 1 7 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.189 -0.044 18387 5530 1 7 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.041 -0.028 18387 5531 1 7 . 1 1 99 99 LYS H H 99 8.304 8.304 7.895 0.409 18387 5532 1 7 . 1 1 100 100 ASP N N 100 117.843 117.843 118.773 -0.930 18387 5533 1 7 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.487 -0.009 18387 5534 1 7 . 1 1 100 100 ASP C C 100 179.694 179.694 178.800 0.894 18387 5535 1 7 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.416 0.111 18387 5536 1 7 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.361 0.467 18387 5537 1 7 . 1 1 100 100 ASP H H 100 8.024 8.024 7.859 0.165 18387 5538 1 7 . 1 1 101 101 VAL N N 101 122.202 122.202 120.815 1.387 18387 5539 1 7 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.790 0.205 18387 5540 1 7 . 1 1 101 101 VAL C C 101 178.533 178.533 177.607 0.926 18387 5541 1 7 . 1 1 101 101 VAL CA C 101 67.002 67.002 67.097 -0.094 18387 5542 1 7 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.986 0.051 18387 5543 1 7 . 1 1 101 101 VAL H H 101 8.205 8.205 8.058 0.147 18387 5544 1 7 . 1 1 102 102 LEU N N 102 118.798 118.798 119.323 -0.525 18387 5545 1 7 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.850 -0.070 18387 5546 1 7 . 1 1 102 102 LEU C C 102 180.254 180.254 178.838 1.416 18387 5547 1 7 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.099 0.842 18387 5548 1 7 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.323 -0.884 18387 5549 1 7 . 1 1 102 102 LEU H H 102 8.422 8.422 8.020 0.402 18387 5550 1 7 . 1 1 103 103 GLU N N 103 116.915 116.915 119.882 -2.967 18387 5551 1 7 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.934 0.201 18387 5552 1 7 . 1 1 103 103 GLU C C 103 180.910 180.910 179.322 1.588 18387 5553 1 7 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.300 0.103 18387 5554 1 7 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.316 0.415 18387 5555 1 7 . 1 1 103 103 GLU H H 103 8.262 8.262 7.863 0.399 18387 5556 1 7 . 1 1 104 104 SER N N 104 117.866 117.866 115.309 2.557 18387 5557 1 7 . 1 1 104 104 SER HA H 104 4.216 4.216 4.203 0.013 18387 5558 1 7 . 1 1 104 104 SER C C 104 175.455 175.455 175.662 -0.207 18387 5559 1 7 . 1 1 104 104 SER CA C 104 62.019 62.019 61.209 0.810 18387 5560 1 7 . 1 1 104 104 SER CB C 104 62.891 62.891 63.245 -0.354 18387 5561 1 7 . 1 1 104 104 SER H H 104 8.544 8.544 7.738 0.806 18387 5562 1 7 . 1 1 105 105 TYR N N 105 117.278 117.278 117.533 -0.255 18387 5563 1 7 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.423 -0.151 18387 5564 1 7 . 1 1 105 105 TYR C C 105 174.750 174.750 175.106 -0.356 18387 5565 1 7 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.962 1.897 18387 5566 1 7 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.532 2.179 18387 5567 1 7 . 1 1 105 105 TYR H H 105 7.691 7.691 7.458 0.233 18387 5568 1 7 . 1 1 106 106 CYS N N 106 116.897 116.897 115.299 1.598 18387 5569 1 7 . 1 1 106 106 CYS HA H 106 3.895 3.895 3.975 -0.080 18387 5570 1 7 . 1 1 106 106 CYS C C 106 174.056 174.056 173.816 0.240 18387 5571 1 7 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.116 0.494 18387 5572 1 7 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.625 0.407 18387 5573 1 7 . 1 1 106 106 CYS H H 106 7.862 7.862 7.930 -0.068 18387 5574 1 7 . 1 1 107 107 ILE N N 107 118.885 118.885 121.533 -2.648 18387 5575 1 7 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.742 -0.403 18387 5576 1 7 . 1 1 107 107 ILE C C 107 176.793 176.793 175.636 1.157 18387 5577 1 7 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.368 1.377 18387 5578 1 7 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.224 0.855 18387 5579 1 7 . 1 1 107 107 ILE H H 107 7.707 7.707 7.714 -0.007 18387 5580 1 7 . 1 1 108 108 VAL N N 108 123.983 123.983 121.825 2.158 18387 5581 1 7 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.263 0.011 18387 5582 1 7 . 1 1 108 108 VAL C C 108 175.476 175.476 175.540 -0.064 18387 5583 1 7 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.478 0.146 18387 5584 1 7 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.243 0.765 18387 5585 1 7 . 1 1 108 108 VAL H H 108 8.656 8.656 8.241 0.415 18387 5586 1 7 . 1 1 109 109 GLY N N 109 110.120 110.120 108.752 1.368 18387 5587 1 7 . 1 1 109 109 GLY C C 109 169.982 169.982 172.537 -2.555 18387 5588 1 7 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.419 -0.816 18387 5589 1 7 . 1 1 109 109 GLY H H 109 7.500 7.500 7.344 0.156 18387 5590 1 7 . 1 1 110 110 PHE N N 110 115.276 115.276 118.530 -3.254 18387 5591 1 7 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.286 -0.512 18387 5592 1 7 . 1 1 110 110 PHE C C 110 174.361 174.361 174.207 0.154 18387 5593 1 7 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.502 0.186 18387 5594 1 7 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.885 0.066 18387 5595 1 7 . 1 1 110 110 PHE H H 110 8.203 8.203 8.587 -0.384 18387 5596 1 7 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.444 -0.085 18387 5597 1 7 . 1 1 111 111 PRO C C 111 175.691 175.691 175.336 0.355 18387 5598 1 7 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.562 0.595 18387 5599 1 7 . 1 1 111 111 PRO CB C 111 35.304 35.304 34.244 1.060 18387 5600 1 7 . 1 1 112 112 HIS N N 112 123.708 123.708 116.947 6.761 18387 5601 1 7 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.982 -0.019 18387 5602 1 7 . 1 1 112 112 HIS C C 112 173.649 173.649 173.757 -0.108 18387 5603 1 7 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.096 0.978 18387 5604 1 7 . 1 1 112 112 HIS CB C 112 32.197 32.197 34.101 -1.904 18387 5605 1 7 . 1 1 112 112 HIS H H 112 8.952 8.952 8.768 0.184 18387 5606 1 7 . 1 1 113 113 ILE N N 113 128.596 128.596 123.992 4.604 18387 5607 1 7 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.389 0.308 18387 5608 1 7 . 1 1 113 113 ILE C C 113 176.130 176.130 174.848 1.282 18387 5609 1 7 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.332 0.663 18387 5610 1 7 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.232 -2.177 18387 5611 1 7 . 1 1 113 113 ILE H H 113 8.808 8.808 8.801 0.007 18387 5612 1 7 . 1 1 114 114 ILE N N 114 119.668 119.668 121.225 -1.557 18387 5613 1 7 . 1 1 114 114 ILE HA H 114 4.973 4.973 5.095 -0.122 18387 5614 1 7 . 1 1 114 114 ILE C C 114 173.186 173.186 173.705 -0.519 18387 5615 1 7 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.755 -0.025 18387 5616 1 7 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.199 0.341 18387 5617 1 7 . 1 1 114 114 ILE H H 114 8.721 8.721 9.203 -0.482 18387 5618 1 7 . 1 1 115 115 LEU N N 115 122.770 122.770 124.783 -2.013 18387 5619 1 7 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.082 0.193 18387 5620 1 7 . 1 1 115 115 LEU C C 115 173.601 173.601 175.002 -1.401 18387 5621 1 7 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.342 0.440 18387 5622 1 7 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.152 1.982 18387 5623 1 7 . 1 1 115 115 LEU H H 115 8.665 8.665 8.991 -0.326 18387 5624 1 7 . 1 1 116 116 VAL N N 116 130.411 130.411 126.608 3.803 18387 5625 1 7 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.863 -0.005 18387 5626 1 7 . 1 1 116 116 VAL C C 116 174.565 174.565 175.531 -0.966 18387 5627 1 7 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.884 -0.080 18387 5628 1 7 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.033 -0.118 18387 5629 1 7 . 1 1 116 116 VAL H H 116 9.472 9.472 9.338 0.134 18387 5630 1 7 . 1 1 117 117 ASP N N 117 127.896 127.896 126.711 1.185 18387 5631 1 7 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.662 -0.270 18387 5632 1 7 . 1 1 117 117 ASP C C 117 176.567 176.567 174.745 1.822 18387 5633 1 7 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.009 0.591 18387 5634 1 7 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.821 -0.237 18387 5635 1 7 . 1 1 117 117 ASP H H 117 9.429 9.429 8.697 0.732 18387 5636 1 7 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.413 -0.219 18387 5637 1 7 . 1 1 118 118 PRO C C 118 177.534 177.534 178.456 -0.922 18387 5638 1 7 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.338 -0.173 18387 5639 1 7 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.855 0.958 18387 5640 1 7 . 1 1 119 119 GLU N N 119 114.015 114.015 116.250 -2.235 18387 5641 1 7 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.194 0.145 18387 5642 1 7 . 1 1 119 119 GLU C C 119 176.722 176.722 177.364 -0.642 18387 5643 1 7 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.356 -1.717 18387 5644 1 7 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.389 0.188 18387 5645 1 7 . 1 1 119 119 GLU H H 119 7.733 7.733 8.149 -0.416 18387 5646 1 7 . 1 1 120 120 GLY N N 120 108.218 108.218 106.744 1.474 18387 5647 1 7 . 1 1 120 120 GLY C C 120 174.110 174.110 173.200 0.910 18387 5648 1 7 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.803 0.593 18387 5649 1 7 . 1 1 120 120 GLY H H 120 8.588 8.588 8.421 0.167 18387 5650 1 7 . 1 1 121 121 LYS N N 121 121.778 121.778 119.998 1.780 18387 5651 1 7 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.142 -0.283 18387 5652 1 7 . 1 1 121 121 LYS C C 121 176.458 176.458 175.942 0.516 18387 5653 1 7 . 1 1 121 121 LYS CA C 121 54.962 54.962 53.902 1.060 18387 5654 1 7 . 1 1 121 121 LYS CB C 121 33.452 33.452 34.702 -1.250 18387 5655 1 7 . 1 1 121 121 LYS H H 121 8.600 8.600 9.160 -0.560 18387 5656 1 7 . 1 1 122 122 ILE N N 122 122.058 122.058 124.070 -2.012 18387 5657 1 7 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.315 -0.043 18387 5658 1 7 . 1 1 122 122 ILE C C 122 177.084 177.084 176.934 0.150 18387 5659 1 7 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.399 0.420 18387 5660 1 7 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.998 1.650 18387 5661 1 7 . 1 1 122 122 ILE H H 122 9.006 9.006 9.048 -0.042 18387 5662 1 7 . 1 1 123 123 VAL N N 123 120.561 120.561 128.918 -8.357 18387 5663 1 7 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.074 0.681 18387 5664 1 7 . 1 1 123 123 VAL C C 123 175.584 175.584 174.600 0.984 18387 5665 1 7 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.938 -1.787 18387 5666 1 7 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.834 0.567 18387 5667 1 7 . 1 1 123 123 VAL H H 123 9.054 9.054 8.648 0.406 18387 5668 1 7 . 1 1 124 124 ALA N N 124 121.102 121.102 120.801 0.301 18387 5669 1 7 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.696 -0.039 18387 5670 1 7 . 1 1 124 124 ALA C C 124 174.832 174.832 174.513 0.319 18387 5671 1 7 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.498 0.962 18387 5672 1 7 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.392 1.438 18387 5673 1 7 . 1 1 124 124 ALA H H 124 7.793 7.793 7.568 0.225 18387 5674 1 7 . 1 1 125 125 LYS N N 125 117.637 117.637 121.777 -4.140 18387 5675 1 7 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.557 0.476 18387 5676 1 7 . 1 1 125 125 LYS C C 125 173.417 173.417 176.022 -2.605 18387 5677 1 7 . 1 1 125 125 LYS CA C 125 55.141 55.141 54.986 0.155 18387 5678 1 7 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.407 1.244 18387 5679 1 7 . 1 1 125 125 LYS H H 125 8.872 8.872 8.507 0.365 18387 5680 1 7 . 1 1 126 126 GLU N N 126 115.236 115.236 117.506 -2.270 18387 5681 1 7 . 1 1 126 126 GLU HA H 126 3.998 3.998 4.039 -0.041 18387 5682 1 7 . 1 1 126 126 GLU C C 126 175.998 175.998 175.298 0.700 18387 5683 1 7 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.381 -0.419 18387 5684 1 7 . 1 1 126 126 GLU CB C 126 26.435 26.435 26.754 -0.319 18387 5685 1 7 . 1 1 126 126 GLU H H 126 7.941 7.941 8.613 -0.672 18387 5686 1 7 . 1 1 127 127 LEU N N 127 118.584 118.584 120.324 -1.740 18387 5687 1 7 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.327 0.056 18387 5688 1 7 . 1 1 127 127 LEU C C 127 176.766 176.766 175.339 1.427 18387 5689 1 7 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.380 -0.771 18387 5690 1 7 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.619 1.344 18387 5691 1 7 . 1 1 127 127 LEU H H 127 7.300 7.300 8.258 -0.958 18387 5692 1 7 . 1 1 128 128 ARG N N 128 118.625 118.625 117.468 1.157 18387 5693 1 7 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.761 -0.286 18387 5694 1 7 . 1 1 128 128 ARG C C 128 177.113 177.113 176.423 0.690 18387 5695 1 7 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.626 -1.236 18387 5696 1 7 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.770 1.842 18387 5697 1 7 . 1 1 128 128 ARG H H 128 7.929 7.929 8.085 -0.156 18387 5698 1 7 . 1 1 129 129 GLY N N 129 114.010 114.010 110.108 3.902 18387 5699 1 7 . 1 1 129 129 GLY C C 129 175.931 175.931 174.200 1.731 18387 5700 1 7 . 1 1 129 129 GLY CA C 129 45.461 45.461 45.974 -0.513 18387 5701 1 7 . 1 1 129 129 GLY H H 129 10.649 10.649 9.379 1.270 18387 5702 1 7 . 1 1 130 130 ASP N N 130 123.975 123.975 123.379 0.596 18387 5703 1 7 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.539 -0.007 18387 5704 1 7 . 1 1 130 130 ASP C C 130 177.507 177.507 177.903 -0.396 18387 5705 1 7 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.475 0.897 18387 5706 1 7 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.972 -0.069 18387 5707 1 7 . 1 1 130 130 ASP H H 130 8.540 8.540 8.482 0.058 18387 5708 1 7 . 1 1 131 131 ASP N N 131 116.806 116.806 120.801 -3.995 18387 5709 1 7 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.348 0.222 18387 5710 1 7 . 1 1 131 131 ASP C C 131 179.038 179.038 178.722 0.316 18387 5711 1 7 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.405 -0.422 18387 5712 1 7 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.543 0.391 18387 5713 1 7 . 1 1 131 131 ASP H H 131 7.907 7.907 7.887 0.020 18387 5714 1 7 . 1 1 132 132 LEU N N 132 123.869 123.869 120.649 3.220 18387 5715 1 7 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.940 -0.149 18387 5716 1 7 . 1 1 132 132 LEU C C 132 176.343 176.343 178.714 -2.371 18387 5717 1 7 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.274 1.510 18387 5718 1 7 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.361 0.407 18387 5719 1 7 . 1 1 132 132 LEU H H 132 7.542 7.542 7.829 -0.287 18387 5720 1 7 . 1 1 133 133 TYR N N 133 120.042 120.042 119.137 0.905 18387 5721 1 7 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.044 -0.048 18387 5722 1 7 . 1 1 133 133 TYR C C 133 177.426 177.426 177.645 -0.219 18387 5723 1 7 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.506 0.627 18387 5724 1 7 . 1 1 133 133 TYR CB C 133 38.576 38.576 37.988 0.588 18387 5725 1 7 . 1 1 133 133 TYR H H 133 7.384 7.384 8.338 -0.954 18387 5726 1 7 . 1 1 134 134 ASN N N 134 114.936 114.936 117.480 -2.544 18387 5727 1 7 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.435 -0.032 18387 5728 1 7 . 1 1 134 134 ASN C C 134 178.703 178.703 177.963 0.740 18387 5729 1 7 . 1 1 134 134 ASN CA C 134 55.809 55.809 57.485 -1.676 18387 5730 1 7 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.647 -0.439 18387 5731 1 7 . 1 1 134 134 ASN H H 134 8.399 8.399 9.030 -0.631 18387 5732 1 7 . 1 1 135 135 THR N N 135 117.387 117.387 116.950 0.437 18387 5733 1 7 . 1 1 135 135 THR HA H 135 3.920 3.920 4.053 -0.133 18387 5734 1 7 . 1 1 135 135 THR C C 135 175.323 175.323 176.553 -1.230 18387 5735 1 7 . 1 1 135 135 THR CA C 135 67.402 67.402 66.549 0.853 18387 5736 1 7 . 1 1 135 135 THR CB C 135 68.111 68.111 69.071 -0.960 18387 5737 1 7 . 1 1 135 135 THR H H 135 8.265 8.265 8.102 0.163 18387 5738 1 7 . 1 1 136 136 VAL N N 136 121.207 121.207 121.656 -0.449 18387 5739 1 7 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.255 -0.240 18387 5740 1 7 . 1 1 136 136 VAL C C 136 176.457 176.457 176.990 -0.533 18387 5741 1 7 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.253 2.019 18387 5742 1 7 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.493 0.448 18387 5743 1 7 . 1 1 136 136 VAL H H 136 7.595 7.595 7.372 0.223 18387 5744 1 7 . 1 1 137 137 GLU N N 137 118.266 118.266 119.140 -0.874 18387 5745 1 7 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.718 -1.036 18387 5746 1 7 . 1 1 137 137 GLU C C 137 177.482 177.482 178.490 -1.008 18387 5747 1 7 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.194 0.736 18387 5748 1 7 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.297 0.485 18387 5749 1 7 . 1 1 137 137 GLU H H 137 8.114 8.114 8.105 0.009 18387 5750 1 7 . 1 1 138 138 LYS N N 138 116.431 116.431 118.657 -2.226 18387 5751 1 7 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.879 -0.111 18387 5752 1 7 . 1 1 138 138 LYS C C 138 179.193 179.193 178.829 0.364 18387 5753 1 7 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.350 -0.310 18387 5754 1 7 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.295 -0.137 18387 5755 1 7 . 1 1 138 138 LYS H H 138 7.133 7.133 7.336 -0.203 18387 5756 1 7 . 1 1 139 139 PHE N N 139 116.336 116.336 116.210 0.126 18387 5757 1 7 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.286 -0.276 18387 5758 1 7 . 1 1 139 139 PHE C C 139 177.855 177.855 176.917 0.938 18387 5759 1 7 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.200 1.183 18387 5760 1 7 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.221 0.131 18387 5761 1 7 . 1 1 139 139 PHE H H 139 7.338 7.338 7.625 -0.287 18387 5762 1 7 . 1 1 140 140 VAL N N 140 116.491 116.491 116.169 0.322 18387 5763 1 7 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.383 0.141 18387 5764 1 7 . 1 1 140 140 VAL C C 140 177.747 177.747 177.941 -0.194 18387 5765 1 7 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.911 0.331 18387 5766 1 7 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.303 0.087 18387 5767 1 7 . 1 1 140 140 VAL H H 140 8.332 8.332 7.977 0.355 18387 5768 1 7 . 1 1 141 141 ASN N N 141 116.956 116.956 118.177 -1.221 18387 5769 1 7 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.631 0.195 18387 5770 1 7 . 1 1 141 141 ASN C C 141 176.997 176.997 177.362 -0.365 18387 5771 1 7 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.118 -1.441 18387 5772 1 7 . 1 1 141 141 ASN CB C 141 38.448 38.448 38.571 -0.123 18387 5773 1 7 . 1 1 141 141 ASN H H 141 7.862 7.862 7.544 0.318 18387 5774 1 7 . 1 1 142 142 GLY N N 142 107.938 107.938 106.346 1.592 18387 5775 1 7 . 1 1 142 142 GLY C C 142 174.336 174.336 174.231 0.105 18387 5776 1 7 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.935 1.050 18387 5777 1 7 . 1 1 142 142 GLY H H 142 7.466 7.466 7.751 -0.285 18387 5778 1 7 . 1 1 143 143 ALA N N 143 123.441 123.441 121.681 1.760 18387 5779 1 7 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.246 0.095 18387 5780 1 7 . 1 1 143 143 ALA C C 143 178.212 178.212 177.977 0.235 18387 5781 1 7 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.657 -0.831 18387 5782 1 7 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.668 0.576 18387 5783 1 7 . 1 1 143 143 ALA H H 143 7.950 7.950 7.504 0.446 18387 5784 1 7 . 1 1 144 144 LYS N N 144 120.149 120.149 118.749 1.400 18387 5785 1 7 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.308 -0.013 18387 5786 1 7 . 1 1 144 144 LYS C C 144 176.945 176.945 178.471 -1.526 18387 5787 1 7 . 1 1 144 144 LYS CA C 144 56.519 56.519 57.549 -1.030 18387 5788 1 7 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.824 0.206 18387 5789 1 7 . 1 1 144 144 LYS H H 144 8.187 8.187 7.708 0.479 18387 5790 1 7 . 1 1 145 145 GLU N N 145 120.992 120.992 118.553 2.439 18387 5791 1 7 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.399 -0.104 18387 5792 1 7 . 1 1 145 145 GLU C C 145 177.116 177.116 176.618 0.498 18387 5793 1 7 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.121 0.782 18387 5794 1 7 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.994 0.248 18387 5795 1 7 . 1 1 145 145 GLU H H 145 8.363 8.363 8.580 -0.217 18387 5796 1 7 . 1 1 146 146 GLY N N 146 109.467 109.467 107.458 2.009 18387 5797 1 7 . 1 1 146 146 GLY C C 146 174.108 174.108 174.068 0.040 18387 5798 1 7 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.384 1.017 18387 5799 1 7 . 1 1 146 146 GLY H H 146 8.371 8.371 7.522 0.849 18387 5800 1 7 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.556 0.053 18387 5801 1 7 . 1 1 151 151 HIS C C 151 174.258 174.258 174.928 -0.670 18387 5802 1 7 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.575 0.590 18387 5803 1 7 . 1 1 151 151 HIS CB C 151 30.833 30.833 31.172 -0.339 18387 5804 1 8 . 1 1 2 2 SER HA H 2 3.992 3.992 4.492 -0.500 18387 5805 1 8 . 1 1 2 2 SER CA C 2 57.555 57.555 58.022 -0.466 18387 5806 1 8 . 1 1 2 2 SER CB C 2 64.977 64.977 62.327 2.650 18387 5807 1 8 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.301 0.138 18387 5808 1 8 . 1 1 3 3 LEU C C 3 176.631 176.631 175.865 0.766 18387 5809 1 8 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.755 -0.191 18387 5810 1 8 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.314 0.410 18387 5811 1 8 . 1 1 4 4 ALA N N 4 125.483 125.483 126.569 -1.086 18387 5812 1 8 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.637 -0.258 18387 5813 1 8 . 1 1 4 4 ALA C C 4 179.642 179.642 176.672 2.970 18387 5814 1 8 . 1 1 4 4 ALA CA C 4 51.735 51.735 50.911 0.824 18387 5815 1 8 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.569 -0.817 18387 5816 1 8 . 1 1 4 4 ALA H H 4 8.483 8.483 8.264 0.219 18387 5817 1 8 . 1 1 5 5 THR HA H 5 3.845 3.845 4.468 -0.623 18387 5818 1 8 . 1 1 5 5 THR C C 5 175.487 175.487 176.079 -0.592 18387 5819 1 8 . 1 1 5 5 THR CA C 5 64.531 64.531 63.475 1.056 18387 5820 1 8 . 1 1 5 5 THR CB C 5 68.108 68.108 68.029 0.078 18387 5821 1 8 . 1 1 6 6 GLY N N 6 114.298 114.298 115.488 -1.190 18387 5822 1 8 . 1 1 6 6 GLY C C 6 174.324 174.324 174.254 0.070 18387 5823 1 8 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.013 -0.178 18387 5824 1 8 . 1 1 6 6 GLY H H 6 9.511 9.511 9.049 0.462 18387 5825 1 8 . 1 1 7 7 SER N N 7 115.270 115.270 118.630 -3.360 18387 5826 1 8 . 1 1 7 7 SER HA H 7 4.500 4.500 4.640 -0.140 18387 5827 1 8 . 1 1 7 7 SER C C 7 173.315 173.315 174.026 -0.711 18387 5828 1 8 . 1 1 7 7 SER CA C 7 58.915 58.915 57.997 0.918 18387 5829 1 8 . 1 1 7 7 SER CB C 7 64.308 64.308 64.079 0.229 18387 5830 1 8 . 1 1 7 7 SER H H 7 7.736 7.736 8.077 -0.341 18387 5831 1 8 . 1 1 8 8 VAL N N 8 123.708 123.708 126.564 -2.856 18387 5832 1 8 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.317 -0.485 18387 5833 1 8 . 1 1 8 8 VAL C C 8 176.673 176.673 176.165 0.508 18387 5834 1 8 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.475 0.198 18387 5835 1 8 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.014 0.208 18387 5836 1 8 . 1 1 8 8 VAL H H 8 8.632 8.632 8.655 -0.023 18387 5837 1 8 . 1 1 9 9 ALA N N 9 133.040 133.040 131.364 1.676 18387 5838 1 8 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.798 -0.535 18387 5839 1 8 . 1 1 9 9 ALA C C 9 175.404 175.404 175.310 0.094 18387 5840 1 8 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.959 0.996 18387 5841 1 8 . 1 1 9 9 ALA CB C 9 18.030 18.030 19.161 -1.131 18387 5842 1 8 . 1 1 9 9 ALA H H 9 8.448 8.448 8.874 -0.426 18387 5843 1 8 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.401 -0.070 18387 5844 1 8 . 1 1 10 10 PRO C C 10 175.071 175.071 175.919 -0.848 18387 5845 1 8 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.444 0.197 18387 5846 1 8 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.270 0.054 18387 5847 1 8 . 1 1 11 11 ALA N N 11 124.172 124.172 123.768 0.404 18387 5848 1 8 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.582 -0.338 18387 5849 1 8 . 1 1 11 11 ALA C C 11 177.688 177.688 177.231 0.457 18387 5850 1 8 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.236 2.385 18387 5851 1 8 . 1 1 11 11 ALA CB C 11 19.327 19.327 20.468 -1.141 18387 5852 1 8 . 1 1 11 11 ALA H H 11 8.221 8.221 8.239 -0.018 18387 5853 1 8 . 1 1 12 12 ILE N N 12 117.815 117.815 123.570 -5.755 18387 5854 1 8 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.273 0.055 18387 5855 1 8 . 1 1 12 12 ILE C C 12 175.013 175.013 175.689 -0.676 18387 5856 1 8 . 1 1 12 12 ILE CA C 12 62.166 62.166 59.578 2.588 18387 5857 1 8 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.465 5.825 18387 5858 1 8 . 1 1 12 12 ILE H H 12 7.693 7.693 8.669 -0.976 18387 5859 1 8 . 1 1 13 13 THR N N 13 121.186 121.186 120.880 0.306 18387 5860 1 8 . 1 1 13 13 THR HA H 13 4.840 4.840 4.881 -0.041 18387 5861 1 8 . 1 1 13 13 THR C C 13 172.625 172.625 173.572 -0.947 18387 5862 1 8 . 1 1 13 13 THR CA C 13 62.297 62.297 61.672 0.625 18387 5863 1 8 . 1 1 13 13 THR CB C 13 71.585 71.585 69.722 1.863 18387 5864 1 8 . 1 1 13 13 THR H H 13 8.363 8.363 8.867 -0.504 18387 5865 1 8 . 1 1 14 14 GLY N N 14 110.785 110.785 111.993 -1.208 18387 5866 1 8 . 1 1 14 14 GLY C C 14 170.040 170.040 171.905 -1.865 18387 5867 1 8 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.930 1.460 18387 5868 1 8 . 1 1 14 14 GLY H H 14 7.993 7.993 9.098 -1.105 18387 5869 1 8 . 1 1 15 15 ILE N N 15 119.088 119.088 120.489 -1.401 18387 5870 1 8 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.132 -0.007 18387 5871 1 8 . 1 1 15 15 ILE C C 15 176.359 176.359 175.920 0.439 18387 5872 1 8 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.348 -1.734 18387 5873 1 8 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.840 -0.201 18387 5874 1 8 . 1 1 15 15 ILE H H 15 7.973 7.973 8.528 -0.555 18387 5875 1 8 . 1 1 16 16 ASP N N 16 126.633 126.633 127.757 -1.124 18387 5876 1 8 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.478 0.371 18387 5877 1 8 . 1 1 16 16 ASP C C 16 179.190 179.190 178.280 0.910 18387 5878 1 8 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.923 -0.043 18387 5879 1 8 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.564 -0.289 18387 5880 1 8 . 1 1 16 16 ASP H H 16 9.335 9.335 9.005 0.330 18387 5881 1 8 . 1 1 17 17 LEU N N 17 116.648 116.648 119.188 -2.540 18387 5882 1 8 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.921 0.253 18387 5883 1 8 . 1 1 17 17 LEU C C 17 178.432 178.432 179.016 -0.584 18387 5884 1 8 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.664 0.316 18387 5885 1 8 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.532 1.454 18387 5886 1 8 . 1 1 17 17 LEU H H 17 8.071 8.071 8.742 -0.671 18387 5887 1 8 . 1 1 18 18 LYS N N 18 117.401 117.401 118.065 -0.664 18387 5888 1 8 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.119 0.390 18387 5889 1 8 . 1 1 18 18 LYS C C 18 176.793 176.793 177.508 -0.715 18387 5890 1 8 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.834 -2.400 18387 5891 1 8 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.713 0.350 18387 5892 1 8 . 1 1 18 18 LYS H H 18 8.207 8.207 8.779 -0.572 18387 5893 1 8 . 1 1 19 19 GLY N N 19 108.061 108.061 106.811 1.250 18387 5894 1 8 . 1 1 19 19 GLY C C 19 174.649 174.649 174.008 0.641 18387 5895 1 8 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.894 0.703 18387 5896 1 8 . 1 1 19 19 GLY H H 19 8.099 8.099 8.173 -0.074 18387 5897 1 8 . 1 1 20 20 ASN N N 20 121.012 121.012 119.334 1.678 18387 5898 1 8 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.005 -0.100 18387 5899 1 8 . 1 1 20 20 ASN C C 20 174.827 174.827 174.570 0.257 18387 5900 1 8 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.142 0.325 18387 5901 1 8 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.483 -1.807 18387 5902 1 8 . 1 1 20 20 ASN H H 20 8.945 8.945 8.371 0.574 18387 5903 1 8 . 1 1 21 21 SER N N 21 117.285 117.285 117.367 -0.082 18387 5904 1 8 . 1 1 21 21 SER HA H 21 5.000 5.000 4.908 0.092 18387 5905 1 8 . 1 1 21 21 SER C C 21 174.911 174.911 174.259 0.652 18387 5906 1 8 . 1 1 21 21 SER CA C 21 58.730 58.730 58.578 0.152 18387 5907 1 8 . 1 1 21 21 SER CB C 21 63.162 63.162 62.714 0.448 18387 5908 1 8 . 1 1 21 21 SER H H 21 8.740 8.740 8.621 0.119 18387 5909 1 8 . 1 1 22 22 VAL N N 22 128.665 128.665 128.134 0.531 18387 5910 1 8 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.306 0.074 18387 5911 1 8 . 1 1 22 22 VAL C C 22 176.276 176.276 175.399 0.877 18387 5912 1 8 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.816 1.137 18387 5913 1 8 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.296 1.286 18387 5914 1 8 . 1 1 22 22 VAL H H 22 9.125 9.125 8.942 0.183 18387 5915 1 8 . 1 1 23 23 SER N N 23 127.457 127.457 122.002 5.455 18387 5916 1 8 . 1 1 23 23 SER HA H 23 5.878 5.878 5.535 0.343 18387 5917 1 8 . 1 1 23 23 SER C C 23 174.436 174.436 175.794 -1.358 18387 5918 1 8 . 1 1 23 23 SER CA C 23 57.101 57.101 56.238 0.863 18387 5919 1 8 . 1 1 23 23 SER CB C 23 66.078 66.078 64.656 1.422 18387 5920 1 8 . 1 1 23 23 SER H H 23 8.971 8.971 8.824 0.147 18387 5921 1 8 . 1 1 24 24 LEU N N 24 126.734 126.734 122.773 3.961 18387 5922 1 8 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.929 -0.462 18387 5923 1 8 . 1 1 24 24 LEU C C 24 179.852 179.852 177.539 2.313 18387 5924 1 8 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.076 1.127 18387 5925 1 8 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.018 -0.040 18387 5926 1 8 . 1 1 24 24 LEU H H 24 8.450 8.450 8.276 0.174 18387 5927 1 8 . 1 1 25 25 ASN N N 25 115.642 115.642 116.479 -0.837 18387 5928 1 8 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.423 -0.181 18387 5929 1 8 . 1 1 25 25 ASN C C 25 176.246 176.246 176.396 -0.150 18387 5930 1 8 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.346 0.024 18387 5931 1 8 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.538 1.233 18387 5932 1 8 . 1 1 25 25 ASN H H 25 8.505 8.505 8.798 -0.293 18387 5933 1 8 . 1 1 26 26 ASP N N 26 119.722 119.722 120.490 -0.768 18387 5934 1 8 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.255 -0.050 18387 5935 1 8 . 1 1 26 26 ASP C C 26 176.708 176.708 176.294 0.414 18387 5936 1 8 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.425 0.101 18387 5937 1 8 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.215 -0.935 18387 5938 1 8 . 1 1 26 26 ASP H H 26 7.731 7.731 7.909 -0.178 18387 5939 1 8 . 1 1 27 27 PHE N N 27 116.827 116.827 115.748 1.079 18387 5940 1 8 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.650 -0.170 18387 5941 1 8 . 1 1 27 27 PHE C C 27 174.227 174.227 174.987 -0.760 18387 5942 1 8 . 1 1 27 27 PHE CA C 27 57.071 57.071 56.959 0.112 18387 5943 1 8 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.723 -0.004 18387 5944 1 8 . 1 1 27 27 PHE H H 27 7.390 7.390 7.437 -0.047 18387 5945 1 8 . 1 1 28 28 LYS N N 28 120.357 120.357 123.145 -2.788 18387 5946 1 8 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.279 0.108 18387 5947 1 8 . 1 1 28 28 LYS C C 28 177.845 177.845 176.234 1.611 18387 5948 1 8 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.491 1.511 18387 5949 1 8 . 1 1 28 28 LYS CB C 28 32.544 32.544 30.548 1.996 18387 5950 1 8 . 1 1 28 28 LYS H H 28 6.883 6.883 7.475 -0.592 18387 5951 1 8 . 1 1 29 29 GLY N N 29 112.653 112.653 109.804 2.849 18387 5952 1 8 . 1 1 29 29 GLY C C 29 173.799 173.799 173.661 0.138 18387 5953 1 8 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.184 -0.196 18387 5954 1 8 . 1 1 29 29 GLY H H 29 8.930 8.930 8.334 0.596 18387 5955 1 8 . 1 1 30 30 LYS N N 30 120.516 120.516 118.293 2.223 18387 5956 1 8 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.499 0.136 18387 5957 1 8 . 1 1 30 30 LYS C C 30 176.505 176.505 174.536 1.969 18387 5958 1 8 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.999 0.181 18387 5959 1 8 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.422 -1.565 18387 5960 1 8 . 1 1 30 30 LYS H H 30 8.098 8.098 7.359 0.739 18387 5961 1 8 . 1 1 31 31 TYR N N 31 117.383 117.383 119.525 -2.142 18387 5962 1 8 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.741 -0.087 18387 5963 1 8 . 1 1 31 31 TYR C C 31 175.551 175.551 176.066 -0.515 18387 5964 1 8 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.894 1.271 18387 5965 1 8 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.494 2.699 18387 5966 1 8 . 1 1 31 31 TYR H H 31 8.263 8.263 8.889 -0.626 18387 5967 1 8 . 1 1 32 32 VAL N N 32 120.900 120.900 125.418 -4.518 18387 5968 1 8 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.525 -0.086 18387 5969 1 8 . 1 1 32 32 VAL C C 32 175.975 175.975 174.786 1.189 18387 5970 1 8 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.311 -1.605 18387 5971 1 8 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.803 2.704 18387 5972 1 8 . 1 1 32 32 VAL H H 32 9.244 9.244 9.311 -0.067 18387 5973 1 8 . 1 1 33 33 LEU N N 33 130.058 130.058 131.521 -1.463 18387 5974 1 8 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.085 0.088 18387 5975 1 8 . 1 1 33 33 LEU C C 33 174.693 174.693 175.263 -0.570 18387 5976 1 8 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.389 -0.041 18387 5977 1 8 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.392 0.928 18387 5978 1 8 . 1 1 33 33 LEU H H 33 8.161 8.161 8.767 -0.606 18387 5979 1 8 . 1 1 34 34 VAL N N 34 129.232 129.232 129.760 -0.528 18387 5980 1 8 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.798 0.184 18387 5981 1 8 . 1 1 34 34 VAL C C 34 174.285 174.285 174.850 -0.565 18387 5982 1 8 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.900 -0.394 18387 5983 1 8 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.371 0.007 18387 5984 1 8 . 1 1 34 34 VAL H H 34 9.296 9.296 9.277 0.019 18387 5985 1 8 . 1 1 35 35 ASP N N 35 123.675 123.675 128.406 -4.731 18387 5986 1 8 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.031 0.318 18387 5987 1 8 . 1 1 35 35 ASP C C 35 174.258 174.258 175.503 -1.245 18387 5988 1 8 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.473 -1.419 18387 5989 1 8 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.648 -1.186 18387 5990 1 8 . 1 1 35 35 ASP H H 35 8.015 8.015 8.389 -0.374 18387 5991 1 8 . 1 1 36 36 PHE N N 36 126.959 126.959 127.065 -0.106 18387 5992 1 8 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.204 0.731 18387 5993 1 8 . 1 1 36 36 PHE C C 36 175.432 175.432 175.746 -0.314 18387 5994 1 8 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.417 -0.322 18387 5995 1 8 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.510 0.520 18387 5996 1 8 . 1 1 36 36 PHE H H 36 9.171 9.171 8.933 0.238 18387 5997 1 8 . 1 1 37 37 TRP N N 37 120.839 120.839 123.385 -2.546 18387 5998 1 8 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.266 0.491 18387 5999 1 8 . 1 1 37 37 TRP C C 37 172.412 172.412 173.168 -0.756 18387 6000 1 8 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.843 0.066 18387 6001 1 8 . 1 1 37 37 TRP CB C 37 32.680 32.680 33.056 -0.376 18387 6002 1 8 . 1 1 37 37 TRP H H 37 9.280 9.280 8.966 0.314 18387 6003 1 8 . 1 1 38 38 PHE N N 38 109.215 109.215 112.201 -2.986 18387 6004 1 8 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.435 -0.502 18387 6005 1 8 . 1 1 38 38 PHE C C 38 176.141 176.141 174.257 1.884 18387 6006 1 8 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.395 0.617 18387 6007 1 8 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.466 -0.847 18387 6008 1 8 . 1 1 38 38 PHE H H 38 7.062 7.062 7.994 -0.932 18387 6009 1 8 . 1 1 39 39 ALA N N 39 125.193 125.193 124.332 0.861 18387 6010 1 8 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.193 -0.128 18387 6011 1 8 . 1 1 39 39 ALA C C 39 179.349 179.349 178.293 1.056 18387 6012 1 8 . 1 1 39 39 ALA CA C 39 56.064 56.064 55.419 0.645 18387 6013 1 8 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.791 1.106 18387 6014 1 8 . 1 1 39 39 ALA H H 39 10.355 10.355 9.548 0.807 18387 6015 1 8 . 1 1 40 40 GLY N N 40 103.437 103.437 104.927 -1.490 18387 6016 1 8 . 1 1 40 40 GLY C C 40 172.732 172.732 174.414 -1.682 18387 6017 1 8 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.974 -1.038 18387 6018 1 8 . 1 1 40 40 GLY H H 40 8.583 8.583 8.648 -0.065 18387 6019 1 8 . 1 1 41 41 CYS N N 41 124.859 124.859 119.293 5.566 18387 6020 1 8 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.343 0.061 18387 6021 1 8 . 1 1 41 41 CYS C C 41 176.620 176.620 174.761 1.859 18387 6022 1 8 . 1 1 41 41 CYS CA C 41 58.375 58.375 56.252 2.123 18387 6023 1 8 . 1 1 41 41 CYS CB C 41 28.376 28.376 26.189 2.187 18387 6024 1 8 . 1 1 41 41 CYS H H 41 6.946 6.946 6.577 0.369 18387 6025 1 8 . 1 1 42 42 SER HA H 42 4.040 4.040 4.173 -0.133 18387 6026 1 8 . 1 1 42 42 SER CA C 42 61.552 61.552 60.126 1.426 18387 6027 1 8 . 1 1 42 42 SER CB C 42 62.675 62.675 62.530 0.145 18387 6028 1 8 . 1 1 43 43 TRP N N 43 129.748 129.748 121.689 8.059 18387 6029 1 8 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.523 0.026 18387 6030 1 8 . 1 1 43 43 TRP C C 43 180.400 180.400 178.249 2.151 18387 6031 1 8 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.285 0.964 18387 6032 1 8 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.328 0.264 18387 6033 1 8 . 1 1 44 44 CYS N N 44 124.462 124.462 115.475 8.987 18387 6034 1 8 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.491 -0.240 18387 6035 1 8 . 1 1 44 44 CYS C C 44 178.643 178.643 177.446 1.197 18387 6036 1 8 . 1 1 44 44 CYS CA C 44 64.849 64.849 60.407 4.442 18387 6037 1 8 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.629 1.793 18387 6038 1 8 . 1 1 44 44 CYS H H 44 9.591 9.591 7.831 1.760 18387 6039 1 8 . 1 1 45 45 ARG N N 45 117.248 117.248 119.438 -2.190 18387 6040 1 8 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.388 -0.212 18387 6041 1 8 . 1 1 45 45 ARG C C 45 180.302 180.302 176.934 3.368 18387 6042 1 8 . 1 1 45 45 ARG CA C 45 56.943 56.943 56.389 0.554 18387 6043 1 8 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.236 -1.605 18387 6044 1 8 . 1 1 45 45 ARG H H 45 7.955 7.955 7.667 0.288 18387 6045 1 8 . 1 1 46 46 LYS N N 46 120.318 120.318 117.898 2.420 18387 6046 1 8 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.320 -0.048 18387 6047 1 8 . 1 1 46 46 LYS C C 46 177.755 177.755 177.531 0.224 18387 6048 1 8 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.423 1.346 18387 6049 1 8 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.675 0.482 18387 6050 1 8 . 1 1 46 46 LYS H H 46 8.129 8.129 7.592 0.537 18387 6051 1 8 . 1 1 47 47 GLU N N 47 114.278 114.278 117.866 -3.588 18387 6052 1 8 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.819 0.072 18387 6053 1 8 . 1 1 47 47 GLU C C 47 178.701 178.701 178.043 0.658 18387 6054 1 8 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.766 -1.212 18387 6055 1 8 . 1 1 47 47 GLU CB C 47 29.766 29.766 30.023 -0.257 18387 6056 1 8 . 1 1 47 47 GLU H H 47 7.386 7.386 7.729 -0.343 18387 6057 1 8 . 1 1 48 48 THR N N 48 115.665 115.665 117.207 -1.542 18387 6058 1 8 . 1 1 48 48 THR HA H 48 4.048 4.048 4.250 -0.202 18387 6059 1 8 . 1 1 48 48 THR C C 48 172.392 172.392 174.467 -2.075 18387 6060 1 8 . 1 1 48 48 THR CA C 48 69.426 69.426 68.948 0.478 18387 6061 1 8 . 1 1 48 48 THR CB C 48 66.906 66.906 66.458 0.448 18387 6062 1 8 . 1 1 48 48 THR H H 48 7.810 7.810 7.642 0.168 18387 6063 1 8 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.219 0.070 18387 6064 1 8 . 1 1 49 49 PRO C C 49 179.828 179.828 178.864 0.964 18387 6065 1 8 . 1 1 49 49 PRO CA C 49 66.599 66.599 65.976 0.623 18387 6066 1 8 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.870 0.164 18387 6067 1 8 . 1 1 50 50 TYR N N 50 116.950 116.950 116.973 -0.023 18387 6068 1 8 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.362 -0.224 18387 6069 1 8 . 1 1 50 50 TYR C C 50 179.488 179.488 178.521 0.967 18387 6070 1 8 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.684 -0.549 18387 6071 1 8 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.750 0.551 18387 6072 1 8 . 1 1 50 50 TYR H H 50 7.071 7.071 7.169 -0.098 18387 6073 1 8 . 1 1 51 51 LEU N N 51 123.989 123.989 120.364 3.625 18387 6074 1 8 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.894 -0.224 18387 6075 1 8 . 1 1 51 51 LEU C C 51 178.072 178.072 179.130 -1.058 18387 6076 1 8 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.094 0.581 18387 6077 1 8 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.581 1.036 18387 6078 1 8 . 1 1 51 51 LEU H H 51 8.243 8.243 8.639 -0.396 18387 6079 1 8 . 1 1 52 52 LEU N N 52 119.857 119.857 120.110 -0.253 18387 6080 1 8 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.311 0.016 18387 6081 1 8 . 1 1 52 52 LEU C C 52 178.704 178.704 178.162 0.542 18387 6082 1 8 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.602 -0.027 18387 6083 1 8 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.807 0.931 18387 6084 1 8 . 1 1 52 52 LEU H H 52 9.085 9.085 8.954 0.131 18387 6085 1 8 . 1 1 53 53 LYS N N 53 118.658 118.658 119.159 -0.501 18387 6086 1 8 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.967 0.142 18387 6087 1 8 . 1 1 53 53 LYS C C 53 179.786 179.786 179.016 0.770 18387 6088 1 8 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.982 -0.261 18387 6089 1 8 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.217 0.943 18387 6090 1 8 . 1 1 53 53 LYS H H 53 7.807 7.807 8.260 -0.453 18387 6091 1 8 . 1 1 54 54 THR N N 54 116.869 116.869 116.240 0.629 18387 6092 1 8 . 1 1 54 54 THR HA H 54 3.965 3.965 4.540 -0.575 18387 6093 1 8 . 1 1 54 54 THR C C 54 175.328 175.328 176.942 -1.614 18387 6094 1 8 . 1 1 54 54 THR CA C 54 67.683 67.683 66.870 0.813 18387 6095 1 8 . 1 1 54 54 THR CB C 54 68.452 68.452 68.861 -0.409 18387 6096 1 8 . 1 1 54 54 THR H H 54 7.771 7.771 8.276 -0.505 18387 6097 1 8 . 1 1 55 55 TYR N N 55 122.202 122.202 123.212 -1.010 18387 6098 1 8 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.260 0.012 18387 6099 1 8 . 1 1 55 55 TYR C C 55 176.809 176.809 177.487 -0.678 18387 6100 1 8 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.898 0.839 18387 6101 1 8 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.383 0.897 18387 6102 1 8 . 1 1 55 55 TYR H H 55 9.145 9.145 8.770 0.375 18387 6103 1 8 . 1 1 56 56 ASN N N 56 113.858 113.858 116.450 -2.592 18387 6104 1 8 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.250 0.013 18387 6105 1 8 . 1 1 56 56 ASN C C 56 177.427 177.427 177.055 0.372 18387 6106 1 8 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.644 -0.714 18387 6107 1 8 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.625 -0.671 18387 6108 1 8 . 1 1 56 56 ASN H H 56 8.850 8.850 8.446 0.404 18387 6109 1 8 . 1 1 57 57 ALA N N 57 118.829 118.829 120.459 -1.630 18387 6110 1 8 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.060 0.004 18387 6111 1 8 . 1 1 57 57 ALA C C 57 180.445 180.445 178.443 2.002 18387 6112 1 8 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.305 0.046 18387 6113 1 8 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.042 0.152 18387 6114 1 8 . 1 1 57 57 ALA H H 57 7.436 7.436 7.704 -0.268 18387 6115 1 8 . 1 1 58 58 PHE N N 58 112.082 112.082 115.501 -3.419 18387 6116 1 8 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.692 0.229 18387 6117 1 8 . 1 1 58 58 PHE C C 58 176.999 176.999 174.873 2.126 18387 6118 1 8 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.286 0.781 18387 6119 1 8 . 1 1 58 58 PHE CB C 58 40.490 40.490 40.545 -0.055 18387 6120 1 8 . 1 1 58 58 PHE H H 58 7.480 7.480 7.754 -0.274 18387 6121 1 8 . 1 1 59 59 LYS N N 59 120.666 120.666 120.284 0.382 18387 6122 1 8 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.490 0.313 18387 6123 1 8 . 1 1 59 59 LYS C C 59 177.157 177.157 177.944 -0.787 18387 6124 1 8 . 1 1 59 59 LYS CA C 59 59.081 59.081 57.539 1.542 18387 6125 1 8 . 1 1 59 59 LYS CB C 59 30.568 30.568 32.558 -1.990 18387 6126 1 8 . 1 1 59 59 LYS H H 59 8.411 8.411 7.837 0.574 18387 6127 1 8 . 1 1 60 60 ASP N N 60 118.908 118.908 118.580 0.328 18387 6128 1 8 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.223 0.902 18387 6129 1 8 . 1 1 60 60 ASP C C 60 176.889 176.889 177.424 -0.535 18387 6130 1 8 . 1 1 60 60 ASP CA C 60 54.649 54.649 57.772 -3.123 18387 6131 1 8 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.282 1.430 18387 6132 1 8 . 1 1 60 60 ASP H H 60 8.574 8.574 9.017 -0.443 18387 6133 1 8 . 1 1 61 61 LYS N N 61 121.021 121.021 121.400 -0.379 18387 6134 1 8 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.163 0.551 18387 6135 1 8 . 1 1 61 61 LYS C C 61 175.968 175.968 178.329 -2.361 18387 6136 1 8 . 1 1 61 61 LYS CA C 61 55.137 55.137 58.728 -3.591 18387 6137 1 8 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.825 0.252 18387 6138 1 8 . 1 1 61 61 LYS H H 61 8.278 8.278 8.444 -0.166 18387 6139 1 8 . 1 1 62 62 GLY C C 62 173.837 173.837 172.748 1.089 18387 6140 1 8 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.074 1.976 18387 6141 1 8 . 1 1 63 63 PHE N N 63 120.476 120.476 121.857 -1.381 18387 6142 1 8 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.777 0.256 18387 6143 1 8 . 1 1 63 63 PHE C C 63 173.613 173.613 173.203 0.410 18387 6144 1 8 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.622 -0.772 18387 6145 1 8 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.944 -0.269 18387 6146 1 8 . 1 1 63 63 PHE H H 63 7.413 7.413 7.751 -0.338 18387 6147 1 8 . 1 1 64 64 THR N N 64 119.903 119.903 118.621 1.282 18387 6148 1 8 . 1 1 64 64 THR HA H 64 4.097 4.097 4.691 -0.594 18387 6149 1 8 . 1 1 64 64 THR C C 64 170.397 170.397 172.156 -1.759 18387 6150 1 8 . 1 1 64 64 THR CA C 64 60.261 60.261 59.942 0.319 18387 6151 1 8 . 1 1 64 64 THR CB C 64 69.507 69.507 71.388 -1.881 18387 6152 1 8 . 1 1 64 64 THR H H 64 7.665 7.665 8.576 -0.911 18387 6153 1 8 . 1 1 65 65 ILE N N 65 117.277 117.277 125.185 -7.908 18387 6154 1 8 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.269 0.207 18387 6155 1 8 . 1 1 65 65 ILE C C 65 173.056 173.056 173.971 -0.915 18387 6156 1 8 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.599 -0.891 18387 6157 1 8 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.863 0.982 18387 6158 1 8 . 1 1 65 65 ILE H H 65 7.321 7.321 8.560 -1.239 18387 6159 1 8 . 1 1 66 66 TYR N N 66 131.968 131.968 129.316 2.652 18387 6160 1 8 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.149 0.098 18387 6161 1 8 . 1 1 66 66 TYR C C 66 174.074 174.074 174.763 -0.689 18387 6162 1 8 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.715 -0.750 18387 6163 1 8 . 1 1 66 66 TYR CB C 66 41.117 41.117 40.675 0.442 18387 6164 1 8 . 1 1 66 66 TYR H H 66 9.038 9.038 9.175 -0.137 18387 6165 1 8 . 1 1 67 67 GLY N N 67 114.364 114.364 115.383 -1.019 18387 6166 1 8 . 1 1 67 67 GLY C C 67 172.461 172.461 172.575 -0.114 18387 6167 1 8 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.356 0.644 18387 6168 1 8 . 1 1 67 67 GLY H H 67 9.188 9.188 9.142 0.046 18387 6169 1 8 . 1 1 68 68 VAL N N 68 126.938 126.938 123.171 3.767 18387 6170 1 8 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.931 -0.795 18387 6171 1 8 . 1 1 68 68 VAL C C 68 173.822 173.822 174.853 -1.031 18387 6172 1 8 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.930 1.568 18387 6173 1 8 . 1 1 68 68 VAL CB C 68 33.558 33.558 31.666 1.892 18387 6174 1 8 . 1 1 68 68 VAL H H 68 9.309 9.309 8.616 0.693 18387 6175 1 8 . 1 1 69 69 SER N N 69 118.813 118.813 123.705 -4.892 18387 6176 1 8 . 1 1 69 69 SER HA H 69 5.527 5.527 4.893 0.634 18387 6177 1 8 . 1 1 69 69 SER C C 69 175.753 175.753 173.713 2.040 18387 6178 1 8 . 1 1 69 69 SER CA C 69 54.407 54.407 57.247 -2.840 18387 6179 1 8 . 1 1 69 69 SER CB C 69 63.630 63.630 65.159 -1.529 18387 6180 1 8 . 1 1 69 69 SER H H 69 8.124 8.124 9.055 -0.931 18387 6181 1 8 . 1 1 70 70 THR N N 70 113.861 113.861 118.142 -4.281 18387 6182 1 8 . 1 1 70 70 THR HA H 70 4.381 4.381 4.461 -0.080 18387 6183 1 8 . 1 1 70 70 THR C C 70 175.001 175.001 172.971 2.030 18387 6184 1 8 . 1 1 70 70 THR CA C 70 60.259 60.259 59.711 0.548 18387 6185 1 8 . 1 1 70 70 THR CB C 70 67.291 67.291 68.894 -1.603 18387 6186 1 8 . 1 1 70 70 THR H H 70 7.656 7.656 7.801 -0.145 18387 6187 1 8 . 1 1 71 71 ASP N N 71 125.133 125.133 122.434 2.699 18387 6188 1 8 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.412 -0.342 18387 6189 1 8 . 1 1 71 71 ASP C C 71 175.685 175.685 176.694 -1.009 18387 6190 1 8 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.885 1.727 18387 6191 1 8 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.291 1.078 18387 6192 1 8 . 1 1 71 71 ASP H H 71 8.931 8.931 7.813 1.118 18387 6193 1 8 . 1 1 72 72 ARG N N 72 118.814 118.814 117.770 1.044 18387 6194 1 8 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.125 0.070 18387 6195 1 8 . 1 1 72 72 ARG C C 72 177.300 177.300 177.028 0.272 18387 6196 1 8 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.041 -0.232 18387 6197 1 8 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.947 0.164 18387 6198 1 8 . 1 1 72 72 ARG H H 72 8.057 8.057 8.311 -0.254 18387 6199 1 8 . 1 1 73 73 ARG N N 73 118.174 118.174 118.075 0.099 18387 6200 1 8 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.541 0.213 18387 6201 1 8 . 1 1 73 73 ARG C C 73 176.503 176.503 176.269 0.234 18387 6202 1 8 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.129 0.407 18387 6203 1 8 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.620 -1.592 18387 6204 1 8 . 1 1 73 73 ARG H H 73 8.639 8.639 8.176 0.463 18387 6205 1 8 . 1 1 74 74 GLU N N 74 127.609 127.609 124.336 3.273 18387 6206 1 8 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.195 -0.116 18387 6207 1 8 . 1 1 74 74 GLU C C 74 178.107 178.107 177.870 0.237 18387 6208 1 8 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.587 -0.802 18387 6209 1 8 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.857 0.241 18387 6210 1 8 . 1 1 74 74 GLU H H 74 9.129 9.129 9.074 0.055 18387 6211 1 8 . 1 1 75 75 GLU N N 75 117.874 117.874 118.843 -0.969 18387 6212 1 8 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.117 -0.017 18387 6213 1 8 . 1 1 75 75 GLU C C 75 178.993 178.993 178.167 0.826 18387 6214 1 8 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.444 -0.318 18387 6215 1 8 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.746 0.545 18387 6216 1 8 . 1 1 75 75 GLU H H 75 9.745 9.745 8.923 0.822 18387 6217 1 8 . 1 1 76 76 ASP N N 76 119.182 119.182 119.128 0.054 18387 6218 1 8 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.462 -0.096 18387 6219 1 8 . 1 1 76 76 ASP C C 76 178.107 178.107 178.202 -0.095 18387 6220 1 8 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.330 0.644 18387 6221 1 8 . 1 1 76 76 ASP CB C 76 40.520 40.520 39.802 0.718 18387 6222 1 8 . 1 1 76 76 ASP H H 76 7.004 7.004 8.403 -1.399 18387 6223 1 8 . 1 1 77 77 TRP N N 77 123.008 123.008 123.468 -0.460 18387 6224 1 8 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.161 -0.012 18387 6225 1 8 . 1 1 77 77 TRP C C 77 176.236 176.236 178.182 -1.946 18387 6226 1 8 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.103 -0.620 18387 6227 1 8 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.471 -0.936 18387 6228 1 8 . 1 1 77 77 TRP H H 77 7.112 7.112 8.319 -1.207 18387 6229 1 8 . 1 1 78 78 LYS N N 78 115.727 115.727 118.142 -2.415 18387 6230 1 8 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.475 -0.230 18387 6231 1 8 . 1 1 78 78 LYS C C 78 179.426 179.426 178.766 0.660 18387 6232 1 8 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.274 1.158 18387 6233 1 8 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.848 0.897 18387 6234 1 8 . 1 1 78 78 LYS H H 78 8.431 8.431 8.455 -0.024 18387 6235 1 8 . 1 1 79 79 LYS N N 79 118.321 118.321 119.652 -1.331 18387 6236 1 8 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.916 0.104 18387 6237 1 8 . 1 1 79 79 LYS C C 79 178.239 178.239 178.622 -0.383 18387 6238 1 8 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.446 -0.379 18387 6239 1 8 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.495 -0.032 18387 6240 1 8 . 1 1 79 79 LYS H H 79 7.690 7.690 7.905 -0.215 18387 6241 1 8 . 1 1 80 80 ALA N N 80 120.679 120.679 122.526 -1.847 18387 6242 1 8 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.285 -0.130 18387 6243 1 8 . 1 1 80 80 ALA C C 80 178.811 178.811 179.960 -1.149 18387 6244 1 8 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.895 0.193 18387 6245 1 8 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.558 0.200 18387 6246 1 8 . 1 1 80 80 ALA H H 80 7.560 7.560 8.389 -0.829 18387 6247 1 8 . 1 1 81 81 ILE N N 81 118.019 118.019 119.025 -1.006 18387 6248 1 8 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.581 -0.179 18387 6249 1 8 . 1 1 81 81 ILE C C 81 178.113 178.113 178.371 -0.258 18387 6250 1 8 . 1 1 81 81 ILE CA C 81 64.520 64.520 63.262 1.258 18387 6251 1 8 . 1 1 81 81 ILE CB C 81 38.204 38.204 36.335 1.869 18387 6252 1 8 . 1 1 81 81 ILE H H 81 7.514 7.514 8.121 -0.607 18387 6253 1 8 . 1 1 82 82 GLU N N 82 117.252 117.252 120.078 -2.826 18387 6254 1 8 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.921 0.173 18387 6255 1 8 . 1 1 82 82 GLU C C 82 179.558 179.558 178.522 1.036 18387 6256 1 8 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.559 0.021 18387 6257 1 8 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.146 0.237 18387 6258 1 8 . 1 1 82 82 GLU H H 82 7.401 7.401 7.647 -0.246 18387 6259 1 8 . 1 1 83 83 GLU N N 83 119.340 119.340 118.738 0.602 18387 6260 1 8 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.067 -0.169 18387 6261 1 8 . 1 1 83 83 GLU C C 83 178.740 178.740 178.290 0.450 18387 6262 1 8 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.422 0.577 18387 6263 1 8 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.798 0.122 18387 6264 1 8 . 1 1 83 83 GLU H H 83 8.191 8.191 7.650 0.541 18387 6265 1 8 . 1 1 84 84 ASP N N 84 118.449 118.449 117.021 1.428 18387 6266 1 8 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.356 -0.082 18387 6267 1 8 . 1 1 84 84 ASP C C 84 175.597 175.597 176.165 -0.568 18387 6268 1 8 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.911 0.136 18387 6269 1 8 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.994 -1.098 18387 6270 1 8 . 1 1 84 84 ASP H H 84 8.252 8.252 8.191 0.061 18387 6271 1 8 . 1 1 85 85 LYS N N 85 116.410 116.410 115.097 1.313 18387 6272 1 8 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.453 -0.280 18387 6273 1 8 . 1 1 85 85 LYS C C 85 176.856 176.856 175.180 1.676 18387 6274 1 8 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.771 -0.798 18387 6275 1 8 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.313 -0.445 18387 6276 1 8 . 1 1 85 85 LYS H H 85 7.890 7.890 7.762 0.128 18387 6277 1 8 . 1 1 86 86 SER N N 86 112.295 112.295 114.214 -1.919 18387 6278 1 8 . 1 1 86 86 SER HA H 86 3.139 3.139 3.752 -0.613 18387 6279 1 8 . 1 1 86 86 SER C C 86 175.805 175.805 172.857 2.948 18387 6280 1 8 . 1 1 86 86 SER CA C 86 53.637 53.637 56.741 -3.104 18387 6281 1 8 . 1 1 86 86 SER CB C 86 60.736 60.736 61.177 -0.441 18387 6282 1 8 . 1 1 86 86 SER H H 86 7.327 7.327 7.187 0.140 18387 6283 1 8 . 1 1 87 87 TYR N N 87 120.962 120.962 125.605 -4.643 18387 6284 1 8 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.124 0.181 18387 6285 1 8 . 1 1 87 87 TYR C C 87 177.064 177.064 174.870 2.194 18387 6286 1 8 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.371 -1.148 18387 6287 1 8 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.033 -0.680 18387 6288 1 8 . 1 1 87 87 TYR H H 87 6.933 6.933 7.523 -0.590 18387 6289 1 8 . 1 1 88 88 TRP N N 88 118.597 118.597 121.451 -2.854 18387 6290 1 8 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.731 0.120 18387 6291 1 8 . 1 1 88 88 TRP C C 88 175.456 175.456 174.593 0.863 18387 6292 1 8 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.755 1.481 18387 6293 1 8 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.197 -3.470 18387 6294 1 8 . 1 1 88 88 TRP H H 88 6.552 6.552 7.223 -0.671 18387 6295 1 8 . 1 1 89 89 ASN N N 89 118.067 118.067 120.820 -2.753 18387 6296 1 8 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.795 0.254 18387 6297 1 8 . 1 1 89 89 ASN C C 89 173.773 173.773 174.392 -0.619 18387 6298 1 8 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.412 2.044 18387 6299 1 8 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.794 1.403 18387 6300 1 8 . 1 1 89 89 ASN H H 89 7.864 7.864 8.530 -0.666 18387 6301 1 8 . 1 1 90 90 GLN N N 90 125.392 125.392 122.570 2.822 18387 6302 1 8 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.294 0.203 18387 6303 1 8 . 1 1 90 90 GLN C C 90 176.491 176.491 175.805 0.686 18387 6304 1 8 . 1 1 90 90 GLN CA C 90 55.460 55.460 55.715 -0.255 18387 6305 1 8 . 1 1 90 90 GLN CB C 90 31.227 31.227 30.910 0.317 18387 6306 1 8 . 1 1 90 90 GLN H H 90 7.904 7.904 8.089 -0.185 18387 6307 1 8 . 1 1 91 91 VAL N N 91 114.434 114.434 117.833 -3.399 18387 6308 1 8 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.895 0.585 18387 6309 1 8 . 1 1 91 91 VAL C C 91 174.248 174.248 173.330 0.918 18387 6310 1 8 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.448 -0.442 18387 6311 1 8 . 1 1 91 91 VAL CB C 91 36.638 36.638 34.644 1.994 18387 6312 1 8 . 1 1 91 91 VAL H H 91 9.585 9.585 9.191 0.394 18387 6313 1 8 . 1 1 92 92 LEU N N 92 126.910 126.910 126.554 0.356 18387 6314 1 8 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.340 -0.271 18387 6315 1 8 . 1 1 92 92 LEU C C 92 177.696 177.696 176.118 1.578 18387 6316 1 8 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.614 0.230 18387 6317 1 8 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.263 0.684 18387 6318 1 8 . 1 1 92 92 LEU H H 92 8.941 8.941 8.637 0.304 18387 6319 1 8 . 1 1 93 93 LEU N N 93 125.673 125.673 129.016 -3.343 18387 6320 1 8 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.232 0.168 18387 6321 1 8 . 1 1 93 93 LEU C C 93 177.291 177.291 176.409 0.882 18387 6322 1 8 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.391 -0.440 18387 6323 1 8 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.331 1.848 18387 6324 1 8 . 1 1 93 93 LEU H H 93 8.038 8.038 8.939 -0.901 18387 6325 1 8 . 1 1 94 94 GLN N N 94 122.206 122.206 123.647 -1.441 18387 6326 1 8 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.078 0.159 18387 6327 1 8 . 1 1 94 94 GLN C C 94 178.246 178.246 177.067 1.179 18387 6328 1 8 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.336 -0.561 18387 6329 1 8 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.744 -0.489 18387 6330 1 8 . 1 1 94 94 GLN H H 94 9.298 9.298 8.526 0.772 18387 6331 1 8 . 1 1 95 95 LYS N N 95 122.668 122.668 120.850 1.818 18387 6332 1 8 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.972 -0.006 18387 6333 1 8 . 1 1 95 95 LYS C C 95 178.787 178.787 178.316 0.471 18387 6334 1 8 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.510 0.562 18387 6335 1 8 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.028 0.438 18387 6336 1 8 . 1 1 95 95 LYS H H 95 8.645 8.645 8.673 -0.028 18387 6337 1 8 . 1 1 96 96 ASP N N 96 116.775 116.775 118.897 -2.122 18387 6338 1 8 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.528 0.052 18387 6339 1 8 . 1 1 96 96 ASP C C 96 176.220 176.220 177.957 -1.737 18387 6340 1 8 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.503 -0.157 18387 6341 1 8 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.448 0.109 18387 6342 1 8 . 1 1 96 96 ASP H H 96 8.606 8.606 8.347 0.259 18387 6343 1 8 . 1 1 97 97 ASP N N 97 118.213 118.213 121.990 -3.777 18387 6344 1 8 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.317 0.610 18387 6345 1 8 . 1 1 97 97 ASP C C 97 176.954 176.954 177.955 -1.001 18387 6346 1 8 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.000 -1.641 18387 6347 1 8 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.659 1.665 18387 6348 1 8 . 1 1 97 97 ASP H H 97 7.988 7.988 8.398 -0.409 18387 6349 1 8 . 1 1 98 98 VAL N N 98 118.907 118.907 119.882 -0.975 18387 6350 1 8 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.532 -0.116 18387 6351 1 8 . 1 1 98 98 VAL C C 98 176.470 176.470 177.644 -1.174 18387 6352 1 8 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.311 1.467 18387 6353 1 8 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.436 0.954 18387 6354 1 8 . 1 1 98 98 VAL H H 98 7.098 7.098 8.358 -1.260 18387 6355 1 8 . 1 1 99 99 LYS N N 99 117.909 117.909 119.485 -1.576 18387 6356 1 8 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.942 0.001 18387 6357 1 8 . 1 1 99 99 LYS C C 99 178.762 178.762 178.739 0.023 18387 6358 1 8 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.236 -0.091 18387 6359 1 8 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.005 0.007 18387 6360 1 8 . 1 1 99 99 LYS H H 99 8.304 8.304 7.805 0.499 18387 6361 1 8 . 1 1 100 100 ASP N N 100 117.843 117.843 118.577 -0.734 18387 6362 1 8 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.393 0.085 18387 6363 1 8 . 1 1 100 100 ASP C C 100 179.694 179.694 178.962 0.732 18387 6364 1 8 . 1 1 100 100 ASP CA C 100 57.526 57.526 56.992 0.534 18387 6365 1 8 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.644 0.184 18387 6366 1 8 . 1 1 100 100 ASP H H 100 8.024 8.024 7.906 0.118 18387 6367 1 8 . 1 1 101 101 VAL N N 101 122.202 122.202 120.334 1.868 18387 6368 1 8 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.947 0.048 18387 6369 1 8 . 1 1 101 101 VAL C C 101 178.533 178.533 178.447 0.086 18387 6370 1 8 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.711 0.291 18387 6371 1 8 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.492 0.545 18387 6372 1 8 . 1 1 101 101 VAL H H 101 8.205 8.205 7.520 0.685 18387 6373 1 8 . 1 1 102 102 LEU N N 102 118.798 118.798 119.173 -0.375 18387 6374 1 8 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.979 -0.199 18387 6375 1 8 . 1 1 102 102 LEU C C 102 180.254 180.254 179.345 0.909 18387 6376 1 8 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.070 0.871 18387 6377 1 8 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.423 -0.984 18387 6378 1 8 . 1 1 102 102 LEU H H 102 8.422 8.422 7.914 0.508 18387 6379 1 8 . 1 1 103 103 GLU N N 103 116.915 116.915 119.839 -2.924 18387 6380 1 8 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.943 0.192 18387 6381 1 8 . 1 1 103 103 GLU C C 103 180.910 180.910 179.652 1.258 18387 6382 1 8 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.744 -0.341 18387 6383 1 8 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.673 0.058 18387 6384 1 8 . 1 1 103 103 GLU H H 103 8.262 8.262 8.833 -0.571 18387 6385 1 8 . 1 1 104 104 SER N N 104 117.866 117.866 115.491 2.375 18387 6386 1 8 . 1 1 104 104 SER HA H 104 4.216 4.216 4.134 0.082 18387 6387 1 8 . 1 1 104 104 SER C C 104 175.455 175.455 175.459 -0.004 18387 6388 1 8 . 1 1 104 104 SER CA C 104 62.019 62.019 61.201 0.818 18387 6389 1 8 . 1 1 104 104 SER CB C 104 62.891 62.891 63.423 -0.533 18387 6390 1 8 . 1 1 104 104 SER H H 104 8.544 8.544 8.268 0.276 18387 6391 1 8 . 1 1 105 105 TYR N N 105 117.278 117.278 116.754 0.524 18387 6392 1 8 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.467 -0.195 18387 6393 1 8 . 1 1 105 105 TYR C C 105 174.750 174.750 174.867 -0.117 18387 6394 1 8 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.492 1.367 18387 6395 1 8 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.763 1.948 18387 6396 1 8 . 1 1 105 105 TYR H H 105 7.691 7.691 7.366 0.325 18387 6397 1 8 . 1 1 106 106 CYS N N 106 116.897 116.897 116.418 0.479 18387 6398 1 8 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.060 -0.165 18387 6399 1 8 . 1 1 106 106 CYS C C 106 174.056 174.056 173.496 0.560 18387 6400 1 8 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.154 -0.544 18387 6401 1 8 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.222 -0.190 18387 6402 1 8 . 1 1 106 106 CYS H H 106 7.862 7.862 8.246 -0.384 18387 6403 1 8 . 1 1 107 107 ILE N N 107 118.885 118.885 120.990 -2.105 18387 6404 1 8 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.776 -0.437 18387 6405 1 8 . 1 1 107 107 ILE C C 107 176.793 176.793 174.926 1.867 18387 6406 1 8 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.290 3.455 18387 6407 1 8 . 1 1 107 107 ILE CB C 107 38.079 38.079 35.468 2.611 18387 6408 1 8 . 1 1 107 107 ILE H H 107 7.707 7.707 8.387 -0.680 18387 6409 1 8 . 1 1 108 108 VAL N N 108 123.983 123.983 126.382 -2.399 18387 6410 1 8 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.111 0.163 18387 6411 1 8 . 1 1 108 108 VAL C C 108 175.476 175.476 175.396 0.080 18387 6412 1 8 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.716 -0.092 18387 6413 1 8 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.214 0.794 18387 6414 1 8 . 1 1 108 108 VAL H H 108 8.656 8.656 8.415 0.241 18387 6415 1 8 . 1 1 109 109 GLY N N 109 110.120 110.120 107.312 2.808 18387 6416 1 8 . 1 1 109 109 GLY C C 109 169.982 169.982 172.564 -2.582 18387 6417 1 8 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.246 -0.643 18387 6418 1 8 . 1 1 109 109 GLY H H 109 7.500 7.500 7.380 0.120 18387 6419 1 8 . 1 1 110 110 PHE N N 110 115.276 115.276 119.552 -4.276 18387 6420 1 8 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.125 -0.351 18387 6421 1 8 . 1 1 110 110 PHE C C 110 174.361 174.361 173.818 0.543 18387 6422 1 8 . 1 1 110 110 PHE CA C 110 55.687 55.687 56.294 -0.607 18387 6423 1 8 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.291 0.660 18387 6424 1 8 . 1 1 110 110 PHE H H 110 8.203 8.203 8.489 -0.286 18387 6425 1 8 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.187 0.172 18387 6426 1 8 . 1 1 111 111 PRO C C 111 175.691 175.691 175.161 0.530 18387 6427 1 8 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.471 0.686 18387 6428 1 8 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.984 1.320 18387 6429 1 8 . 1 1 112 112 HIS N N 112 123.708 123.708 117.189 6.519 18387 6430 1 8 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.933 0.030 18387 6431 1 8 . 1 1 112 112 HIS C C 112 173.649 173.649 173.493 0.156 18387 6432 1 8 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.003 1.071 18387 6433 1 8 . 1 1 112 112 HIS CB C 112 32.197 32.197 33.302 -1.105 18387 6434 1 8 . 1 1 112 112 HIS H H 112 8.952 8.952 8.429 0.523 18387 6435 1 8 . 1 1 113 113 ILE N N 113 128.596 128.596 124.196 4.400 18387 6436 1 8 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.416 0.281 18387 6437 1 8 . 1 1 113 113 ILE C C 113 176.130 176.130 175.109 1.021 18387 6438 1 8 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.180 0.815 18387 6439 1 8 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.844 -1.789 18387 6440 1 8 . 1 1 113 113 ILE H H 113 8.808 8.808 8.658 0.150 18387 6441 1 8 . 1 1 114 114 ILE N N 114 119.668 119.668 122.401 -2.733 18387 6442 1 8 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.998 -0.025 18387 6443 1 8 . 1 1 114 114 ILE C C 114 173.186 173.186 173.687 -0.501 18387 6444 1 8 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.726 0.004 18387 6445 1 8 . 1 1 114 114 ILE CB C 114 42.540 42.540 41.816 0.724 18387 6446 1 8 . 1 1 114 114 ILE H H 114 8.721 8.721 8.857 -0.136 18387 6447 1 8 . 1 1 115 115 LEU N N 115 122.770 122.770 124.165 -1.395 18387 6448 1 8 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.275 0.000 18387 6449 1 8 . 1 1 115 115 LEU C C 115 173.601 173.601 174.909 -1.308 18387 6450 1 8 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.127 0.655 18387 6451 1 8 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.798 1.336 18387 6452 1 8 . 1 1 115 115 LEU H H 115 8.665 8.665 8.891 -0.226 18387 6453 1 8 . 1 1 116 116 VAL N N 116 130.411 130.411 126.603 3.808 18387 6454 1 8 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.930 -0.072 18387 6455 1 8 . 1 1 116 116 VAL C C 116 174.565 174.565 175.376 -0.811 18387 6456 1 8 . 1 1 116 116 VAL CA C 116 60.804 60.804 59.898 0.906 18387 6457 1 8 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.217 -0.301 18387 6458 1 8 . 1 1 116 116 VAL H H 116 9.472 9.472 9.323 0.149 18387 6459 1 8 . 1 1 117 117 ASP N N 117 127.896 127.896 126.473 1.423 18387 6460 1 8 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.990 -0.598 18387 6461 1 8 . 1 1 117 117 ASP C C 117 176.567 176.567 175.554 1.013 18387 6462 1 8 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.003 0.597 18387 6463 1 8 . 1 1 117 117 ASP CB C 117 40.584 40.584 41.453 -0.869 18387 6464 1 8 . 1 1 117 117 ASP H H 117 9.429 9.429 8.454 0.975 18387 6465 1 8 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.124 0.070 18387 6466 1 8 . 1 1 118 118 PRO C C 118 177.534 177.534 178.730 -1.196 18387 6467 1 8 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.520 -0.355 18387 6468 1 8 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.957 0.856 18387 6469 1 8 . 1 1 119 119 GLU N N 119 114.015 114.015 117.040 -3.025 18387 6470 1 8 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.059 0.280 18387 6471 1 8 . 1 1 119 119 GLU C C 119 176.722 176.722 177.349 -0.627 18387 6472 1 8 . 1 1 119 119 GLU CA C 119 55.639 55.639 58.130 -2.490 18387 6473 1 8 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.277 0.299 18387 6474 1 8 . 1 1 119 119 GLU H H 119 7.733 7.733 8.112 -0.379 18387 6475 1 8 . 1 1 120 120 GLY N N 120 108.218 108.218 106.610 1.608 18387 6476 1 8 . 1 1 120 120 GLY C C 120 174.110 174.110 173.208 0.902 18387 6477 1 8 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.860 0.536 18387 6478 1 8 . 1 1 120 120 GLY H H 120 8.588 8.588 8.488 0.100 18387 6479 1 8 . 1 1 121 121 LYS N N 121 121.778 121.778 119.599 2.179 18387 6480 1 8 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.179 -0.320 18387 6481 1 8 . 1 1 121 121 LYS C C 121 176.458 176.458 176.122 0.336 18387 6482 1 8 . 1 1 121 121 LYS CA C 121 54.962 54.962 53.517 1.445 18387 6483 1 8 . 1 1 121 121 LYS CB C 121 33.452 33.452 34.508 -1.056 18387 6484 1 8 . 1 1 121 121 LYS H H 121 8.600 8.600 9.134 -0.534 18387 6485 1 8 . 1 1 122 122 ILE N N 122 122.058 122.058 124.473 -2.415 18387 6486 1 8 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.190 0.082 18387 6487 1 8 . 1 1 122 122 ILE C C 122 177.084 177.084 176.746 0.338 18387 6488 1 8 . 1 1 122 122 ILE CA C 122 62.819 62.819 63.039 -0.220 18387 6489 1 8 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.110 1.538 18387 6490 1 8 . 1 1 122 122 ILE H H 122 9.006 9.006 8.844 0.162 18387 6491 1 8 . 1 1 123 123 VAL N N 123 120.561 120.561 130.282 -9.721 18387 6492 1 8 . 1 1 123 123 VAL HA H 123 4.755 4.755 3.972 0.783 18387 6493 1 8 . 1 1 123 123 VAL C C 123 175.584 175.584 175.639 -0.055 18387 6494 1 8 . 1 1 123 123 VAL CA C 123 61.151 61.151 64.677 -3.526 18387 6495 1 8 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.152 1.249 18387 6496 1 8 . 1 1 123 123 VAL H H 123 9.054 9.054 9.025 0.029 18387 6497 1 8 . 1 1 124 124 ALA N N 124 121.102 121.102 119.983 1.119 18387 6498 1 8 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.582 0.075 18387 6499 1 8 . 1 1 124 124 ALA C C 124 174.832 174.832 174.623 0.209 18387 6500 1 8 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.672 0.788 18387 6501 1 8 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.411 1.419 18387 6502 1 8 . 1 1 124 124 ALA H H 124 7.793 7.793 7.363 0.430 18387 6503 1 8 . 1 1 125 125 LYS N N 125 117.637 117.637 122.079 -4.442 18387 6504 1 8 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.447 0.586 18387 6505 1 8 . 1 1 125 125 LYS C C 125 173.417 173.417 175.873 -2.456 18387 6506 1 8 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.327 -0.186 18387 6507 1 8 . 1 1 125 125 LYS CB C 125 36.651 36.651 34.628 2.023 18387 6508 1 8 . 1 1 125 125 LYS H H 125 8.872 8.872 8.505 0.367 18387 6509 1 8 . 1 1 126 126 GLU N N 126 115.236 115.236 121.407 -6.171 18387 6510 1 8 . 1 1 126 126 GLU HA H 126 3.998 3.998 4.033 -0.035 18387 6511 1 8 . 1 1 126 126 GLU C C 126 175.998 175.998 175.641 0.357 18387 6512 1 8 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.386 -0.423 18387 6513 1 8 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.427 -0.993 18387 6514 1 8 . 1 1 126 126 GLU H H 126 7.941 7.941 8.584 -0.643 18387 6515 1 8 . 1 1 127 127 LEU N N 127 118.584 118.584 120.634 -2.050 18387 6516 1 8 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.387 -0.005 18387 6517 1 8 . 1 1 127 127 LEU C C 127 176.766 176.766 175.969 0.797 18387 6518 1 8 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.456 0.153 18387 6519 1 8 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.936 1.027 18387 6520 1 8 . 1 1 127 127 LEU H H 127 7.300 7.300 7.515 -0.215 18387 6521 1 8 . 1 1 128 128 ARG N N 128 118.625 118.625 118.818 -0.193 18387 6522 1 8 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.939 -0.464 18387 6523 1 8 . 1 1 128 128 ARG C C 128 177.113 177.113 177.015 0.098 18387 6524 1 8 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.013 -0.623 18387 6525 1 8 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.526 1.086 18387 6526 1 8 . 1 1 128 128 ARG H H 128 7.929 7.929 8.110 -0.181 18387 6527 1 8 . 1 1 129 129 GLY N N 129 114.010 114.010 111.328 2.682 18387 6528 1 8 . 1 1 129 129 GLY C C 129 175.931 175.931 174.477 1.454 18387 6529 1 8 . 1 1 129 129 GLY CA C 129 45.461 45.461 45.701 -0.240 18387 6530 1 8 . 1 1 129 129 GLY H H 129 10.649 10.649 9.187 1.462 18387 6531 1 8 . 1 1 130 130 ASP N N 130 123.975 123.975 123.860 0.115 18387 6532 1 8 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.461 0.071 18387 6533 1 8 . 1 1 130 130 ASP C C 130 177.507 177.507 177.501 0.006 18387 6534 1 8 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.346 1.026 18387 6535 1 8 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.534 0.369 18387 6536 1 8 . 1 1 130 130 ASP H H 130 8.540 8.540 8.133 0.407 18387 6537 1 8 . 1 1 131 131 ASP N N 131 116.806 116.806 121.051 -4.245 18387 6538 1 8 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.370 0.200 18387 6539 1 8 . 1 1 131 131 ASP C C 131 179.038 179.038 178.712 0.326 18387 6540 1 8 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.254 -0.271 18387 6541 1 8 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.462 0.472 18387 6542 1 8 . 1 1 131 131 ASP H H 131 7.907 7.907 7.753 0.154 18387 6543 1 8 . 1 1 132 132 LEU N N 132 123.869 123.869 120.897 2.972 18387 6544 1 8 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.855 -0.064 18387 6545 1 8 . 1 1 132 132 LEU C C 132 176.343 176.343 178.601 -2.258 18387 6546 1 8 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.775 1.009 18387 6547 1 8 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.651 0.117 18387 6548 1 8 . 1 1 132 132 LEU H H 132 7.542 7.542 7.684 -0.142 18387 6549 1 8 . 1 1 133 133 TYR N N 133 120.042 120.042 118.765 1.277 18387 6550 1 8 . 1 1 133 133 TYR HA H 133 3.996 3.996 3.955 0.041 18387 6551 1 8 . 1 1 133 133 TYR C C 133 177.426 177.426 177.716 -0.290 18387 6552 1 8 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.986 0.147 18387 6553 1 8 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.426 0.150 18387 6554 1 8 . 1 1 133 133 TYR H H 133 7.384 7.384 7.467 -0.083 18387 6555 1 8 . 1 1 134 134 ASN N N 134 114.936 114.936 117.342 -2.406 18387 6556 1 8 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.398 0.005 18387 6557 1 8 . 1 1 134 134 ASN C C 134 178.703 178.703 178.066 0.637 18387 6558 1 8 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.822 -1.013 18387 6559 1 8 . 1 1 134 134 ASN CB C 134 38.208 38.208 37.943 0.265 18387 6560 1 8 . 1 1 134 134 ASN H H 134 8.399 8.399 8.916 -0.517 18387 6561 1 8 . 1 1 135 135 THR N N 135 117.387 117.387 117.631 -0.244 18387 6562 1 8 . 1 1 135 135 THR HA H 135 3.920 3.920 3.935 -0.015 18387 6563 1 8 . 1 1 135 135 THR C C 135 175.323 175.323 176.580 -1.257 18387 6564 1 8 . 1 1 135 135 THR CA C 135 67.402 67.402 66.477 0.925 18387 6565 1 8 . 1 1 135 135 THR CB C 135 68.111 68.111 68.857 -0.746 18387 6566 1 8 . 1 1 135 135 THR H H 135 8.265 8.265 8.047 0.218 18387 6567 1 8 . 1 1 136 136 VAL N N 136 121.207 121.207 121.308 -0.101 18387 6568 1 8 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.223 -0.208 18387 6569 1 8 . 1 1 136 136 VAL C C 136 176.457 176.457 176.758 -0.301 18387 6570 1 8 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.576 1.696 18387 6571 1 8 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.706 0.235 18387 6572 1 8 . 1 1 136 136 VAL H H 136 7.595 7.595 7.550 0.045 18387 6573 1 8 . 1 1 137 137 GLU N N 137 118.266 118.266 119.615 -1.349 18387 6574 1 8 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.685 -1.003 18387 6575 1 8 . 1 1 137 137 GLU C C 137 177.482 177.482 178.314 -0.832 18387 6576 1 8 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.768 0.162 18387 6577 1 8 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.326 0.456 18387 6578 1 8 . 1 1 137 137 GLU H H 137 8.114 8.114 8.308 -0.194 18387 6579 1 8 . 1 1 138 138 LYS N N 138 116.431 116.431 118.506 -2.075 18387 6580 1 8 . 1 1 138 138 LYS HA H 138 3.768 3.768 4.001 -0.233 18387 6581 1 8 . 1 1 138 138 LYS C C 138 179.193 179.193 179.118 0.075 18387 6582 1 8 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.131 -0.091 18387 6583 1 8 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.451 -0.293 18387 6584 1 8 . 1 1 138 138 LYS H H 138 7.133 7.133 7.741 -0.608 18387 6585 1 8 . 1 1 139 139 PHE N N 139 116.336 116.336 118.556 -2.220 18387 6586 1 8 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.221 -0.211 18387 6587 1 8 . 1 1 139 139 PHE C C 139 177.855 177.855 176.859 0.996 18387 6588 1 8 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.892 1.492 18387 6589 1 8 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.706 -0.354 18387 6590 1 8 . 1 1 139 139 PHE H H 139 7.338 7.338 7.485 -0.147 18387 6591 1 8 . 1 1 140 140 VAL N N 140 116.491 116.491 116.133 0.358 18387 6592 1 8 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.720 -0.196 18387 6593 1 8 . 1 1 140 140 VAL C C 140 177.747 177.747 177.738 0.009 18387 6594 1 8 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.662 0.580 18387 6595 1 8 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.753 -0.364 18387 6596 1 8 . 1 1 140 140 VAL H H 140 8.332 8.332 8.396 -0.064 18387 6597 1 8 . 1 1 141 141 ASN N N 141 116.956 116.956 116.779 0.177 18387 6598 1 8 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.581 0.245 18387 6599 1 8 . 1 1 141 141 ASN C C 141 176.997 176.997 175.875 1.122 18387 6600 1 8 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.027 -1.350 18387 6601 1 8 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.446 -0.998 18387 6602 1 8 . 1 1 141 141 ASN H H 141 7.862 7.862 7.771 0.091 18387 6603 1 8 . 1 1 142 142 GLY N N 142 107.938 107.938 107.518 0.420 18387 6604 1 8 . 1 1 142 142 GLY C C 142 174.336 174.336 173.417 0.919 18387 6605 1 8 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.672 1.312 18387 6606 1 8 . 1 1 142 142 GLY H H 142 7.466 7.466 7.646 -0.180 18387 6607 1 8 . 1 1 143 143 ALA N N 143 123.441 123.441 122.294 1.147 18387 6608 1 8 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.274 0.067 18387 6609 1 8 . 1 1 143 143 ALA C C 143 178.212 178.212 177.202 1.010 18387 6610 1 8 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.918 -0.092 18387 6611 1 8 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.848 0.396 18387 6612 1 8 . 1 1 143 143 ALA H H 143 7.950 7.950 8.335 -0.385 18387 6613 1 8 . 1 1 144 144 LYS N N 144 120.149 120.149 122.367 -2.218 18387 6614 1 8 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.390 -0.095 18387 6615 1 8 . 1 1 144 144 LYS C C 144 176.945 176.945 177.170 -0.225 18387 6616 1 8 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.862 -0.343 18387 6617 1 8 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.423 0.607 18387 6618 1 8 . 1 1 144 144 LYS H H 144 8.187 8.187 8.455 -0.268 18387 6619 1 8 . 1 1 145 145 GLU N N 145 120.992 120.992 120.050 0.942 18387 6620 1 8 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.383 -0.088 18387 6621 1 8 . 1 1 145 145 GLU C C 145 177.116 177.116 176.966 0.150 18387 6622 1 8 . 1 1 145 145 GLU CA C 145 56.903 56.903 57.105 -0.202 18387 6623 1 8 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.548 0.694 18387 6624 1 8 . 1 1 145 145 GLU H H 145 8.363 8.363 8.573 -0.210 18387 6625 1 8 . 1 1 146 146 GLY N N 146 109.467 109.467 109.588 -0.121 18387 6626 1 8 . 1 1 146 146 GLY C C 146 174.108 174.108 173.840 0.268 18387 6627 1 8 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.902 0.499 18387 6628 1 8 . 1 1 146 146 GLY H H 146 8.371 8.371 8.054 0.317 18387 6629 1 8 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.526 0.083 18387 6630 1 8 . 1 1 151 151 HIS C C 151 174.258 174.258 173.956 0.302 18387 6631 1 8 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.540 -0.375 18387 6632 1 8 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.658 0.175 18387 6633 1 9 . 1 1 2 2 SER HA H 2 3.992 3.992 4.625 -0.633 18387 6634 1 9 . 1 1 2 2 SER CA C 2 57.555 57.555 58.809 -1.254 18387 6635 1 9 . 1 1 2 2 SER CB C 2 64.977 64.977 63.702 1.275 18387 6636 1 9 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.637 -0.198 18387 6637 1 9 . 1 1 3 3 LEU C C 3 176.631 176.631 175.946 0.685 18387 6638 1 9 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.034 0.530 18387 6639 1 9 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.572 -0.848 18387 6640 1 9 . 1 1 4 4 ALA N N 4 125.483 125.483 124.180 1.303 18387 6641 1 9 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.548 -0.169 18387 6642 1 9 . 1 1 4 4 ALA C C 4 179.642 179.642 176.825 2.817 18387 6643 1 9 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.540 0.195 18387 6644 1 9 . 1 1 4 4 ALA CB C 4 19.752 19.752 19.701 0.051 18387 6645 1 9 . 1 1 4 4 ALA H H 4 8.483 8.483 8.176 0.307 18387 6646 1 9 . 1 1 5 5 THR HA H 5 3.845 3.845 5.116 -1.271 18387 6647 1 9 . 1 1 5 5 THR C C 5 175.487 175.487 175.429 0.058 18387 6648 1 9 . 1 1 5 5 THR CA C 5 64.531 64.531 61.566 2.965 18387 6649 1 9 . 1 1 5 5 THR CB C 5 68.108 68.108 69.534 -1.426 18387 6650 1 9 . 1 1 6 6 GLY N N 6 114.298 114.298 115.675 -1.377 18387 6651 1 9 . 1 1 6 6 GLY C C 6 174.324 174.324 174.122 0.202 18387 6652 1 9 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.107 -0.272 18387 6653 1 9 . 1 1 6 6 GLY H H 6 9.511 9.511 8.229 1.282 18387 6654 1 9 . 1 1 7 7 SER N N 7 115.270 115.270 117.035 -1.765 18387 6655 1 9 . 1 1 7 7 SER HA H 7 4.500 4.500 4.502 -0.002 18387 6656 1 9 . 1 1 7 7 SER C C 7 173.315 173.315 174.686 -1.371 18387 6657 1 9 . 1 1 7 7 SER CA C 7 58.915 58.915 57.685 1.230 18387 6658 1 9 . 1 1 7 7 SER CB C 7 64.308 64.308 63.740 0.568 18387 6659 1 9 . 1 1 7 7 SER H H 7 7.736 7.736 7.918 -0.182 18387 6660 1 9 . 1 1 8 8 VAL N N 8 123.708 123.708 126.080 -2.372 18387 6661 1 9 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.164 -0.332 18387 6662 1 9 . 1 1 8 8 VAL C C 8 176.673 176.673 176.684 -0.011 18387 6663 1 9 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.798 0.875 18387 6664 1 9 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.495 0.727 18387 6665 1 9 . 1 1 8 8 VAL H H 8 8.632 8.632 8.633 -0.001 18387 6666 1 9 . 1 1 9 9 ALA N N 9 133.040 133.040 132.131 0.909 18387 6667 1 9 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.887 -0.624 18387 6668 1 9 . 1 1 9 9 ALA C C 9 175.404 175.404 175.576 -0.172 18387 6669 1 9 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.110 0.845 18387 6670 1 9 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.898 -0.868 18387 6671 1 9 . 1 1 9 9 ALA H H 9 8.448 8.448 9.126 -0.678 18387 6672 1 9 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.424 -0.093 18387 6673 1 9 . 1 1 10 10 PRO C C 10 175.071 175.071 176.115 -1.044 18387 6674 1 9 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.453 0.188 18387 6675 1 9 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.207 0.117 18387 6676 1 9 . 1 1 11 11 ALA N N 11 124.172 124.172 123.156 1.016 18387 6677 1 9 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.588 -0.344 18387 6678 1 9 . 1 1 11 11 ALA C C 11 177.688 177.688 177.373 0.315 18387 6679 1 9 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.534 2.087 18387 6680 1 9 . 1 1 11 11 ALA CB C 11 19.327 19.327 20.065 -0.738 18387 6681 1 9 . 1 1 11 11 ALA H H 11 8.221 8.221 8.257 -0.036 18387 6682 1 9 . 1 1 12 12 ILE N N 12 117.815 117.815 123.344 -5.529 18387 6683 1 9 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.294 0.034 18387 6684 1 9 . 1 1 12 12 ILE C C 12 175.013 175.013 175.644 -0.631 18387 6685 1 9 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.703 1.463 18387 6686 1 9 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.564 4.726 18387 6687 1 9 . 1 1 12 12 ILE H H 12 7.693 7.693 8.603 -0.910 18387 6688 1 9 . 1 1 13 13 THR N N 13 121.186 121.186 122.331 -1.145 18387 6689 1 9 . 1 1 13 13 THR HA H 13 4.840 4.840 4.970 -0.130 18387 6690 1 9 . 1 1 13 13 THR C C 13 172.625 172.625 173.850 -1.225 18387 6691 1 9 . 1 1 13 13 THR CA C 13 62.297 62.297 61.441 0.856 18387 6692 1 9 . 1 1 13 13 THR CB C 13 71.585 71.585 69.186 2.399 18387 6693 1 9 . 1 1 13 13 THR H H 13 8.363 8.363 8.684 -0.321 18387 6694 1 9 . 1 1 14 14 GLY N N 14 110.785 110.785 112.301 -1.516 18387 6695 1 9 . 1 1 14 14 GLY C C 14 170.040 170.040 171.830 -1.790 18387 6696 1 9 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.328 1.062 18387 6697 1 9 . 1 1 14 14 GLY H H 14 7.993 7.993 9.316 -1.323 18387 6698 1 9 . 1 1 15 15 ILE N N 15 119.088 119.088 122.082 -2.994 18387 6699 1 9 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.163 -0.038 18387 6700 1 9 . 1 1 15 15 ILE C C 15 176.359 176.359 176.110 0.249 18387 6701 1 9 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.532 -1.918 18387 6702 1 9 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.961 -0.322 18387 6703 1 9 . 1 1 15 15 ILE H H 15 7.973 7.973 8.860 -0.887 18387 6704 1 9 . 1 1 16 16 ASP N N 16 126.633 126.633 127.501 -0.868 18387 6705 1 9 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.477 0.372 18387 6706 1 9 . 1 1 16 16 ASP C C 16 179.190 179.190 178.298 0.892 18387 6707 1 9 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.091 -0.211 18387 6708 1 9 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.484 -0.209 18387 6709 1 9 . 1 1 16 16 ASP H H 16 9.335 9.335 8.805 0.530 18387 6710 1 9 . 1 1 17 17 LEU N N 17 116.648 116.648 119.228 -2.580 18387 6711 1 9 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.099 0.075 18387 6712 1 9 . 1 1 17 17 LEU C C 17 178.432 178.432 179.067 -0.635 18387 6713 1 9 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.811 0.170 18387 6714 1 9 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.670 1.316 18387 6715 1 9 . 1 1 17 17 LEU H H 17 8.071 8.071 8.950 -0.879 18387 6716 1 9 . 1 1 18 18 LYS N N 18 117.401 117.401 118.054 -0.653 18387 6717 1 9 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.211 0.298 18387 6718 1 9 . 1 1 18 18 LYS C C 18 176.793 176.793 177.222 -0.429 18387 6719 1 9 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.322 -1.887 18387 6720 1 9 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.806 0.257 18387 6721 1 9 . 1 1 18 18 LYS H H 18 8.207 8.207 8.877 -0.670 18387 6722 1 9 . 1 1 19 19 GLY N N 19 108.061 108.061 107.497 0.564 18387 6723 1 9 . 1 1 19 19 GLY C C 19 174.649 174.649 174.029 0.620 18387 6724 1 9 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.832 0.765 18387 6725 1 9 . 1 1 19 19 GLY H H 19 8.099 8.099 8.027 0.072 18387 6726 1 9 . 1 1 20 20 ASN N N 20 121.012 121.012 119.597 1.415 18387 6727 1 9 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.965 -0.060 18387 6728 1 9 . 1 1 20 20 ASN C C 20 174.827 174.827 174.709 0.118 18387 6729 1 9 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.348 0.119 18387 6730 1 9 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.979 -1.303 18387 6731 1 9 . 1 1 20 20 ASN H H 20 8.945 8.945 8.999 -0.054 18387 6732 1 9 . 1 1 21 21 SER N N 21 117.285 117.285 117.648 -0.363 18387 6733 1 9 . 1 1 21 21 SER HA H 21 5.000 5.000 4.778 0.222 18387 6734 1 9 . 1 1 21 21 SER C C 21 174.911 174.911 174.317 0.594 18387 6735 1 9 . 1 1 21 21 SER CA C 21 58.730 58.730 58.480 0.250 18387 6736 1 9 . 1 1 21 21 SER CB C 21 63.162 63.162 62.626 0.536 18387 6737 1 9 . 1 1 21 21 SER H H 21 8.740 8.740 8.623 0.117 18387 6738 1 9 . 1 1 22 22 VAL N N 22 128.665 128.665 127.294 1.371 18387 6739 1 9 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.262 0.118 18387 6740 1 9 . 1 1 22 22 VAL C C 22 176.276 176.276 175.342 0.934 18387 6741 1 9 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.149 0.804 18387 6742 1 9 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.285 2.297 18387 6743 1 9 . 1 1 22 22 VAL H H 22 9.125 9.125 8.966 0.159 18387 6744 1 9 . 1 1 23 23 SER N N 23 127.457 127.457 119.263 8.194 18387 6745 1 9 . 1 1 23 23 SER HA H 23 5.878 5.878 5.678 0.200 18387 6746 1 9 . 1 1 23 23 SER C C 23 174.436 174.436 175.624 -1.188 18387 6747 1 9 . 1 1 23 23 SER CA C 23 57.101 57.101 56.166 0.935 18387 6748 1 9 . 1 1 23 23 SER CB C 23 66.078 66.078 65.803 0.275 18387 6749 1 9 . 1 1 23 23 SER H H 23 8.971 8.971 8.487 0.484 18387 6750 1 9 . 1 1 24 24 LEU N N 24 126.734 126.734 123.259 3.475 18387 6751 1 9 . 1 1 24 24 LEU HA H 24 3.467 3.467 4.393 -0.926 18387 6752 1 9 . 1 1 24 24 LEU C C 24 179.852 179.852 177.601 2.251 18387 6753 1 9 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.104 2.099 18387 6754 1 9 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.972 0.006 18387 6755 1 9 . 1 1 24 24 LEU H H 24 8.450 8.450 8.368 0.082 18387 6756 1 9 . 1 1 25 25 ASN N N 25 115.642 115.642 117.415 -1.773 18387 6757 1 9 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.453 -0.211 18387 6758 1 9 . 1 1 25 25 ASN C C 25 176.246 176.246 176.807 -0.561 18387 6759 1 9 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.546 -0.176 18387 6760 1 9 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.330 1.441 18387 6761 1 9 . 1 1 25 25 ASN H H 25 8.505 8.505 8.556 -0.051 18387 6762 1 9 . 1 1 26 26 ASP N N 26 119.722 119.722 120.304 -0.582 18387 6763 1 9 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.301 -0.096 18387 6764 1 9 . 1 1 26 26 ASP C C 26 176.708 176.708 176.846 -0.138 18387 6765 1 9 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.581 -0.056 18387 6766 1 9 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.424 -1.144 18387 6767 1 9 . 1 1 26 26 ASP H H 26 7.731 7.731 7.706 0.025 18387 6768 1 9 . 1 1 27 27 PHE N N 27 116.827 116.827 116.221 0.606 18387 6769 1 9 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.414 0.066 18387 6770 1 9 . 1 1 27 27 PHE C C 27 174.227 174.227 175.622 -1.395 18387 6771 1 9 . 1 1 27 27 PHE CA C 27 57.071 57.071 58.227 -1.156 18387 6772 1 9 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.013 0.706 18387 6773 1 9 . 1 1 27 27 PHE H H 27 7.390 7.390 7.340 0.050 18387 6774 1 9 . 1 1 28 28 LYS N N 28 120.357 120.357 121.496 -1.139 18387 6775 1 9 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.508 -0.121 18387 6776 1 9 . 1 1 28 28 LYS C C 28 177.845 177.845 176.533 1.312 18387 6777 1 9 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.816 1.186 18387 6778 1 9 . 1 1 28 28 LYS CB C 28 32.544 32.544 31.342 1.202 18387 6779 1 9 . 1 1 28 28 LYS H H 28 6.883 6.883 7.103 -0.220 18387 6780 1 9 . 1 1 29 29 GLY N N 29 112.653 112.653 111.516 1.137 18387 6781 1 9 . 1 1 29 29 GLY C C 29 173.799 173.799 173.691 0.108 18387 6782 1 9 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.733 0.255 18387 6783 1 9 . 1 1 29 29 GLY H H 29 8.930 8.930 8.103 0.827 18387 6784 1 9 . 1 1 30 30 LYS N N 30 120.516 120.516 119.315 1.201 18387 6785 1 9 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.828 -0.193 18387 6786 1 9 . 1 1 30 30 LYS C C 30 176.505 176.505 175.179 1.326 18387 6787 1 9 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.356 0.824 18387 6788 1 9 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.900 -1.043 18387 6789 1 9 . 1 1 30 30 LYS H H 30 8.098 8.098 7.494 0.604 18387 6790 1 9 . 1 1 31 31 TYR N N 31 117.383 117.383 120.093 -2.710 18387 6791 1 9 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.750 -0.096 18387 6792 1 9 . 1 1 31 31 TYR C C 31 175.551 175.551 175.423 0.128 18387 6793 1 9 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.551 1.614 18387 6794 1 9 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.898 2.295 18387 6795 1 9 . 1 1 31 31 TYR H H 31 8.263 8.263 9.192 -0.929 18387 6796 1 9 . 1 1 32 32 VAL N N 32 120.900 120.900 124.581 -3.681 18387 6797 1 9 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.620 -0.181 18387 6798 1 9 . 1 1 32 32 VAL C C 32 175.975 175.975 174.628 1.347 18387 6799 1 9 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.622 -0.916 18387 6800 1 9 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.562 2.945 18387 6801 1 9 . 1 1 32 32 VAL H H 32 9.244 9.244 9.270 -0.026 18387 6802 1 9 . 1 1 33 33 LEU N N 33 130.058 130.058 131.481 -1.423 18387 6803 1 9 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.917 0.256 18387 6804 1 9 . 1 1 33 33 LEU C C 33 174.693 174.693 175.042 -0.349 18387 6805 1 9 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.278 0.070 18387 6806 1 9 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.064 1.257 18387 6807 1 9 . 1 1 33 33 LEU H H 33 8.161 8.161 8.399 -0.238 18387 6808 1 9 . 1 1 34 34 VAL N N 34 129.232 129.232 130.262 -1.030 18387 6809 1 9 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.402 0.580 18387 6810 1 9 . 1 1 34 34 VAL C C 34 174.285 174.285 174.750 -0.465 18387 6811 1 9 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.734 -0.228 18387 6812 1 9 . 1 1 34 34 VAL CB C 34 32.378 32.378 31.955 0.423 18387 6813 1 9 . 1 1 34 34 VAL H H 34 9.296 9.296 9.233 0.063 18387 6814 1 9 . 1 1 35 35 ASP N N 35 123.675 123.675 129.334 -5.659 18387 6815 1 9 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.977 0.372 18387 6816 1 9 . 1 1 35 35 ASP C C 35 174.258 174.258 175.118 -0.860 18387 6817 1 9 . 1 1 35 35 ASP CA C 35 51.054 51.054 54.003 -2.949 18387 6818 1 9 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.483 -2.022 18387 6819 1 9 . 1 1 35 35 ASP H H 35 8.015 8.015 8.296 -0.281 18387 6820 1 9 . 1 1 36 36 PHE N N 36 126.959 126.959 124.871 2.088 18387 6821 1 9 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.717 0.218 18387 6822 1 9 . 1 1 36 36 PHE C C 36 175.432 175.432 175.338 0.094 18387 6823 1 9 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.858 0.237 18387 6824 1 9 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.582 -0.552 18387 6825 1 9 . 1 1 36 36 PHE H H 36 9.171 9.171 8.581 0.590 18387 6826 1 9 . 1 1 37 37 TRP N N 37 120.839 120.839 121.870 -1.031 18387 6827 1 9 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.179 0.578 18387 6828 1 9 . 1 1 37 37 TRP C C 37 172.412 172.412 173.332 -0.920 18387 6829 1 9 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.721 0.188 18387 6830 1 9 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.487 0.193 18387 6831 1 9 . 1 1 37 37 TRP H H 37 9.280 9.280 9.172 0.108 18387 6832 1 9 . 1 1 38 38 PHE N N 38 109.215 109.215 112.000 -2.785 18387 6833 1 9 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.511 -0.578 18387 6834 1 9 . 1 1 38 38 PHE C C 38 176.141 176.141 174.823 1.318 18387 6835 1 9 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.730 0.281 18387 6836 1 9 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.742 -1.123 18387 6837 1 9 . 1 1 38 38 PHE H H 38 7.062 7.062 8.190 -1.128 18387 6838 1 9 . 1 1 39 39 ALA N N 39 125.193 125.193 122.891 2.302 18387 6839 1 9 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.252 -0.187 18387 6840 1 9 . 1 1 39 39 ALA C C 39 179.349 179.349 178.758 0.591 18387 6841 1 9 . 1 1 39 39 ALA CA C 39 56.064 56.064 55.278 0.786 18387 6842 1 9 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.918 0.979 18387 6843 1 9 . 1 1 39 39 ALA H H 39 10.355 10.355 9.773 0.582 18387 6844 1 9 . 1 1 40 40 GLY N N 40 103.437 103.437 106.972 -3.535 18387 6845 1 9 . 1 1 40 40 GLY C C 40 172.732 172.732 174.546 -1.814 18387 6846 1 9 . 1 1 40 40 GLY CA C 40 44.936 44.936 46.269 -1.333 18387 6847 1 9 . 1 1 40 40 GLY H H 40 8.583 8.583 8.855 -0.272 18387 6848 1 9 . 1 1 41 41 CYS N N 41 124.859 124.859 121.370 3.489 18387 6849 1 9 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.271 0.133 18387 6850 1 9 . 1 1 41 41 CYS C C 41 176.620 176.620 174.958 1.662 18387 6851 1 9 . 1 1 41 41 CYS CA C 41 58.375 58.375 59.268 -0.893 18387 6852 1 9 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.269 1.107 18387 6853 1 9 . 1 1 41 41 CYS H H 41 6.946 6.946 6.981 -0.035 18387 6854 1 9 . 1 1 42 42 SER HA H 42 4.040 4.040 4.276 -0.236 18387 6855 1 9 . 1 1 42 42 SER CA C 42 61.552 61.552 61.467 0.085 18387 6856 1 9 . 1 1 42 42 SER CB C 42 62.675 62.675 63.334 -0.659 18387 6857 1 9 . 1 1 43 43 TRP N N 43 129.748 129.748 121.570 8.178 18387 6858 1 9 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.474 0.075 18387 6859 1 9 . 1 1 43 43 TRP C C 43 180.400 180.400 177.119 3.281 18387 6860 1 9 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.144 1.105 18387 6861 1 9 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.499 0.093 18387 6862 1 9 . 1 1 44 44 CYS N N 44 124.462 124.462 115.240 9.222 18387 6863 1 9 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.045 0.206 18387 6864 1 9 . 1 1 44 44 CYS C C 44 178.643 178.643 177.216 1.427 18387 6865 1 9 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.860 1.989 18387 6866 1 9 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.200 2.222 18387 6867 1 9 . 1 1 44 44 CYS H H 44 9.591 9.591 7.647 1.944 18387 6868 1 9 . 1 1 45 45 ARG N N 45 117.248 117.248 118.091 -0.843 18387 6869 1 9 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.122 0.054 18387 6870 1 9 . 1 1 45 45 ARG C C 45 180.302 180.302 177.589 2.713 18387 6871 1 9 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.584 -0.641 18387 6872 1 9 . 1 1 45 45 ARG CB C 45 27.631 27.631 30.106 -2.475 18387 6873 1 9 . 1 1 45 45 ARG H H 45 7.955 7.955 7.532 0.423 18387 6874 1 9 . 1 1 46 46 LYS N N 46 120.318 120.318 117.706 2.612 18387 6875 1 9 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.085 0.187 18387 6876 1 9 . 1 1 46 46 LYS C C 46 177.755 177.755 177.413 0.342 18387 6877 1 9 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.521 1.248 18387 6878 1 9 . 1 1 46 46 LYS CB C 46 33.157 33.157 31.372 1.785 18387 6879 1 9 . 1 1 46 46 LYS H H 46 8.129 8.129 7.172 0.957 18387 6880 1 9 . 1 1 47 47 GLU N N 47 114.278 114.278 116.915 -2.637 18387 6881 1 9 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.602 0.289 18387 6882 1 9 . 1 1 47 47 GLU C C 47 178.701 178.701 177.687 1.014 18387 6883 1 9 . 1 1 47 47 GLU CA C 47 56.554 56.554 56.966 -0.412 18387 6884 1 9 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.572 0.194 18387 6885 1 9 . 1 1 47 47 GLU H H 47 7.386 7.386 7.380 0.006 18387 6886 1 9 . 1 1 48 48 THR N N 48 115.665 115.665 117.676 -2.011 18387 6887 1 9 . 1 1 48 48 THR HA H 48 4.048 4.048 4.193 -0.145 18387 6888 1 9 . 1 1 48 48 THR C C 48 172.392 172.392 174.491 -2.099 18387 6889 1 9 . 1 1 48 48 THR CA C 48 69.426 69.426 68.871 0.555 18387 6890 1 9 . 1 1 48 48 THR CB C 48 66.906 66.906 66.524 0.382 18387 6891 1 9 . 1 1 48 48 THR H H 48 7.810 7.810 7.641 0.169 18387 6892 1 9 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.161 0.128 18387 6893 1 9 . 1 1 49 49 PRO C C 49 179.828 179.828 178.719 1.109 18387 6894 1 9 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.550 0.049 18387 6895 1 9 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.038 -0.003 18387 6896 1 9 . 1 1 50 50 TYR N N 50 116.950 116.950 115.978 0.972 18387 6897 1 9 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.250 -0.113 18387 6898 1 9 . 1 1 50 50 TYR C C 50 179.488 179.488 178.531 0.957 18387 6899 1 9 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.837 -0.702 18387 6900 1 9 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.739 0.562 18387 6901 1 9 . 1 1 50 50 TYR H H 50 7.071 7.071 7.311 -0.240 18387 6902 1 9 . 1 1 51 51 LEU N N 51 123.989 123.989 120.372 3.617 18387 6903 1 9 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.891 -0.221 18387 6904 1 9 . 1 1 51 51 LEU C C 51 178.072 178.072 179.104 -1.032 18387 6905 1 9 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.962 0.714 18387 6906 1 9 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.491 1.126 18387 6907 1 9 . 1 1 51 51 LEU H H 51 8.243 8.243 8.521 -0.278 18387 6908 1 9 . 1 1 52 52 LEU N N 52 119.857 119.857 120.035 -0.178 18387 6909 1 9 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.214 0.113 18387 6910 1 9 . 1 1 52 52 LEU C C 52 178.704 178.704 178.346 0.358 18387 6911 1 9 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.609 -0.034 18387 6912 1 9 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.841 0.897 18387 6913 1 9 . 1 1 52 52 LEU H H 52 9.085 9.085 8.864 0.221 18387 6914 1 9 . 1 1 53 53 LYS N N 53 118.658 118.658 119.075 -0.417 18387 6915 1 9 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.028 0.081 18387 6916 1 9 . 1 1 53 53 LYS C C 53 179.786 179.786 179.096 0.690 18387 6917 1 9 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.089 -0.368 18387 6918 1 9 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.377 0.782 18387 6919 1 9 . 1 1 53 53 LYS H H 53 7.807 7.807 8.255 -0.448 18387 6920 1 9 . 1 1 54 54 THR N N 54 116.869 116.869 116.801 0.068 18387 6921 1 9 . 1 1 54 54 THR HA H 54 3.965 3.965 4.248 -0.283 18387 6922 1 9 . 1 1 54 54 THR C C 54 175.328 175.328 176.703 -1.375 18387 6923 1 9 . 1 1 54 54 THR CA C 54 67.683 67.683 67.048 0.635 18387 6924 1 9 . 1 1 54 54 THR CB C 54 68.452 68.452 69.151 -0.699 18387 6925 1 9 . 1 1 54 54 THR H H 54 7.771 7.771 8.264 -0.493 18387 6926 1 9 . 1 1 55 55 TYR N N 55 122.202 122.202 122.470 -0.268 18387 6927 1 9 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.278 -0.006 18387 6928 1 9 . 1 1 55 55 TYR C C 55 176.809 176.809 177.174 -0.365 18387 6929 1 9 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.762 0.975 18387 6930 1 9 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.401 0.879 18387 6931 1 9 . 1 1 55 55 TYR H H 55 9.145 9.145 8.829 0.316 18387 6932 1 9 . 1 1 56 56 ASN N N 56 113.858 113.858 116.179 -2.321 18387 6933 1 9 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.263 0.000 18387 6934 1 9 . 1 1 56 56 ASN C C 56 177.427 177.427 176.831 0.596 18387 6935 1 9 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.922 0.008 18387 6936 1 9 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.602 -0.648 18387 6937 1 9 . 1 1 56 56 ASN H H 56 8.850 8.850 8.372 0.478 18387 6938 1 9 . 1 1 57 57 ALA N N 57 118.829 118.829 120.729 -1.900 18387 6939 1 9 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.068 -0.004 18387 6940 1 9 . 1 1 57 57 ALA C C 57 180.445 180.445 177.382 3.063 18387 6941 1 9 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.148 0.203 18387 6942 1 9 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.277 -0.083 18387 6943 1 9 . 1 1 57 57 ALA H H 57 7.436 7.436 7.515 -0.079 18387 6944 1 9 . 1 1 58 58 PHE N N 58 112.082 112.082 114.730 -2.648 18387 6945 1 9 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.682 0.239 18387 6946 1 9 . 1 1 58 58 PHE C C 58 176.999 176.999 177.010 -0.011 18387 6947 1 9 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.489 0.578 18387 6948 1 9 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.648 0.842 18387 6949 1 9 . 1 1 58 58 PHE H H 58 7.480 7.480 7.894 -0.414 18387 6950 1 9 . 1 1 59 59 LYS N N 59 120.666 120.666 121.471 -0.805 18387 6951 1 9 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.524 0.279 18387 6952 1 9 . 1 1 59 59 LYS C C 59 177.157 177.157 177.621 -0.464 18387 6953 1 9 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.174 -0.093 18387 6954 1 9 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.581 -1.013 18387 6955 1 9 . 1 1 59 59 LYS H H 59 8.411 8.411 7.931 0.480 18387 6956 1 9 . 1 1 60 60 ASP N N 60 118.908 118.908 117.540 1.368 18387 6957 1 9 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.600 0.525 18387 6958 1 9 . 1 1 60 60 ASP C C 60 176.889 176.889 176.641 0.248 18387 6959 1 9 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.509 -0.860 18387 6960 1 9 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.758 0.954 18387 6961 1 9 . 1 1 60 60 ASP H H 60 8.574 8.574 8.563 0.011 18387 6962 1 9 . 1 1 61 61 LYS N N 61 121.021 121.021 119.920 1.101 18387 6963 1 9 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.637 0.077 18387 6964 1 9 . 1 1 61 61 LYS C C 61 175.968 175.968 176.542 -0.574 18387 6965 1 9 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.484 -0.347 18387 6966 1 9 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.386 0.692 18387 6967 1 9 . 1 1 61 61 LYS H H 61 8.278 8.278 7.652 0.626 18387 6968 1 9 . 1 1 62 62 GLY C C 62 173.837 173.837 173.506 0.331 18387 6969 1 9 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.407 1.643 18387 6970 1 9 . 1 1 63 63 PHE N N 63 120.476 120.476 120.035 0.441 18387 6971 1 9 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.755 0.278 18387 6972 1 9 . 1 1 63 63 PHE C C 63 173.613 173.613 173.368 0.245 18387 6973 1 9 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.539 -0.689 18387 6974 1 9 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.998 -0.323 18387 6975 1 9 . 1 1 63 63 PHE H H 63 7.413 7.413 7.623 -0.210 18387 6976 1 9 . 1 1 64 64 THR N N 64 119.903 119.903 119.213 0.690 18387 6977 1 9 . 1 1 64 64 THR HA H 64 4.097 4.097 4.716 -0.619 18387 6978 1 9 . 1 1 64 64 THR C C 64 170.397 170.397 172.426 -2.029 18387 6979 1 9 . 1 1 64 64 THR CA C 64 60.261 60.261 59.890 0.371 18387 6980 1 9 . 1 1 64 64 THR CB C 64 69.507 69.507 71.685 -2.178 18387 6981 1 9 . 1 1 64 64 THR H H 64 7.665 7.665 8.516 -0.851 18387 6982 1 9 . 1 1 65 65 ILE N N 65 117.277 117.277 125.874 -8.597 18387 6983 1 9 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.066 0.410 18387 6984 1 9 . 1 1 65 65 ILE C C 65 173.056 173.056 175.202 -2.146 18387 6985 1 9 . 1 1 65 65 ILE CA C 65 59.708 59.708 61.152 -1.444 18387 6986 1 9 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.058 1.787 18387 6987 1 9 . 1 1 65 65 ILE H H 65 7.321 7.321 8.536 -1.215 18387 6988 1 9 . 1 1 66 66 TYR N N 66 131.968 131.968 130.707 1.261 18387 6989 1 9 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.922 0.325 18387 6990 1 9 . 1 1 66 66 TYR C C 66 174.074 174.074 175.167 -1.093 18387 6991 1 9 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.074 -0.109 18387 6992 1 9 . 1 1 66 66 TYR CB C 66 41.117 41.117 38.180 2.937 18387 6993 1 9 . 1 1 66 66 TYR H H 66 9.038 9.038 9.185 -0.147 18387 6994 1 9 . 1 1 67 67 GLY N N 67 114.364 114.364 116.089 -1.725 18387 6995 1 9 . 1 1 67 67 GLY C C 67 172.461 172.461 172.671 -0.210 18387 6996 1 9 . 1 1 67 67 GLY CA C 67 45.000 45.000 45.001 -0.001 18387 6997 1 9 . 1 1 67 67 GLY H H 67 9.188 9.188 9.131 0.057 18387 6998 1 9 . 1 1 68 68 VAL N N 68 126.938 126.938 127.686 -0.748 18387 6999 1 9 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.382 -0.246 18387 7000 1 9 . 1 1 68 68 VAL C C 68 173.822 173.822 174.437 -0.615 18387 7001 1 9 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.078 0.421 18387 7002 1 9 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.146 1.412 18387 7003 1 9 . 1 1 68 68 VAL H H 68 9.309 9.309 9.027 0.282 18387 7004 1 9 . 1 1 69 69 SER N N 69 118.813 118.813 121.490 -2.677 18387 7005 1 9 . 1 1 69 69 SER HA H 69 5.527 5.527 5.393 0.134 18387 7006 1 9 . 1 1 69 69 SER C C 69 175.753 175.753 173.385 2.368 18387 7007 1 9 . 1 1 69 69 SER CA C 69 54.407 54.407 55.136 -0.729 18387 7008 1 9 . 1 1 69 69 SER CB C 69 63.630 63.630 64.901 -1.271 18387 7009 1 9 . 1 1 69 69 SER H H 69 8.124 8.124 8.337 -0.213 18387 7010 1 9 . 1 1 70 70 THR N N 70 113.861 113.861 117.763 -3.902 18387 7011 1 9 . 1 1 70 70 THR HA H 70 4.381 4.381 4.491 -0.110 18387 7012 1 9 . 1 1 70 70 THR C C 70 175.001 175.001 173.169 1.832 18387 7013 1 9 . 1 1 70 70 THR CA C 70 60.259 60.259 59.451 0.808 18387 7014 1 9 . 1 1 70 70 THR CB C 70 67.291 67.291 68.760 -1.469 18387 7015 1 9 . 1 1 70 70 THR H H 70 7.656 7.656 8.040 -0.384 18387 7016 1 9 . 1 1 71 71 ASP N N 71 125.133 125.133 124.598 0.535 18387 7017 1 9 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.370 -0.300 18387 7018 1 9 . 1 1 71 71 ASP C C 71 175.685 175.685 176.194 -0.509 18387 7019 1 9 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.802 1.810 18387 7020 1 9 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.586 0.783 18387 7021 1 9 . 1 1 71 71 ASP H H 71 8.931 8.931 7.387 1.544 18387 7022 1 9 . 1 1 72 72 ARG N N 72 118.814 118.814 119.772 -0.958 18387 7023 1 9 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.193 0.002 18387 7024 1 9 . 1 1 72 72 ARG C C 72 177.300 177.300 176.075 1.225 18387 7025 1 9 . 1 1 72 72 ARG CA C 72 56.809 56.809 56.473 0.336 18387 7026 1 9 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.301 0.810 18387 7027 1 9 . 1 1 72 72 ARG H H 72 8.057 8.057 8.535 -0.478 18387 7028 1 9 . 1 1 73 73 ARG N N 73 118.174 118.174 117.516 0.658 18387 7029 1 9 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.602 0.152 18387 7030 1 9 . 1 1 73 73 ARG C C 73 176.503 176.503 175.486 1.017 18387 7031 1 9 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.439 0.097 18387 7032 1 9 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.415 -2.387 18387 7033 1 9 . 1 1 73 73 ARG H H 73 8.639 8.639 7.431 1.208 18387 7034 1 9 . 1 1 74 74 GLU N N 74 127.609 127.609 123.423 4.186 18387 7035 1 9 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.218 -0.139 18387 7036 1 9 . 1 1 74 74 GLU C C 74 178.107 178.107 177.820 0.287 18387 7037 1 9 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.924 -0.139 18387 7038 1 9 . 1 1 74 74 GLU CB C 74 30.098 30.098 30.016 0.082 18387 7039 1 9 . 1 1 74 74 GLU H H 74 9.129 9.129 9.067 0.062 18387 7040 1 9 . 1 1 75 75 GLU N N 75 117.874 117.874 119.496 -1.622 18387 7041 1 9 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.113 -0.013 18387 7042 1 9 . 1 1 75 75 GLU C C 75 178.993 178.993 178.683 0.310 18387 7043 1 9 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.943 0.184 18387 7044 1 9 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.956 0.336 18387 7045 1 9 . 1 1 75 75 GLU H H 75 9.745 9.745 8.869 0.876 18387 7046 1 9 . 1 1 76 76 ASP N N 76 119.182 119.182 119.473 -0.291 18387 7047 1 9 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.529 -0.164 18387 7048 1 9 . 1 1 76 76 ASP C C 76 178.107 178.107 178.057 0.050 18387 7049 1 9 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.666 -0.693 18387 7050 1 9 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.517 0.003 18387 7051 1 9 . 1 1 76 76 ASP H H 76 7.004 7.004 8.409 -1.405 18387 7052 1 9 . 1 1 77 77 TRP N N 77 123.008 123.008 123.232 -0.224 18387 7053 1 9 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.507 -0.358 18387 7054 1 9 . 1 1 77 77 TRP C C 77 176.236 176.236 178.249 -2.013 18387 7055 1 9 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.712 -0.230 18387 7056 1 9 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.200 -0.665 18387 7057 1 9 . 1 1 77 77 TRP H H 77 7.112 7.112 7.959 -0.847 18387 7058 1 9 . 1 1 78 78 LYS N N 78 115.727 115.727 118.247 -2.520 18387 7059 1 9 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.481 -0.236 18387 7060 1 9 . 1 1 78 78 LYS C C 78 179.426 179.426 178.861 0.565 18387 7061 1 9 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.271 1.161 18387 7062 1 9 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.834 0.911 18387 7063 1 9 . 1 1 78 78 LYS H H 78 8.431 8.431 8.440 -0.009 18387 7064 1 9 . 1 1 79 79 LYS N N 79 118.321 118.321 119.854 -1.533 18387 7065 1 9 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.974 0.046 18387 7066 1 9 . 1 1 79 79 LYS C C 79 178.239 178.239 178.582 -0.343 18387 7067 1 9 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.431 -0.364 18387 7068 1 9 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.511 -0.048 18387 7069 1 9 . 1 1 79 79 LYS H H 79 7.690 7.690 7.893 -0.203 18387 7070 1 9 . 1 1 80 80 ALA N N 80 120.679 120.679 121.917 -1.238 18387 7071 1 9 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.291 -0.136 18387 7072 1 9 . 1 1 80 80 ALA C C 80 178.811 178.811 179.820 -1.009 18387 7073 1 9 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.147 -0.060 18387 7074 1 9 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.601 0.157 18387 7075 1 9 . 1 1 80 80 ALA H H 80 7.560 7.560 8.297 -0.737 18387 7076 1 9 . 1 1 81 81 ILE N N 81 118.019 118.019 119.019 -1.000 18387 7077 1 9 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.598 -0.196 18387 7078 1 9 . 1 1 81 81 ILE C C 81 178.113 178.113 178.197 -0.084 18387 7079 1 9 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.488 0.032 18387 7080 1 9 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.663 0.541 18387 7081 1 9 . 1 1 81 81 ILE H H 81 7.514 7.514 7.888 -0.374 18387 7082 1 9 . 1 1 82 82 GLU N N 82 117.252 117.252 119.975 -2.723 18387 7083 1 9 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.902 0.192 18387 7084 1 9 . 1 1 82 82 GLU C C 82 179.558 179.558 178.148 1.410 18387 7085 1 9 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.516 0.064 18387 7086 1 9 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.138 0.245 18387 7087 1 9 . 1 1 82 82 GLU H H 82 7.401 7.401 7.594 -0.193 18387 7088 1 9 . 1 1 83 83 GLU N N 83 119.340 119.340 118.614 0.726 18387 7089 1 9 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.037 -0.139 18387 7090 1 9 . 1 1 83 83 GLU C C 83 178.740 178.740 178.127 0.613 18387 7091 1 9 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.728 0.271 18387 7092 1 9 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.863 0.058 18387 7093 1 9 . 1 1 83 83 GLU H H 83 8.191 8.191 8.060 0.131 18387 7094 1 9 . 1 1 84 84 ASP N N 84 118.449 118.449 114.587 3.862 18387 7095 1 9 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.614 -0.340 18387 7096 1 9 . 1 1 84 84 ASP C C 84 175.597 175.597 174.743 0.854 18387 7097 1 9 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.108 0.939 18387 7098 1 9 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.203 -1.307 18387 7099 1 9 . 1 1 84 84 ASP H H 84 8.252 8.252 7.714 0.538 18387 7100 1 9 . 1 1 85 85 LYS N N 85 116.410 116.410 116.107 0.303 18387 7101 1 9 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.326 -0.153 18387 7102 1 9 . 1 1 85 85 LYS C C 85 176.856 176.856 175.344 1.512 18387 7103 1 9 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.615 -0.642 18387 7104 1 9 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.085 -0.217 18387 7105 1 9 . 1 1 85 85 LYS H H 85 7.890 7.890 7.628 0.262 18387 7106 1 9 . 1 1 86 86 SER N N 86 112.295 112.295 113.753 -1.458 18387 7107 1 9 . 1 1 86 86 SER HA H 86 3.139 3.139 3.598 -0.459 18387 7108 1 9 . 1 1 86 86 SER C C 86 175.805 175.805 172.879 2.926 18387 7109 1 9 . 1 1 86 86 SER CA C 86 53.637 53.637 56.951 -3.314 18387 7110 1 9 . 1 1 86 86 SER CB C 86 60.736 60.736 61.296 -0.560 18387 7111 1 9 . 1 1 86 86 SER H H 86 7.327 7.327 7.356 -0.029 18387 7112 1 9 . 1 1 87 87 TYR N N 87 120.962 120.962 125.329 -4.367 18387 7113 1 9 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.159 0.146 18387 7114 1 9 . 1 1 87 87 TYR C C 87 177.064 177.064 174.383 2.681 18387 7115 1 9 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.875 -0.652 18387 7116 1 9 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.105 -0.752 18387 7117 1 9 . 1 1 87 87 TYR H H 87 6.933 6.933 7.542 -0.609 18387 7118 1 9 . 1 1 88 88 TRP N N 88 118.597 118.597 122.102 -3.505 18387 7119 1 9 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.734 0.117 18387 7120 1 9 . 1 1 88 88 TRP C C 88 175.456 175.456 174.482 0.974 18387 7121 1 9 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.771 1.465 18387 7122 1 9 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.216 -3.489 18387 7123 1 9 . 1 1 88 88 TRP H H 88 6.552 6.552 7.067 -0.515 18387 7124 1 9 . 1 1 89 89 ASN N N 89 118.067 118.067 121.044 -2.977 18387 7125 1 9 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.821 0.228 18387 7126 1 9 . 1 1 89 89 ASN C C 89 173.773 173.773 174.961 -1.188 18387 7127 1 9 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.247 1.209 18387 7128 1 9 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.093 1.104 18387 7129 1 9 . 1 1 89 89 ASN H H 89 7.864 7.864 8.800 -0.936 18387 7130 1 9 . 1 1 90 90 GLN N N 90 125.392 125.392 122.060 3.332 18387 7131 1 9 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.496 0.001 18387 7132 1 9 . 1 1 90 90 GLN C C 90 176.491 176.491 175.193 1.298 18387 7133 1 9 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.886 0.574 18387 7134 1 9 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.457 -2.230 18387 7135 1 9 . 1 1 90 90 GLN H H 90 7.904 7.904 8.388 -0.484 18387 7136 1 9 . 1 1 91 91 VAL N N 91 114.434 114.434 115.105 -0.671 18387 7137 1 9 . 1 1 91 91 VAL HA H 91 5.480 5.480 5.082 0.398 18387 7138 1 9 . 1 1 91 91 VAL C C 91 174.248 174.248 172.705 1.543 18387 7139 1 9 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.176 -0.170 18387 7140 1 9 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.696 0.942 18387 7141 1 9 . 1 1 91 91 VAL H H 91 9.585 9.585 9.188 0.397 18387 7142 1 9 . 1 1 92 92 LEU N N 92 126.910 126.910 122.733 4.177 18387 7143 1 9 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.334 -0.265 18387 7144 1 9 . 1 1 92 92 LEU C C 92 177.696 177.696 175.695 2.001 18387 7145 1 9 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.072 0.772 18387 7146 1 9 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.889 -0.943 18387 7147 1 9 . 1 1 92 92 LEU H H 92 8.941 8.941 8.308 0.633 18387 7148 1 9 . 1 1 93 93 LEU N N 93 125.673 125.673 127.197 -1.524 18387 7149 1 9 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.145 0.255 18387 7150 1 9 . 1 1 93 93 LEU C C 93 177.291 177.291 176.898 0.393 18387 7151 1 9 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.760 -0.809 18387 7152 1 9 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.860 1.319 18387 7153 1 9 . 1 1 93 93 LEU H H 93 8.038 8.038 8.224 -0.186 18387 7154 1 9 . 1 1 94 94 GLN N N 94 122.206 122.206 121.590 0.616 18387 7155 1 9 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.284 -0.047 18387 7156 1 9 . 1 1 94 94 GLN C C 94 178.246 178.246 176.764 1.482 18387 7157 1 9 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.565 0.210 18387 7158 1 9 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.639 -0.384 18387 7159 1 9 . 1 1 94 94 GLN H H 94 9.298 9.298 8.031 1.267 18387 7160 1 9 . 1 1 95 95 LYS N N 95 122.668 122.668 121.676 0.992 18387 7161 1 9 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.925 0.041 18387 7162 1 9 . 1 1 95 95 LYS C C 95 178.787 178.787 176.931 1.856 18387 7163 1 9 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.492 0.580 18387 7164 1 9 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.046 0.419 18387 7165 1 9 . 1 1 95 95 LYS H H 95 8.645 8.645 8.842 -0.197 18387 7166 1 9 . 1 1 96 96 ASP N N 96 116.775 116.775 118.412 -1.637 18387 7167 1 9 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.650 -0.070 18387 7168 1 9 . 1 1 96 96 ASP C C 96 176.220 176.220 177.922 -1.702 18387 7169 1 9 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.653 -0.307 18387 7170 1 9 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.469 0.088 18387 7171 1 9 . 1 1 96 96 ASP H H 96 8.606 8.606 8.189 0.417 18387 7172 1 9 . 1 1 97 97 ASP N N 97 118.213 118.213 120.983 -2.770 18387 7173 1 9 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.384 0.543 18387 7174 1 9 . 1 1 97 97 ASP C C 97 176.954 176.954 178.128 -1.174 18387 7175 1 9 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.049 -1.690 18387 7176 1 9 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.831 1.493 18387 7177 1 9 . 1 1 97 97 ASP H H 97 7.988 7.988 8.137 -0.149 18387 7178 1 9 . 1 1 98 98 VAL N N 98 118.907 118.907 119.285 -0.378 18387 7179 1 9 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.476 -0.060 18387 7180 1 9 . 1 1 98 98 VAL C C 98 176.470 176.470 177.791 -1.321 18387 7181 1 9 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.343 1.435 18387 7182 1 9 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.587 0.804 18387 7183 1 9 . 1 1 98 98 VAL H H 98 7.098 7.098 8.529 -1.431 18387 7184 1 9 . 1 1 99 99 LYS N N 99 117.909 117.909 118.917 -1.008 18387 7185 1 9 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.894 0.049 18387 7186 1 9 . 1 1 99 99 LYS C C 99 178.762 178.762 178.537 0.225 18387 7187 1 9 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.619 0.526 18387 7188 1 9 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.992 0.020 18387 7189 1 9 . 1 1 99 99 LYS H H 99 8.304 8.304 7.365 0.939 18387 7190 1 9 . 1 1 100 100 ASP N N 100 117.843 117.843 119.311 -1.468 18387 7191 1 9 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.343 0.135 18387 7192 1 9 . 1 1 100 100 ASP C C 100 179.694 179.694 178.416 1.278 18387 7193 1 9 . 1 1 100 100 ASP CA C 100 57.526 57.526 56.949 0.577 18387 7194 1 9 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.955 -0.127 18387 7195 1 9 . 1 1 100 100 ASP H H 100 8.024 8.024 7.422 0.602 18387 7196 1 9 . 1 1 101 101 VAL N N 101 122.202 122.202 120.112 2.090 18387 7197 1 9 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.470 0.525 18387 7198 1 9 . 1 1 101 101 VAL C C 101 178.533 178.533 178.446 0.087 18387 7199 1 9 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.332 0.670 18387 7200 1 9 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.375 0.662 18387 7201 1 9 . 1 1 101 101 VAL H H 101 8.205 8.205 7.756 0.449 18387 7202 1 9 . 1 1 102 102 LEU N N 102 118.798 118.798 119.074 -0.276 18387 7203 1 9 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.686 0.094 18387 7204 1 9 . 1 1 102 102 LEU C C 102 180.254 180.254 178.951 1.303 18387 7205 1 9 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.032 0.909 18387 7206 1 9 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.412 -0.973 18387 7207 1 9 . 1 1 102 102 LEU H H 102 8.422 8.422 7.653 0.769 18387 7208 1 9 . 1 1 103 103 GLU N N 103 116.915 116.915 119.600 -2.685 18387 7209 1 9 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.876 0.259 18387 7210 1 9 . 1 1 103 103 GLU C C 103 180.910 180.910 179.297 1.613 18387 7211 1 9 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.926 0.477 18387 7212 1 9 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.168 0.563 18387 7213 1 9 . 1 1 103 103 GLU H H 103 8.262 8.262 7.771 0.491 18387 7214 1 9 . 1 1 104 104 SER N N 104 117.866 117.866 116.176 1.690 18387 7215 1 9 . 1 1 104 104 SER HA H 104 4.216 4.216 4.035 0.181 18387 7216 1 9 . 1 1 104 104 SER C C 104 175.455 175.455 176.597 -1.142 18387 7217 1 9 . 1 1 104 104 SER CA C 104 62.019 62.019 61.888 0.131 18387 7218 1 9 . 1 1 104 104 SER CB C 104 62.891 62.891 63.091 -0.200 18387 7219 1 9 . 1 1 104 104 SER H H 104 8.544 8.544 8.427 0.117 18387 7220 1 9 . 1 1 105 105 TYR N N 105 117.278 117.278 118.511 -1.233 18387 7221 1 9 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.375 -0.103 18387 7222 1 9 . 1 1 105 105 TYR C C 105 174.750 174.750 175.203 -0.453 18387 7223 1 9 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.002 1.857 18387 7224 1 9 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.340 2.371 18387 7225 1 9 . 1 1 105 105 TYR H H 105 7.691 7.691 7.377 0.314 18387 7226 1 9 . 1 1 106 106 CYS N N 106 116.897 116.897 115.706 1.191 18387 7227 1 9 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.030 -0.135 18387 7228 1 9 . 1 1 106 106 CYS C C 106 174.056 174.056 173.607 0.449 18387 7229 1 9 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.007 -0.397 18387 7230 1 9 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.570 0.462 18387 7231 1 9 . 1 1 106 106 CYS H H 106 7.862 7.862 8.287 -0.425 18387 7232 1 9 . 1 1 107 107 ILE N N 107 118.885 118.885 120.727 -1.842 18387 7233 1 9 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.666 -0.327 18387 7234 1 9 . 1 1 107 107 ILE C C 107 176.793 176.793 175.068 1.725 18387 7235 1 9 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.770 1.975 18387 7236 1 9 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.013 1.066 18387 7237 1 9 . 1 1 107 107 ILE H H 107 7.707 7.707 7.726 -0.019 18387 7238 1 9 . 1 1 108 108 VAL N N 108 123.983 123.983 124.834 -0.851 18387 7239 1 9 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.111 0.163 18387 7240 1 9 . 1 1 108 108 VAL C C 108 175.476 175.476 175.978 -0.502 18387 7241 1 9 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.750 -0.126 18387 7242 1 9 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.052 0.956 18387 7243 1 9 . 1 1 108 108 VAL H H 108 8.656 8.656 8.030 0.626 18387 7244 1 9 . 1 1 109 109 GLY N N 109 110.120 110.120 108.532 1.588 18387 7245 1 9 . 1 1 109 109 GLY C C 109 169.982 169.982 172.423 -2.441 18387 7246 1 9 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.994 -0.391 18387 7247 1 9 . 1 1 109 109 GLY H H 109 7.500 7.500 7.246 0.254 18387 7248 1 9 . 1 1 110 110 PHE N N 110 115.276 115.276 119.518 -4.242 18387 7249 1 9 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.118 -0.344 18387 7250 1 9 . 1 1 110 110 PHE C C 110 174.361 174.361 173.854 0.507 18387 7251 1 9 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.270 0.417 18387 7252 1 9 . 1 1 110 110 PHE CB C 110 41.951 41.951 42.151 -0.201 18387 7253 1 9 . 1 1 110 110 PHE H H 110 8.203 8.203 8.519 -0.316 18387 7254 1 9 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.111 0.248 18387 7255 1 9 . 1 1 111 111 PRO C C 111 175.691 175.691 175.623 0.068 18387 7256 1 9 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.754 0.403 18387 7257 1 9 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.264 2.040 18387 7258 1 9 . 1 1 112 112 HIS N N 112 123.708 123.708 123.058 0.650 18387 7259 1 9 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.885 0.078 18387 7260 1 9 . 1 1 112 112 HIS C C 112 173.649 173.649 174.020 -0.371 18387 7261 1 9 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.377 1.697 18387 7262 1 9 . 1 1 112 112 HIS CB C 112 32.197 32.197 31.742 0.455 18387 7263 1 9 . 1 1 112 112 HIS H H 112 8.952 8.952 8.356 0.596 18387 7264 1 9 . 1 1 113 113 ILE N N 113 128.596 128.596 127.235 1.361 18387 7265 1 9 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.086 0.611 18387 7266 1 9 . 1 1 113 113 ILE C C 113 176.130 176.130 174.565 1.565 18387 7267 1 9 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.858 1.137 18387 7268 1 9 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.868 -1.813 18387 7269 1 9 . 1 1 113 113 ILE H H 113 8.808 8.808 8.567 0.241 18387 7270 1 9 . 1 1 114 114 ILE N N 114 119.668 119.668 121.536 -1.868 18387 7271 1 9 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.907 0.066 18387 7272 1 9 . 1 1 114 114 ILE C C 114 173.186 173.186 173.351 -0.165 18387 7273 1 9 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.898 -0.168 18387 7274 1 9 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.047 0.493 18387 7275 1 9 . 1 1 114 114 ILE H H 114 8.721 8.721 8.935 -0.214 18387 7276 1 9 . 1 1 115 115 LEU N N 115 122.770 122.770 126.686 -3.916 18387 7277 1 9 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.309 -0.034 18387 7278 1 9 . 1 1 115 115 LEU C C 115 173.601 173.601 174.812 -1.211 18387 7279 1 9 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.195 0.587 18387 7280 1 9 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.283 1.851 18387 7281 1 9 . 1 1 115 115 LEU H H 115 8.665 8.665 9.037 -0.372 18387 7282 1 9 . 1 1 116 116 VAL N N 116 130.411 130.411 127.346 3.065 18387 7283 1 9 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.057 -0.199 18387 7284 1 9 . 1 1 116 116 VAL C C 116 174.565 174.565 175.292 -0.727 18387 7285 1 9 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.399 0.405 18387 7286 1 9 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.433 -0.518 18387 7287 1 9 . 1 1 116 116 VAL H H 116 9.472 9.472 9.363 0.109 18387 7288 1 9 . 1 1 117 117 ASP N N 117 127.896 127.896 126.583 1.313 18387 7289 1 9 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.914 -0.522 18387 7290 1 9 . 1 1 117 117 ASP C C 117 176.567 176.567 175.046 1.521 18387 7291 1 9 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.912 0.688 18387 7292 1 9 . 1 1 117 117 ASP CB C 117 40.584 40.584 41.028 -0.444 18387 7293 1 9 . 1 1 117 117 ASP H H 117 9.429 9.429 8.228 1.201 18387 7294 1 9 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.277 -0.083 18387 7295 1 9 . 1 1 118 118 PRO C C 118 177.534 177.534 178.234 -0.700 18387 7296 1 9 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.418 -0.253 18387 7297 1 9 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.902 0.910 18387 7298 1 9 . 1 1 119 119 GLU N N 119 114.015 114.015 116.113 -2.098 18387 7299 1 9 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.165 0.174 18387 7300 1 9 . 1 1 119 119 GLU C C 119 176.722 176.722 177.079 -0.357 18387 7301 1 9 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.242 -1.603 18387 7302 1 9 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.325 0.252 18387 7303 1 9 . 1 1 119 119 GLU H H 119 7.733 7.733 8.110 -0.377 18387 7304 1 9 . 1 1 120 120 GLY N N 120 108.218 108.218 105.968 2.250 18387 7305 1 9 . 1 1 120 120 GLY C C 120 174.110 174.110 173.254 0.856 18387 7306 1 9 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.858 0.538 18387 7307 1 9 . 1 1 120 120 GLY H H 120 8.588 8.588 8.452 0.136 18387 7308 1 9 . 1 1 121 121 LYS N N 121 121.778 121.778 120.089 1.689 18387 7309 1 9 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.194 -0.335 18387 7310 1 9 . 1 1 121 121 LYS C C 121 176.458 176.458 176.107 0.351 18387 7311 1 9 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.145 0.817 18387 7312 1 9 . 1 1 121 121 LYS CB C 121 33.452 33.452 34.593 -1.141 18387 7313 1 9 . 1 1 121 121 LYS H H 121 8.600 8.600 9.205 -0.605 18387 7314 1 9 . 1 1 122 122 ILE N N 122 122.058 122.058 124.275 -2.217 18387 7315 1 9 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.330 -0.058 18387 7316 1 9 . 1 1 122 122 ILE C C 122 177.084 177.084 176.229 0.855 18387 7317 1 9 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.132 0.687 18387 7318 1 9 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.759 1.889 18387 7319 1 9 . 1 1 122 122 ILE H H 122 9.006 9.006 8.650 0.356 18387 7320 1 9 . 1 1 123 123 VAL N N 123 120.561 120.561 128.320 -7.759 18387 7321 1 9 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.067 0.688 18387 7322 1 9 . 1 1 123 123 VAL C C 123 175.584 175.584 175.067 0.517 18387 7323 1 9 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.753 -2.602 18387 7324 1 9 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.753 0.648 18387 7325 1 9 . 1 1 123 123 VAL H H 123 9.054 9.054 8.200 0.854 18387 7326 1 9 . 1 1 124 124 ALA N N 124 121.102 121.102 120.781 0.321 18387 7327 1 9 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.785 -0.128 18387 7328 1 9 . 1 1 124 124 ALA C C 124 174.832 174.832 175.051 -0.219 18387 7329 1 9 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.092 1.368 18387 7330 1 9 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.310 1.520 18387 7331 1 9 . 1 1 124 124 ALA H H 124 7.793 7.793 7.509 0.284 18387 7332 1 9 . 1 1 125 125 LYS N N 125 117.637 117.637 120.597 -2.960 18387 7333 1 9 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.787 0.246 18387 7334 1 9 . 1 1 125 125 LYS C C 125 173.417 173.417 175.087 -1.670 18387 7335 1 9 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.887 -0.746 18387 7336 1 9 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.842 0.809 18387 7337 1 9 . 1 1 125 125 LYS H H 125 8.872 8.872 8.098 0.774 18387 7338 1 9 . 1 1 126 126 GLU N N 126 115.236 115.236 115.293 -0.057 18387 7339 1 9 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.811 0.187 18387 7340 1 9 . 1 1 126 126 GLU C C 126 175.998 175.998 175.931 0.067 18387 7341 1 9 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.640 -0.678 18387 7342 1 9 . 1 1 126 126 GLU CB C 126 26.435 26.435 28.048 -1.613 18387 7343 1 9 . 1 1 126 126 GLU H H 126 7.941 7.941 8.768 -0.827 18387 7344 1 9 . 1 1 127 127 LEU N N 127 118.584 118.584 118.665 -0.081 18387 7345 1 9 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.295 0.087 18387 7346 1 9 . 1 1 127 127 LEU C C 127 176.766 176.766 177.399 -0.633 18387 7347 1 9 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.267 -0.658 18387 7348 1 9 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.312 1.651 18387 7349 1 9 . 1 1 127 127 LEU H H 127 7.300 7.300 7.535 -0.235 18387 7350 1 9 . 1 1 128 128 ARG N N 128 118.625 118.625 119.935 -1.310 18387 7351 1 9 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.522 -0.047 18387 7352 1 9 . 1 1 128 128 ARG C C 128 177.113 177.113 177.195 -0.082 18387 7353 1 9 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.679 -0.289 18387 7354 1 9 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.234 2.378 18387 7355 1 9 . 1 1 128 128 ARG H H 128 7.929 7.929 8.129 -0.200 18387 7356 1 9 . 1 1 129 129 GLY N N 129 114.010 114.010 109.527 4.483 18387 7357 1 9 . 1 1 129 129 GLY C C 129 175.931 175.931 175.607 0.324 18387 7358 1 9 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.390 -1.929 18387 7359 1 9 . 1 1 129 129 GLY H H 129 10.649 10.649 9.161 1.488 18387 7360 1 9 . 1 1 130 130 ASP N N 130 123.975 123.975 119.986 3.989 18387 7361 1 9 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.430 0.102 18387 7362 1 9 . 1 1 130 130 ASP C C 130 177.507 177.507 177.476 0.031 18387 7363 1 9 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.592 -0.219 18387 7364 1 9 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.774 0.129 18387 7365 1 9 . 1 1 130 130 ASP H H 130 8.540 8.540 8.132 0.408 18387 7366 1 9 . 1 1 131 131 ASP N N 131 116.806 116.806 120.547 -3.741 18387 7367 1 9 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.335 0.235 18387 7368 1 9 . 1 1 131 131 ASP C C 131 179.038 179.038 178.082 0.956 18387 7369 1 9 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.895 0.088 18387 7370 1 9 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.641 0.293 18387 7371 1 9 . 1 1 131 131 ASP H H 131 7.907 7.907 8.198 -0.291 18387 7372 1 9 . 1 1 132 132 LEU N N 132 123.869 123.869 120.768 3.101 18387 7373 1 9 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.807 -0.016 18387 7374 1 9 . 1 1 132 132 LEU C C 132 176.343 176.343 178.619 -2.276 18387 7375 1 9 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.313 1.471 18387 7376 1 9 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.637 0.131 18387 7377 1 9 . 1 1 132 132 LEU H H 132 7.542 7.542 8.490 -0.948 18387 7378 1 9 . 1 1 133 133 TYR N N 133 120.042 120.042 119.353 0.689 18387 7379 1 9 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.036 -0.040 18387 7380 1 9 . 1 1 133 133 TYR C C 133 177.426 177.426 177.720 -0.294 18387 7381 1 9 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.273 -0.140 18387 7382 1 9 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.462 0.114 18387 7383 1 9 . 1 1 133 133 TYR H H 133 7.384 7.384 7.664 -0.280 18387 7384 1 9 . 1 1 134 134 ASN N N 134 114.936 114.936 117.164 -2.228 18387 7385 1 9 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.478 -0.075 18387 7386 1 9 . 1 1 134 134 ASN C C 134 178.703 178.703 177.961 0.742 18387 7387 1 9 . 1 1 134 134 ASN CA C 134 55.809 55.809 57.047 -1.238 18387 7388 1 9 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.438 -0.230 18387 7389 1 9 . 1 1 134 134 ASN H H 134 8.399 8.399 8.392 0.007 18387 7390 1 9 . 1 1 135 135 THR N N 135 117.387 117.387 117.682 -0.295 18387 7391 1 9 . 1 1 135 135 THR HA H 135 3.920 3.920 3.729 0.191 18387 7392 1 9 . 1 1 135 135 THR C C 135 175.323 175.323 176.489 -1.166 18387 7393 1 9 . 1 1 135 135 THR CA C 135 67.402 67.402 66.569 0.833 18387 7394 1 9 . 1 1 135 135 THR CB C 135 68.111 68.111 68.810 -0.699 18387 7395 1 9 . 1 1 135 135 THR H H 135 8.265 8.265 8.465 -0.200 18387 7396 1 9 . 1 1 136 136 VAL N N 136 121.207 121.207 120.954 0.253 18387 7397 1 9 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.423 -0.408 18387 7398 1 9 . 1 1 136 136 VAL C C 136 176.457 176.457 177.082 -0.625 18387 7399 1 9 . 1 1 136 136 VAL CA C 136 68.272 68.272 65.792 2.480 18387 7400 1 9 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.344 0.597 18387 7401 1 9 . 1 1 136 136 VAL H H 136 7.595 7.595 8.316 -0.721 18387 7402 1 9 . 1 1 137 137 GLU N N 137 118.266 118.266 120.649 -2.383 18387 7403 1 9 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.991 -1.309 18387 7404 1 9 . 1 1 137 137 GLU C C 137 177.482 177.482 178.648 -1.166 18387 7405 1 9 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.907 0.023 18387 7406 1 9 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.406 0.376 18387 7407 1 9 . 1 1 137 137 GLU H H 137 8.114 8.114 8.279 -0.165 18387 7408 1 9 . 1 1 138 138 LYS N N 138 116.431 116.431 118.575 -2.144 18387 7409 1 9 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.995 -0.227 18387 7410 1 9 . 1 1 138 138 LYS C C 138 179.193 179.193 178.497 0.696 18387 7411 1 9 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.598 0.442 18387 7412 1 9 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.887 0.271 18387 7413 1 9 . 1 1 138 138 LYS H H 138 7.133 7.133 7.871 -0.738 18387 7414 1 9 . 1 1 139 139 PHE N N 139 116.336 116.336 117.748 -1.412 18387 7415 1 9 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.368 -0.358 18387 7416 1 9 . 1 1 139 139 PHE C C 139 177.855 177.855 177.426 0.429 18387 7417 1 9 . 1 1 139 139 PHE CA C 139 62.384 62.384 59.012 3.372 18387 7418 1 9 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.465 -0.113 18387 7419 1 9 . 1 1 139 139 PHE H H 139 7.338 7.338 7.272 0.066 18387 7420 1 9 . 1 1 140 140 VAL N N 140 116.491 116.491 116.482 0.009 18387 7421 1 9 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.524 0.000 18387 7422 1 9 . 1 1 140 140 VAL C C 140 177.747 177.747 177.351 0.396 18387 7423 1 9 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.729 0.513 18387 7424 1 9 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.703 -0.313 18387 7425 1 9 . 1 1 140 140 VAL H H 140 8.332 8.332 8.214 0.118 18387 7426 1 9 . 1 1 141 141 ASN N N 141 116.956 116.956 116.819 0.137 18387 7427 1 9 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.650 0.176 18387 7428 1 9 . 1 1 141 141 ASN C C 141 176.997 176.997 176.831 0.166 18387 7429 1 9 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.019 -1.341 18387 7430 1 9 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.556 -1.107 18387 7431 1 9 . 1 1 141 141 ASN H H 141 7.862 7.862 7.929 -0.067 18387 7432 1 9 . 1 1 142 142 GLY N N 142 107.938 107.938 108.797 -0.859 18387 7433 1 9 . 1 1 142 142 GLY C C 142 174.336 174.336 172.998 1.338 18387 7434 1 9 . 1 1 142 142 GLY CA C 142 45.985 45.985 46.162 -0.177 18387 7435 1 9 . 1 1 142 142 GLY H H 142 7.466 7.466 7.719 -0.253 18387 7436 1 9 . 1 1 143 143 ALA N N 143 123.441 123.441 124.224 -0.783 18387 7437 1 9 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.728 -0.387 18387 7438 1 9 . 1 1 143 143 ALA C C 143 178.212 178.212 176.609 1.603 18387 7439 1 9 . 1 1 143 143 ALA CA C 143 52.826 52.826 50.716 2.110 18387 7440 1 9 . 1 1 143 143 ALA CB C 143 19.244 19.244 20.519 -1.275 18387 7441 1 9 . 1 1 143 143 ALA H H 143 7.950 7.950 8.353 -0.403 18387 7442 1 9 . 1 1 144 144 LYS N N 144 120.149 120.149 122.419 -2.270 18387 7443 1 9 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.613 -0.318 18387 7444 1 9 . 1 1 144 144 LYS C C 144 176.945 176.945 177.364 -0.419 18387 7445 1 9 . 1 1 144 144 LYS CA C 144 56.519 56.519 57.019 -0.500 18387 7446 1 9 . 1 1 144 144 LYS CB C 144 33.030 33.030 33.252 -0.222 18387 7447 1 9 . 1 1 144 144 LYS H H 144 8.187 8.187 8.652 -0.465 18387 7448 1 9 . 1 1 145 145 GLU N N 145 120.992 120.992 123.170 -2.178 18387 7449 1 9 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.312 -0.017 18387 7450 1 9 . 1 1 145 145 GLU C C 145 177.116 177.116 176.852 0.264 18387 7451 1 9 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.737 0.166 18387 7452 1 9 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.945 1.297 18387 7453 1 9 . 1 1 145 145 GLU H H 145 8.363 8.363 8.570 -0.207 18387 7454 1 9 . 1 1 146 146 GLY N N 146 109.467 109.467 108.962 0.505 18387 7455 1 9 . 1 1 146 146 GLY C C 146 174.108 174.108 173.789 0.319 18387 7456 1 9 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.358 1.043 18387 7457 1 9 . 1 1 146 146 GLY H H 146 8.371 8.371 7.843 0.528 18387 7458 1 9 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.570 0.039 18387 7459 1 9 . 1 1 151 151 HIS C C 151 174.258 174.258 174.892 -0.634 18387 7460 1 9 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.634 -0.469 18387 7461 1 9 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.497 0.336 18387 7462 1 10 . 1 1 2 2 SER HA H 2 3.992 3.992 4.802 -0.810 18387 7463 1 10 . 1 1 2 2 SER CA C 2 57.555 57.555 58.488 -0.933 18387 7464 1 10 . 1 1 2 2 SER CB C 2 64.977 64.977 64.959 0.018 18387 7465 1 10 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.451 -0.012 18387 7466 1 10 . 1 1 3 3 LEU C C 3 176.631 176.631 174.910 1.721 18387 7467 1 10 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.396 0.168 18387 7468 1 10 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.799 -1.075 18387 7469 1 10 . 1 1 4 4 ALA N N 4 125.483 125.483 124.170 1.313 18387 7470 1 10 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.710 -0.331 18387 7471 1 10 . 1 1 4 4 ALA C C 4 179.642 179.642 176.368 3.274 18387 7472 1 10 . 1 1 4 4 ALA CA C 4 51.735 51.735 52.333 -0.598 18387 7473 1 10 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.770 -1.018 18387 7474 1 10 . 1 1 4 4 ALA H H 4 8.483 8.483 8.719 -0.236 18387 7475 1 10 . 1 1 5 5 THR HA H 5 3.845 3.845 4.855 -1.010 18387 7476 1 10 . 1 1 5 5 THR C C 5 175.487 175.487 175.866 -0.379 18387 7477 1 10 . 1 1 5 5 THR CA C 5 64.531 64.531 60.432 4.099 18387 7478 1 10 . 1 1 5 5 THR CB C 5 68.108 68.108 70.730 -2.622 18387 7479 1 10 . 1 1 6 6 GLY N N 6 114.298 114.298 114.525 -0.227 18387 7480 1 10 . 1 1 6 6 GLY C C 6 174.324 174.324 174.447 -0.123 18387 7481 1 10 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.645 -0.810 18387 7482 1 10 . 1 1 6 6 GLY H H 6 9.511 9.511 9.170 0.341 18387 7483 1 10 . 1 1 7 7 SER N N 7 115.270 115.270 117.274 -2.004 18387 7484 1 10 . 1 1 7 7 SER HA H 7 4.500 4.500 4.575 -0.075 18387 7485 1 10 . 1 1 7 7 SER C C 7 173.315 173.315 174.087 -0.772 18387 7486 1 10 . 1 1 7 7 SER CA C 7 58.915 58.915 58.024 0.891 18387 7487 1 10 . 1 1 7 7 SER CB C 7 64.308 64.308 64.239 0.069 18387 7488 1 10 . 1 1 7 7 SER H H 7 7.736 7.736 7.646 0.090 18387 7489 1 10 . 1 1 8 8 VAL N N 8 123.708 123.708 123.893 -0.185 18387 7490 1 10 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.114 -0.282 18387 7491 1 10 . 1 1 8 8 VAL C C 8 176.673 176.673 176.044 0.629 18387 7492 1 10 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.717 0.956 18387 7493 1 10 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.015 0.207 18387 7494 1 10 . 1 1 8 8 VAL H H 8 8.632 8.632 8.586 0.046 18387 7495 1 10 . 1 1 9 9 ALA N N 9 133.040 133.040 132.394 0.646 18387 7496 1 10 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.955 -0.692 18387 7497 1 10 . 1 1 9 9 ALA C C 9 175.404 175.404 175.195 0.209 18387 7498 1 10 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.740 1.215 18387 7499 1 10 . 1 1 9 9 ALA CB C 9 18.030 18.030 19.027 -0.997 18387 7500 1 10 . 1 1 9 9 ALA H H 9 8.448 8.448 8.855 -0.407 18387 7501 1 10 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.416 -0.085 18387 7502 1 10 . 1 1 10 10 PRO C C 10 175.071 175.071 176.160 -1.089 18387 7503 1 10 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.316 0.324 18387 7504 1 10 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.248 0.076 18387 7505 1 10 . 1 1 11 11 ALA N N 11 124.172 124.172 124.556 -0.384 18387 7506 1 10 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.296 -0.052 18387 7507 1 10 . 1 1 11 11 ALA C C 11 177.688 177.688 177.057 0.631 18387 7508 1 10 . 1 1 11 11 ALA CA C 11 53.621 53.621 52.010 1.611 18387 7509 1 10 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.089 0.238 18387 7510 1 10 . 1 1 11 11 ALA H H 11 8.221 8.221 8.213 0.008 18387 7511 1 10 . 1 1 12 12 ILE N N 12 117.815 117.815 123.621 -5.806 18387 7512 1 10 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.253 0.075 18387 7513 1 10 . 1 1 12 12 ILE C C 12 175.013 175.013 175.443 -0.430 18387 7514 1 10 . 1 1 12 12 ILE CA C 12 62.166 62.166 59.447 2.719 18387 7515 1 10 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.345 4.945 18387 7516 1 10 . 1 1 12 12 ILE H H 12 7.693 7.693 8.257 -0.564 18387 7517 1 10 . 1 1 13 13 THR N N 13 121.186 121.186 118.951 2.235 18387 7518 1 10 . 1 1 13 13 THR HA H 13 4.840 4.840 5.186 -0.346 18387 7519 1 10 . 1 1 13 13 THR C C 13 172.625 172.625 173.334 -0.709 18387 7520 1 10 . 1 1 13 13 THR CA C 13 62.297 62.297 60.647 1.650 18387 7521 1 10 . 1 1 13 13 THR CB C 13 71.585 71.585 70.881 0.704 18387 7522 1 10 . 1 1 13 13 THR H H 13 8.363 8.363 8.336 0.027 18387 7523 1 10 . 1 1 14 14 GLY N N 14 110.785 110.785 113.302 -2.517 18387 7524 1 10 . 1 1 14 14 GLY C C 14 170.040 170.040 172.307 -2.267 18387 7525 1 10 . 1 1 14 14 GLY CA C 14 44.390 44.390 44.432 -0.042 18387 7526 1 10 . 1 1 14 14 GLY H H 14 7.993 7.993 9.184 -1.191 18387 7527 1 10 . 1 1 15 15 ILE N N 15 119.088 119.088 121.950 -2.862 18387 7528 1 10 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.758 0.367 18387 7529 1 10 . 1 1 15 15 ILE C C 15 176.359 176.359 176.106 0.253 18387 7530 1 10 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.716 -3.102 18387 7531 1 10 . 1 1 15 15 ILE CB C 15 38.639 38.639 37.713 0.926 18387 7532 1 10 . 1 1 15 15 ILE H H 15 7.973 7.973 8.719 -0.746 18387 7533 1 10 . 1 1 16 16 ASP N N 16 126.633 126.633 127.535 -0.902 18387 7534 1 10 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.086 0.763 18387 7535 1 10 . 1 1 16 16 ASP C C 16 179.190 179.190 177.131 2.059 18387 7536 1 10 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.732 0.148 18387 7537 1 10 . 1 1 16 16 ASP CB C 16 42.275 42.275 41.943 0.332 18387 7538 1 10 . 1 1 16 16 ASP H H 16 9.335 9.335 9.008 0.327 18387 7539 1 10 . 1 1 17 17 LEU N N 17 116.648 116.648 118.222 -1.574 18387 7540 1 10 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.245 -0.071 18387 7541 1 10 . 1 1 17 17 LEU C C 17 178.432 178.432 178.277 0.155 18387 7542 1 10 . 1 1 17 17 LEU CA C 17 57.981 57.981 56.671 1.310 18387 7543 1 10 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.837 1.149 18387 7544 1 10 . 1 1 17 17 LEU H H 17 8.071 8.071 8.803 -0.732 18387 7545 1 10 . 1 1 18 18 LYS N N 18 117.401 117.401 117.862 -0.461 18387 7546 1 10 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.294 0.215 18387 7547 1 10 . 1 1 18 18 LYS C C 18 176.793 176.793 177.567 -0.774 18387 7548 1 10 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.254 -1.819 18387 7549 1 10 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.097 -0.034 18387 7550 1 10 . 1 1 18 18 LYS H H 18 8.207 8.207 7.972 0.235 18387 7551 1 10 . 1 1 19 19 GLY N N 19 108.061 108.061 106.298 1.763 18387 7552 1 10 . 1 1 19 19 GLY C C 19 174.649 174.649 173.595 1.054 18387 7553 1 10 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.584 1.013 18387 7554 1 10 . 1 1 19 19 GLY H H 19 8.099 8.099 8.956 -0.857 18387 7555 1 10 . 1 1 20 20 ASN N N 20 121.012 121.012 119.635 1.377 18387 7556 1 10 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.078 -0.173 18387 7557 1 10 . 1 1 20 20 ASN C C 20 174.827 174.827 174.512 0.315 18387 7558 1 10 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.149 0.318 18387 7559 1 10 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.618 -1.942 18387 7560 1 10 . 1 1 20 20 ASN H H 20 8.945 8.945 9.043 -0.098 18387 7561 1 10 . 1 1 21 21 SER N N 21 117.285 117.285 117.283 0.002 18387 7562 1 10 . 1 1 21 21 SER HA H 21 5.000 5.000 4.586 0.414 18387 7563 1 10 . 1 1 21 21 SER C C 21 174.911 174.911 174.398 0.513 18387 7564 1 10 . 1 1 21 21 SER CA C 21 58.730 58.730 58.315 0.415 18387 7565 1 10 . 1 1 21 21 SER CB C 21 63.162 63.162 62.494 0.668 18387 7566 1 10 . 1 1 21 21 SER H H 21 8.740 8.740 8.693 0.047 18387 7567 1 10 . 1 1 22 22 VAL N N 22 128.665 128.665 124.339 4.326 18387 7568 1 10 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.444 -0.064 18387 7569 1 10 . 1 1 22 22 VAL C C 22 176.276 176.276 174.536 1.740 18387 7570 1 10 . 1 1 22 22 VAL CA C 22 62.953 62.953 60.073 2.880 18387 7571 1 10 . 1 1 22 22 VAL CB C 22 35.582 35.582 35.739 -0.157 18387 7572 1 10 . 1 1 22 22 VAL H H 22 9.125 9.125 8.807 0.318 18387 7573 1 10 . 1 1 23 23 SER N N 23 127.457 127.457 117.907 9.550 18387 7574 1 10 . 1 1 23 23 SER HA H 23 5.878 5.878 5.282 0.596 18387 7575 1 10 . 1 1 23 23 SER C C 23 174.436 174.436 176.140 -1.704 18387 7576 1 10 . 1 1 23 23 SER CA C 23 57.101 57.101 56.904 0.197 18387 7577 1 10 . 1 1 23 23 SER CB C 23 66.078 66.078 64.867 1.211 18387 7578 1 10 . 1 1 23 23 SER H H 23 8.971 8.971 8.407 0.564 18387 7579 1 10 . 1 1 24 24 LEU N N 24 126.734 126.734 124.062 2.672 18387 7580 1 10 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.715 -0.248 18387 7581 1 10 . 1 1 24 24 LEU C C 24 179.852 179.852 177.301 2.551 18387 7582 1 10 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.396 0.807 18387 7583 1 10 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.803 0.175 18387 7584 1 10 . 1 1 24 24 LEU H H 24 8.450 8.450 8.686 -0.236 18387 7585 1 10 . 1 1 25 25 ASN N N 25 115.642 115.642 114.218 1.424 18387 7586 1 10 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.367 -0.125 18387 7587 1 10 . 1 1 25 25 ASN C C 25 176.246 176.246 175.697 0.549 18387 7588 1 10 . 1 1 25 25 ASN CA C 25 55.370 55.370 54.941 0.429 18387 7589 1 10 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.641 1.130 18387 7590 1 10 . 1 1 25 25 ASN H H 25 8.505 8.505 8.434 0.071 18387 7591 1 10 . 1 1 26 26 ASP N N 26 119.722 119.722 119.893 -0.171 18387 7592 1 10 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.267 -0.062 18387 7593 1 10 . 1 1 26 26 ASP C C 26 176.708 176.708 176.924 -0.216 18387 7594 1 10 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.334 0.191 18387 7595 1 10 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.894 -1.614 18387 7596 1 10 . 1 1 26 26 ASP H H 26 7.731 7.731 7.675 0.056 18387 7597 1 10 . 1 1 27 27 PHE N N 27 116.827 116.827 115.099 1.728 18387 7598 1 10 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.780 -0.300 18387 7599 1 10 . 1 1 27 27 PHE C C 27 174.227 174.227 174.639 -0.412 18387 7600 1 10 . 1 1 27 27 PHE CA C 27 57.071 57.071 56.676 0.395 18387 7601 1 10 . 1 1 27 27 PHE CB C 27 39.719 39.719 40.236 -0.517 18387 7602 1 10 . 1 1 27 27 PHE H H 27 7.390 7.390 7.469 -0.079 18387 7603 1 10 . 1 1 28 28 LYS N N 28 120.357 120.357 121.976 -1.619 18387 7604 1 10 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.146 0.241 18387 7605 1 10 . 1 1 28 28 LYS C C 28 177.845 177.845 176.392 1.453 18387 7606 1 10 . 1 1 28 28 LYS CA C 28 58.002 58.002 58.007 -0.005 18387 7607 1 10 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.304 0.240 18387 7608 1 10 . 1 1 28 28 LYS H H 28 6.883 6.883 7.287 -0.404 18387 7609 1 10 . 1 1 29 29 GLY N N 29 112.653 112.653 112.892 -0.239 18387 7610 1 10 . 1 1 29 29 GLY C C 29 173.799 173.799 173.893 -0.094 18387 7611 1 10 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.750 0.238 18387 7612 1 10 . 1 1 29 29 GLY H H 29 8.930 8.930 8.327 0.603 18387 7613 1 10 . 1 1 30 30 LYS N N 30 120.516 120.516 120.453 0.063 18387 7614 1 10 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.545 0.090 18387 7615 1 10 . 1 1 30 30 LYS C C 30 176.505 176.505 175.558 0.947 18387 7616 1 10 . 1 1 30 30 LYS CA C 30 55.180 55.180 55.002 0.178 18387 7617 1 10 . 1 1 30 30 LYS CB C 30 34.857 34.857 34.622 0.235 18387 7618 1 10 . 1 1 30 30 LYS H H 30 8.098 8.098 7.473 0.625 18387 7619 1 10 . 1 1 31 31 TYR N N 31 117.383 117.383 119.296 -1.913 18387 7620 1 10 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.511 0.143 18387 7621 1 10 . 1 1 31 31 TYR C C 31 175.551 175.551 175.829 -0.278 18387 7622 1 10 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.588 0.577 18387 7623 1 10 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.136 3.057 18387 7624 1 10 . 1 1 31 31 TYR H H 31 8.263 8.263 8.895 -0.632 18387 7625 1 10 . 1 1 32 32 VAL N N 32 120.900 120.900 126.033 -5.133 18387 7626 1 10 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.117 0.322 18387 7627 1 10 . 1 1 32 32 VAL C C 32 175.975 175.975 174.794 1.181 18387 7628 1 10 . 1 1 32 32 VAL CA C 32 59.706 59.706 62.034 -2.328 18387 7629 1 10 . 1 1 32 32 VAL CB C 32 35.507 35.507 31.898 3.609 18387 7630 1 10 . 1 1 32 32 VAL H H 32 9.244 9.244 9.337 -0.093 18387 7631 1 10 . 1 1 33 33 LEU N N 33 130.058 130.058 131.511 -1.453 18387 7632 1 10 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.011 0.162 18387 7633 1 10 . 1 1 33 33 LEU C C 33 174.693 174.693 175.472 -0.779 18387 7634 1 10 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.836 -0.488 18387 7635 1 10 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.069 1.252 18387 7636 1 10 . 1 1 33 33 LEU H H 33 8.161 8.161 8.863 -0.702 18387 7637 1 10 . 1 1 34 34 VAL N N 34 129.232 129.232 129.669 -0.437 18387 7638 1 10 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.626 0.356 18387 7639 1 10 . 1 1 34 34 VAL C C 34 174.285 174.285 174.830 -0.545 18387 7640 1 10 . 1 1 34 34 VAL CA C 34 61.506 61.506 62.117 -0.611 18387 7641 1 10 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.441 -0.063 18387 7642 1 10 . 1 1 34 34 VAL H H 34 9.296 9.296 9.228 0.068 18387 7643 1 10 . 1 1 35 35 ASP N N 35 123.675 123.675 128.231 -4.556 18387 7644 1 10 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.078 0.271 18387 7645 1 10 . 1 1 35 35 ASP C C 35 174.258 174.258 174.935 -0.677 18387 7646 1 10 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.576 -1.522 18387 7647 1 10 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.234 -1.772 18387 7648 1 10 . 1 1 35 35 ASP H H 35 8.015 8.015 8.964 -0.949 18387 7649 1 10 . 1 1 36 36 PHE N N 36 126.959 126.959 126.345 0.614 18387 7650 1 10 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.569 0.366 18387 7651 1 10 . 1 1 36 36 PHE C C 36 175.432 175.432 175.675 -0.243 18387 7652 1 10 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.864 0.231 18387 7653 1 10 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.288 -0.258 18387 7654 1 10 . 1 1 36 36 PHE H H 36 9.171 9.171 8.582 0.589 18387 7655 1 10 . 1 1 37 37 TRP N N 37 120.839 120.839 123.379 -2.540 18387 7656 1 10 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.391 0.365 18387 7657 1 10 . 1 1 37 37 TRP C C 37 172.412 172.412 173.525 -1.113 18387 7658 1 10 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.462 0.447 18387 7659 1 10 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.895 -0.215 18387 7660 1 10 . 1 1 37 37 TRP H H 37 9.280 9.280 9.094 0.186 18387 7661 1 10 . 1 1 38 38 PHE N N 38 109.215 109.215 111.816 -2.601 18387 7662 1 10 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.261 -0.328 18387 7663 1 10 . 1 1 38 38 PHE C C 38 176.141 176.141 174.199 1.942 18387 7664 1 10 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.379 0.632 18387 7665 1 10 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.693 -1.074 18387 7666 1 10 . 1 1 38 38 PHE H H 38 7.062 7.062 7.656 -0.594 18387 7667 1 10 . 1 1 39 39 ALA N N 39 125.193 125.193 123.541 1.652 18387 7668 1 10 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.347 -0.282 18387 7669 1 10 . 1 1 39 39 ALA C C 39 179.349 179.349 178.556 0.793 18387 7670 1 10 . 1 1 39 39 ALA CA C 39 56.064 56.064 53.469 2.595 18387 7671 1 10 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.870 1.027 18387 7672 1 10 . 1 1 39 39 ALA H H 39 10.355 10.355 9.300 1.055 18387 7673 1 10 . 1 1 40 40 GLY N N 40 103.437 103.437 106.292 -2.855 18387 7674 1 10 . 1 1 40 40 GLY C C 40 172.732 172.732 173.889 -1.157 18387 7675 1 10 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.566 0.370 18387 7676 1 10 . 1 1 40 40 GLY H H 40 8.583 8.583 8.191 0.392 18387 7677 1 10 . 1 1 41 41 CYS N N 41 124.859 124.859 119.803 5.056 18387 7678 1 10 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.404 -0.000 18387 7679 1 10 . 1 1 41 41 CYS C C 41 176.620 176.620 175.562 1.058 18387 7680 1 10 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.415 0.960 18387 7681 1 10 . 1 1 41 41 CYS CB C 41 28.376 28.376 29.444 -1.068 18387 7682 1 10 . 1 1 41 41 CYS H H 41 6.946 6.946 6.940 0.006 18387 7683 1 10 . 1 1 42 42 SER HA H 42 4.040 4.040 4.187 -0.147 18387 7684 1 10 . 1 1 42 42 SER CA C 42 61.552 61.552 61.499 0.053 18387 7685 1 10 . 1 1 42 42 SER CB C 42 62.675 62.675 62.728 -0.053 18387 7686 1 10 . 1 1 43 43 TRP N N 43 129.748 129.748 119.683 10.065 18387 7687 1 10 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.566 -0.017 18387 7688 1 10 . 1 1 43 43 TRP C C 43 180.400 180.400 177.984 2.416 18387 7689 1 10 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.445 1.804 18387 7690 1 10 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.391 0.201 18387 7691 1 10 . 1 1 44 44 CYS N N 44 124.462 124.462 117.300 7.162 18387 7692 1 10 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.261 -0.010 18387 7693 1 10 . 1 1 44 44 CYS C C 44 178.643 178.643 176.910 1.733 18387 7694 1 10 . 1 1 44 44 CYS CA C 44 64.849 64.849 63.415 1.434 18387 7695 1 10 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.160 2.262 18387 7696 1 10 . 1 1 44 44 CYS H H 44 9.591 9.591 7.842 1.749 18387 7697 1 10 . 1 1 45 45 ARG N N 45 117.248 117.248 117.244 0.004 18387 7698 1 10 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.614 -0.438 18387 7699 1 10 . 1 1 45 45 ARG C C 45 180.302 180.302 177.567 2.735 18387 7700 1 10 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.724 -0.781 18387 7701 1 10 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.615 -1.984 18387 7702 1 10 . 1 1 45 45 ARG H H 45 7.955 7.955 7.720 0.235 18387 7703 1 10 . 1 1 46 46 LYS N N 46 120.318 120.318 118.334 1.984 18387 7704 1 10 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.340 -0.068 18387 7705 1 10 . 1 1 46 46 LYS C C 46 177.755 177.755 178.318 -0.563 18387 7706 1 10 . 1 1 46 46 LYS CA C 46 58.769 58.769 58.210 0.559 18387 7707 1 10 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.858 0.299 18387 7708 1 10 . 1 1 46 46 LYS H H 46 8.129 8.129 7.814 0.315 18387 7709 1 10 . 1 1 47 47 GLU N N 47 114.278 114.278 118.701 -4.423 18387 7710 1 10 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.495 0.396 18387 7711 1 10 . 1 1 47 47 GLU C C 47 178.701 178.701 178.746 -0.045 18387 7712 1 10 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.502 -1.948 18387 7713 1 10 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.442 0.324 18387 7714 1 10 . 1 1 47 47 GLU H H 47 7.386 7.386 7.844 -0.458 18387 7715 1 10 . 1 1 48 48 THR N N 48 115.665 115.665 117.059 -1.394 18387 7716 1 10 . 1 1 48 48 THR HA H 48 4.048 4.048 4.242 -0.194 18387 7717 1 10 . 1 1 48 48 THR C C 48 172.392 172.392 174.441 -2.049 18387 7718 1 10 . 1 1 48 48 THR CA C 48 69.426 69.426 68.211 1.215 18387 7719 1 10 . 1 1 48 48 THR CB C 48 66.906 66.906 66.501 0.405 18387 7720 1 10 . 1 1 48 48 THR H H 48 7.810 7.810 7.646 0.164 18387 7721 1 10 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.230 0.059 18387 7722 1 10 . 1 1 49 49 PRO C C 49 179.828 179.828 178.754 1.074 18387 7723 1 10 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.432 0.167 18387 7724 1 10 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.038 -0.003 18387 7725 1 10 . 1 1 50 50 TYR N N 50 116.950 116.950 116.000 0.950 18387 7726 1 10 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.246 -0.108 18387 7727 1 10 . 1 1 50 50 TYR C C 50 179.488 179.488 178.082 1.406 18387 7728 1 10 . 1 1 50 50 TYR CA C 50 61.135 61.135 60.874 0.261 18387 7729 1 10 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.604 0.697 18387 7730 1 10 . 1 1 50 50 TYR H H 50 7.071 7.071 7.299 -0.228 18387 7731 1 10 . 1 1 51 51 LEU N N 51 123.989 123.989 120.190 3.799 18387 7732 1 10 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.835 -0.165 18387 7733 1 10 . 1 1 51 51 LEU C C 51 178.072 178.072 178.908 -0.836 18387 7734 1 10 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.902 0.774 18387 7735 1 10 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.349 1.268 18387 7736 1 10 . 1 1 51 51 LEU H H 51 8.243 8.243 8.222 0.021 18387 7737 1 10 . 1 1 52 52 LEU N N 52 119.857 119.857 120.043 -0.186 18387 7738 1 10 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.074 0.253 18387 7739 1 10 . 1 1 52 52 LEU C C 52 178.704 178.704 178.473 0.231 18387 7740 1 10 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.456 0.118 18387 7741 1 10 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.610 1.128 18387 7742 1 10 . 1 1 52 52 LEU H H 52 9.085 9.085 8.650 0.435 18387 7743 1 10 . 1 1 53 53 LYS N N 53 118.658 118.658 118.932 -0.274 18387 7744 1 10 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.905 0.204 18387 7745 1 10 . 1 1 53 53 LYS C C 53 179.786 179.786 178.864 0.922 18387 7746 1 10 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.971 -0.250 18387 7747 1 10 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.205 0.954 18387 7748 1 10 . 1 1 53 53 LYS H H 53 7.807 7.807 8.217 -0.410 18387 7749 1 10 . 1 1 54 54 THR N N 54 116.869 116.869 115.983 0.886 18387 7750 1 10 . 1 1 54 54 THR HA H 54 3.965 3.965 4.332 -0.367 18387 7751 1 10 . 1 1 54 54 THR C C 54 175.328 175.328 176.874 -1.546 18387 7752 1 10 . 1 1 54 54 THR CA C 54 67.683 67.683 66.760 0.923 18387 7753 1 10 . 1 1 54 54 THR CB C 54 68.452 68.452 68.960 -0.508 18387 7754 1 10 . 1 1 54 54 THR H H 54 7.771 7.771 7.880 -0.109 18387 7755 1 10 . 1 1 55 55 TYR N N 55 122.202 122.202 123.315 -1.113 18387 7756 1 10 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.223 0.049 18387 7757 1 10 . 1 1 55 55 TYR C C 55 176.809 176.809 177.280 -0.471 18387 7758 1 10 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.024 0.713 18387 7759 1 10 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.305 0.975 18387 7760 1 10 . 1 1 55 55 TYR H H 55 9.145 9.145 8.887 0.258 18387 7761 1 10 . 1 1 56 56 ASN N N 56 113.858 113.858 118.021 -4.163 18387 7762 1 10 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.197 0.066 18387 7763 1 10 . 1 1 56 56 ASN C C 56 177.427 177.427 177.341 0.086 18387 7764 1 10 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.300 -0.370 18387 7765 1 10 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.099 -0.145 18387 7766 1 10 . 1 1 56 56 ASN H H 56 8.850 8.850 8.663 0.187 18387 7767 1 10 . 1 1 57 57 ALA N N 57 118.829 118.829 122.029 -3.200 18387 7768 1 10 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.014 0.050 18387 7769 1 10 . 1 1 57 57 ALA C C 57 180.445 180.445 179.321 1.124 18387 7770 1 10 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.537 -0.186 18387 7771 1 10 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.383 0.811 18387 7772 1 10 . 1 1 57 57 ALA H H 57 7.436 7.436 7.607 -0.171 18387 7773 1 10 . 1 1 58 58 PHE N N 58 112.082 112.082 114.895 -2.813 18387 7774 1 10 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.700 0.221 18387 7775 1 10 . 1 1 58 58 PHE C C 58 176.999 176.999 177.541 -0.542 18387 7776 1 10 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.800 0.267 18387 7777 1 10 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.428 1.062 18387 7778 1 10 . 1 1 58 58 PHE H H 58 7.480 7.480 7.668 -0.188 18387 7779 1 10 . 1 1 59 59 LYS N N 59 120.666 120.666 121.001 -0.335 18387 7780 1 10 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.213 0.590 18387 7781 1 10 . 1 1 59 59 LYS C C 59 177.157 177.157 177.558 -0.401 18387 7782 1 10 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.210 -0.129 18387 7783 1 10 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.390 -0.822 18387 7784 1 10 . 1 1 59 59 LYS H H 59 8.411 8.411 8.359 0.052 18387 7785 1 10 . 1 1 60 60 ASP N N 60 118.908 118.908 117.881 1.027 18387 7786 1 10 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.491 0.634 18387 7787 1 10 . 1 1 60 60 ASP C C 60 176.889 176.889 176.502 0.387 18387 7788 1 10 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.902 -1.253 18387 7789 1 10 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.934 -0.222 18387 7790 1 10 . 1 1 60 60 ASP H H 60 8.574 8.574 8.517 0.057 18387 7791 1 10 . 1 1 61 61 LYS N N 61 121.021 121.021 118.605 2.416 18387 7792 1 10 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.636 0.078 18387 7793 1 10 . 1 1 61 61 LYS C C 61 175.968 175.968 176.856 -0.888 18387 7794 1 10 . 1 1 61 61 LYS CA C 61 55.137 55.137 54.817 0.320 18387 7795 1 10 . 1 1 61 61 LYS CB C 61 33.078 33.078 35.129 -2.051 18387 7796 1 10 . 1 1 61 61 LYS H H 61 8.278 8.278 7.766 0.512 18387 7797 1 10 . 1 1 62 62 GLY C C 62 173.837 173.837 173.554 0.283 18387 7798 1 10 . 1 1 62 62 GLY CA C 62 47.050 47.050 44.912 2.138 18387 7799 1 10 . 1 1 63 63 PHE N N 63 120.476 120.476 121.462 -0.986 18387 7800 1 10 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.650 0.383 18387 7801 1 10 . 1 1 63 63 PHE C C 63 173.613 173.613 173.159 0.454 18387 7802 1 10 . 1 1 63 63 PHE CA C 63 55.850 55.850 57.023 -1.173 18387 7803 1 10 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.207 -0.532 18387 7804 1 10 . 1 1 63 63 PHE H H 63 7.413 7.413 8.240 -0.827 18387 7805 1 10 . 1 1 64 64 THR N N 64 119.903 119.903 115.476 4.427 18387 7806 1 10 . 1 1 64 64 THR HA H 64 4.097 4.097 4.716 -0.619 18387 7807 1 10 . 1 1 64 64 THR C C 64 170.397 170.397 171.909 -1.512 18387 7808 1 10 . 1 1 64 64 THR CA C 64 60.261 60.261 60.570 -0.309 18387 7809 1 10 . 1 1 64 64 THR CB C 64 69.507 69.507 71.483 -1.975 18387 7810 1 10 . 1 1 64 64 THR H H 64 7.665 7.665 8.233 -0.568 18387 7811 1 10 . 1 1 65 65 ILE N N 65 117.277 117.277 123.216 -5.939 18387 7812 1 10 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.562 -0.086 18387 7813 1 10 . 1 1 65 65 ILE C C 65 173.056 173.056 173.657 -0.601 18387 7814 1 10 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.554 -0.846 18387 7815 1 10 . 1 1 65 65 ILE CB C 65 39.845 39.845 40.300 -0.455 18387 7816 1 10 . 1 1 65 65 ILE H H 65 7.321 7.321 8.589 -1.268 18387 7817 1 10 . 1 1 66 66 TYR N N 66 131.968 131.968 129.162 2.806 18387 7818 1 10 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.380 -0.133 18387 7819 1 10 . 1 1 66 66 TYR C C 66 174.074 174.074 175.452 -1.378 18387 7820 1 10 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.631 -0.666 18387 7821 1 10 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.807 1.310 18387 7822 1 10 . 1 1 66 66 TYR H H 66 9.038 9.038 9.203 -0.165 18387 7823 1 10 . 1 1 67 67 GLY N N 67 114.364 114.364 115.623 -1.259 18387 7824 1 10 . 1 1 67 67 GLY C C 67 172.461 172.461 172.574 -0.113 18387 7825 1 10 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.324 0.676 18387 7826 1 10 . 1 1 67 67 GLY H H 67 9.188 9.188 9.084 0.104 18387 7827 1 10 . 1 1 68 68 VAL N N 68 126.938 126.938 118.578 8.360 18387 7828 1 10 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.196 -1.060 18387 7829 1 10 . 1 1 68 68 VAL C C 68 173.822 173.822 174.042 -0.220 18387 7830 1 10 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.619 1.879 18387 7831 1 10 . 1 1 68 68 VAL CB C 68 33.558 33.558 33.550 0.008 18387 7832 1 10 . 1 1 68 68 VAL H H 68 9.309 9.309 9.347 -0.038 18387 7833 1 10 . 1 1 69 69 SER N N 69 118.813 118.813 120.065 -1.252 18387 7834 1 10 . 1 1 69 69 SER HA H 69 5.527 5.527 5.377 0.150 18387 7835 1 10 . 1 1 69 69 SER C C 69 175.753 175.753 173.186 2.567 18387 7836 1 10 . 1 1 69 69 SER CA C 69 54.407 54.407 55.416 -1.009 18387 7837 1 10 . 1 1 69 69 SER CB C 69 63.630 63.630 65.490 -1.860 18387 7838 1 10 . 1 1 69 69 SER H H 69 8.124 8.124 8.422 -0.298 18387 7839 1 10 . 1 1 70 70 THR N N 70 113.861 113.861 120.983 -7.122 18387 7840 1 10 . 1 1 70 70 THR HA H 70 4.381 4.381 4.482 -0.102 18387 7841 1 10 . 1 1 70 70 THR C C 70 175.001 175.001 174.025 0.976 18387 7842 1 10 . 1 1 70 70 THR CA C 70 60.259 60.259 59.883 0.376 18387 7843 1 10 . 1 1 70 70 THR CB C 70 67.291 67.291 68.410 -1.119 18387 7844 1 10 . 1 1 70 70 THR H H 70 7.656 7.656 8.561 -0.905 18387 7845 1 10 . 1 1 71 71 ASP N N 71 125.133 125.133 122.270 2.863 18387 7846 1 10 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.497 -0.427 18387 7847 1 10 . 1 1 71 71 ASP C C 71 175.685 175.685 177.172 -1.487 18387 7848 1 10 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.405 2.207 18387 7849 1 10 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.798 0.571 18387 7850 1 10 . 1 1 71 71 ASP H H 71 8.931 8.931 7.402 1.529 18387 7851 1 10 . 1 1 72 72 ARG N N 72 118.814 118.814 119.253 -0.439 18387 7852 1 10 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.039 0.156 18387 7853 1 10 . 1 1 72 72 ARG C C 72 177.300 177.300 176.669 0.631 18387 7854 1 10 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.887 -2.078 18387 7855 1 10 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.680 0.431 18387 7856 1 10 . 1 1 72 72 ARG H H 72 8.057 8.057 8.386 -0.329 18387 7857 1 10 . 1 1 73 73 ARG N N 73 118.174 118.174 116.152 2.022 18387 7858 1 10 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.547 0.207 18387 7859 1 10 . 1 1 73 73 ARG C C 73 176.503 176.503 175.256 1.247 18387 7860 1 10 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.952 -0.416 18387 7861 1 10 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.134 -1.106 18387 7862 1 10 . 1 1 73 73 ARG H H 73 8.639 8.639 7.477 1.162 18387 7863 1 10 . 1 1 74 74 GLU N N 74 127.609 127.609 123.949 3.660 18387 7864 1 10 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.220 -0.141 18387 7865 1 10 . 1 1 74 74 GLU C C 74 178.107 178.107 177.945 0.162 18387 7866 1 10 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.888 -1.103 18387 7867 1 10 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.563 0.535 18387 7868 1 10 . 1 1 74 74 GLU H H 74 9.129 9.129 8.782 0.347 18387 7869 1 10 . 1 1 75 75 GLU N N 75 117.874 117.874 117.761 0.113 18387 7870 1 10 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.143 -0.043 18387 7871 1 10 . 1 1 75 75 GLU C C 75 178.993 178.993 178.530 0.463 18387 7872 1 10 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.042 1.085 18387 7873 1 10 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.708 0.583 18387 7874 1 10 . 1 1 75 75 GLU H H 75 9.745 9.745 8.822 0.923 18387 7875 1 10 . 1 1 76 76 ASP N N 76 119.182 119.182 121.383 -2.201 18387 7876 1 10 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.419 -0.053 18387 7877 1 10 . 1 1 76 76 ASP C C 76 178.107 178.107 177.826 0.281 18387 7878 1 10 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.546 -0.573 18387 7879 1 10 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.427 0.093 18387 7880 1 10 . 1 1 76 76 ASP H H 76 7.004 7.004 8.568 -1.564 18387 7881 1 10 . 1 1 77 77 TRP N N 77 123.008 123.008 121.991 1.017 18387 7882 1 10 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.269 -0.120 18387 7883 1 10 . 1 1 77 77 TRP C C 77 176.236 176.236 177.967 -1.731 18387 7884 1 10 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.709 -0.226 18387 7885 1 10 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.375 -0.840 18387 7886 1 10 . 1 1 77 77 TRP H H 77 7.112 7.112 8.046 -0.934 18387 7887 1 10 . 1 1 78 78 LYS N N 78 115.727 115.727 118.763 -3.036 18387 7888 1 10 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.351 -0.106 18387 7889 1 10 . 1 1 78 78 LYS C C 78 179.426 179.426 178.888 0.538 18387 7890 1 10 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.665 0.767 18387 7891 1 10 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.639 1.106 18387 7892 1 10 . 1 1 78 78 LYS H H 78 8.431 8.431 8.679 -0.248 18387 7893 1 10 . 1 1 79 79 LYS N N 79 118.321 118.321 119.404 -1.083 18387 7894 1 10 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.951 0.069 18387 7895 1 10 . 1 1 79 79 LYS C C 79 178.239 178.239 178.483 -0.244 18387 7896 1 10 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.372 -0.305 18387 7897 1 10 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.466 -0.003 18387 7898 1 10 . 1 1 79 79 LYS H H 79 7.690 7.690 8.060 -0.370 18387 7899 1 10 . 1 1 80 80 ALA N N 80 120.679 120.679 122.304 -1.625 18387 7900 1 10 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.250 -0.095 18387 7901 1 10 . 1 1 80 80 ALA C C 80 178.811 178.811 179.769 -0.958 18387 7902 1 10 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.114 -0.027 18387 7903 1 10 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.350 0.408 18387 7904 1 10 . 1 1 80 80 ALA H H 80 7.560 7.560 7.856 -0.296 18387 7905 1 10 . 1 1 81 81 ILE N N 81 118.019 118.019 119.127 -1.108 18387 7906 1 10 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.592 -0.190 18387 7907 1 10 . 1 1 81 81 ILE C C 81 178.113 178.113 178.301 -0.188 18387 7908 1 10 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.455 0.065 18387 7909 1 10 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.551 0.653 18387 7910 1 10 . 1 1 81 81 ILE H H 81 7.514 7.514 8.096 -0.582 18387 7911 1 10 . 1 1 82 82 GLU N N 82 117.252 117.252 120.037 -2.785 18387 7912 1 10 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.861 0.233 18387 7913 1 10 . 1 1 82 82 GLU C C 82 179.558 179.558 178.843 0.715 18387 7914 1 10 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.896 -0.316 18387 7915 1 10 . 1 1 82 82 GLU CB C 82 29.383 29.383 28.870 0.513 18387 7916 1 10 . 1 1 82 82 GLU H H 82 7.401 7.401 7.593 -0.192 18387 7917 1 10 . 1 1 83 83 GLU N N 83 119.340 119.340 119.721 -0.381 18387 7918 1 10 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.993 -0.095 18387 7919 1 10 . 1 1 83 83 GLU C C 83 178.740 178.740 178.749 -0.009 18387 7920 1 10 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.176 -0.177 18387 7921 1 10 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.672 0.248 18387 7922 1 10 . 1 1 83 83 GLU H H 83 8.191 8.191 8.197 -0.006 18387 7923 1 10 . 1 1 84 84 ASP N N 84 118.449 118.449 115.614 2.835 18387 7924 1 10 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.534 -0.260 18387 7925 1 10 . 1 1 84 84 ASP C C 84 175.597 175.597 175.440 0.157 18387 7926 1 10 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.539 0.508 18387 7927 1 10 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.795 -0.900 18387 7928 1 10 . 1 1 84 84 ASP H H 84 8.252 8.252 8.008 0.244 18387 7929 1 10 . 1 1 85 85 LYS N N 85 116.410 116.410 115.772 0.638 18387 7930 1 10 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.151 0.022 18387 7931 1 10 . 1 1 85 85 LYS C C 85 176.856 176.856 175.882 0.974 18387 7932 1 10 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.606 -0.633 18387 7933 1 10 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.357 -0.489 18387 7934 1 10 . 1 1 85 85 LYS H H 85 7.890 7.890 7.453 0.437 18387 7935 1 10 . 1 1 86 86 SER N N 86 112.295 112.295 113.637 -1.342 18387 7936 1 10 . 1 1 86 86 SER HA H 86 3.139 3.139 3.452 -0.313 18387 7937 1 10 . 1 1 86 86 SER C C 86 175.805 175.805 172.905 2.900 18387 7938 1 10 . 1 1 86 86 SER CA C 86 53.637 53.637 56.865 -3.228 18387 7939 1 10 . 1 1 86 86 SER CB C 86 60.736 60.736 61.039 -0.303 18387 7940 1 10 . 1 1 86 86 SER H H 86 7.327 7.327 7.358 -0.031 18387 7941 1 10 . 1 1 87 87 TYR N N 87 120.962 120.962 122.988 -2.026 18387 7942 1 10 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.067 0.238 18387 7943 1 10 . 1 1 87 87 TYR C C 87 177.064 177.064 174.769 2.295 18387 7944 1 10 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.620 -1.397 18387 7945 1 10 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.162 0.191 18387 7946 1 10 . 1 1 87 87 TYR H H 87 6.933 6.933 7.552 -0.619 18387 7947 1 10 . 1 1 88 88 TRP N N 88 118.597 118.597 119.424 -0.827 18387 7948 1 10 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.688 0.163 18387 7949 1 10 . 1 1 88 88 TRP C C 88 175.456 175.456 174.787 0.669 18387 7950 1 10 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.020 2.216 18387 7951 1 10 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.174 -3.447 18387 7952 1 10 . 1 1 88 88 TRP H H 88 6.552 6.552 7.203 -0.651 18387 7953 1 10 . 1 1 89 89 ASN N N 89 118.067 118.067 120.545 -2.478 18387 7954 1 10 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.485 0.564 18387 7955 1 10 . 1 1 89 89 ASN C C 89 173.773 173.773 174.288 -0.515 18387 7956 1 10 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.458 1.998 18387 7957 1 10 . 1 1 89 89 ASN CB C 89 39.197 39.197 36.787 2.410 18387 7958 1 10 . 1 1 89 89 ASN H H 89 7.864 7.864 8.394 -0.530 18387 7959 1 10 . 1 1 90 90 GLN N N 90 125.392 125.392 122.275 3.117 18387 7960 1 10 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.363 0.134 18387 7961 1 10 . 1 1 90 90 GLN C C 90 176.491 176.491 175.272 1.219 18387 7962 1 10 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.465 0.994 18387 7963 1 10 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.559 -1.332 18387 7964 1 10 . 1 1 90 90 GLN H H 90 7.904 7.904 8.168 -0.264 18387 7965 1 10 . 1 1 91 91 VAL N N 91 114.434 114.434 116.670 -2.236 18387 7966 1 10 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.972 0.508 18387 7967 1 10 . 1 1 91 91 VAL C C 91 174.248 174.248 173.012 1.236 18387 7968 1 10 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.062 -0.056 18387 7969 1 10 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.420 1.218 18387 7970 1 10 . 1 1 91 91 VAL H H 91 9.585 9.585 9.079 0.506 18387 7971 1 10 . 1 1 92 92 LEU N N 92 126.910 126.910 124.600 2.310 18387 7972 1 10 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.165 -0.096 18387 7973 1 10 . 1 1 92 92 LEU C C 92 177.696 177.696 175.784 1.912 18387 7974 1 10 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.526 0.318 18387 7975 1 10 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.108 0.839 18387 7976 1 10 . 1 1 92 92 LEU H H 92 8.941 8.941 8.404 0.537 18387 7977 1 10 . 1 1 93 93 LEU N N 93 125.673 125.673 128.650 -2.977 18387 7978 1 10 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.257 0.143 18387 7979 1 10 . 1 1 93 93 LEU C C 93 177.291 177.291 176.426 0.865 18387 7980 1 10 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.133 -0.182 18387 7981 1 10 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.725 1.454 18387 7982 1 10 . 1 1 93 93 LEU H H 93 8.038 8.038 8.674 -0.636 18387 7983 1 10 . 1 1 94 94 GLN N N 94 122.206 122.206 122.375 -0.169 18387 7984 1 10 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.173 0.064 18387 7985 1 10 . 1 1 94 94 GLN C C 94 178.246 178.246 176.853 1.393 18387 7986 1 10 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.862 -0.087 18387 7987 1 10 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.614 -0.359 18387 7988 1 10 . 1 1 94 94 GLN H H 94 9.298 9.298 8.412 0.886 18387 7989 1 10 . 1 1 95 95 LYS N N 95 122.668 122.668 120.565 2.103 18387 7990 1 10 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.033 -0.067 18387 7991 1 10 . 1 1 95 95 LYS C C 95 178.787 178.787 178.219 0.568 18387 7992 1 10 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.144 0.928 18387 7993 1 10 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.138 0.327 18387 7994 1 10 . 1 1 95 95 LYS H H 95 8.645 8.645 8.565 0.081 18387 7995 1 10 . 1 1 96 96 ASP N N 96 116.775 116.775 118.153 -1.378 18387 7996 1 10 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.570 0.010 18387 7997 1 10 . 1 1 96 96 ASP C C 96 176.220 176.220 178.064 -1.844 18387 7998 1 10 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.599 -0.253 18387 7999 1 10 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.960 -0.403 18387 8000 1 10 . 1 1 96 96 ASP H H 96 8.606 8.606 8.191 0.415 18387 8001 1 10 . 1 1 97 97 ASP N N 97 118.213 118.213 120.121 -1.908 18387 8002 1 10 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.344 0.583 18387 8003 1 10 . 1 1 97 97 ASP C C 97 176.954 176.954 178.297 -1.343 18387 8004 1 10 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.676 -1.317 18387 8005 1 10 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.671 1.653 18387 8006 1 10 . 1 1 97 97 ASP H H 97 7.988 7.988 8.305 -0.317 18387 8007 1 10 . 1 1 98 98 VAL N N 98 118.907 118.907 119.801 -0.894 18387 8008 1 10 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.523 -0.107 18387 8009 1 10 . 1 1 98 98 VAL C C 98 176.470 176.470 177.444 -0.974 18387 8010 1 10 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.183 1.595 18387 8011 1 10 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.470 0.921 18387 8012 1 10 . 1 1 98 98 VAL H H 98 7.098 7.098 8.573 -1.475 18387 8013 1 10 . 1 1 99 99 LYS N N 99 117.909 117.909 119.761 -1.852 18387 8014 1 10 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.907 0.036 18387 8015 1 10 . 1 1 99 99 LYS C C 99 178.762 178.762 178.130 0.632 18387 8016 1 10 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.113 0.032 18387 8017 1 10 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.003 0.009 18387 8018 1 10 . 1 1 99 99 LYS H H 99 8.304 8.304 7.721 0.583 18387 8019 1 10 . 1 1 100 100 ASP N N 100 117.843 117.843 119.742 -1.899 18387 8020 1 10 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.455 0.023 18387 8021 1 10 . 1 1 100 100 ASP C C 100 179.694 179.694 179.060 0.634 18387 8022 1 10 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.547 -0.021 18387 8023 1 10 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.675 0.153 18387 8024 1 10 . 1 1 100 100 ASP H H 100 8.024 8.024 7.708 0.316 18387 8025 1 10 . 1 1 101 101 VAL N N 101 122.202 122.202 120.676 1.526 18387 8026 1 10 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.362 0.633 18387 8027 1 10 . 1 1 101 101 VAL C C 101 178.533 178.533 177.667 0.866 18387 8028 1 10 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.849 0.153 18387 8029 1 10 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.838 0.199 18387 8030 1 10 . 1 1 101 101 VAL H H 101 8.205 8.205 7.981 0.224 18387 8031 1 10 . 1 1 102 102 LEU N N 102 118.798 118.798 119.259 -0.461 18387 8032 1 10 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.806 -0.026 18387 8033 1 10 . 1 1 102 102 LEU C C 102 180.254 180.254 178.885 1.369 18387 8034 1 10 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.136 0.805 18387 8035 1 10 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.319 -0.880 18387 8036 1 10 . 1 1 102 102 LEU H H 102 8.422 8.422 8.119 0.303 18387 8037 1 10 . 1 1 103 103 GLU N N 103 116.915 116.915 119.492 -2.577 18387 8038 1 10 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.870 0.265 18387 8039 1 10 . 1 1 103 103 GLU C C 103 180.910 180.910 179.509 1.401 18387 8040 1 10 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.483 -0.080 18387 8041 1 10 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.615 0.116 18387 8042 1 10 . 1 1 103 103 GLU H H 103 8.262 8.262 7.954 0.308 18387 8043 1 10 . 1 1 104 104 SER N N 104 117.866 117.866 116.052 1.814 18387 8044 1 10 . 1 1 104 104 SER HA H 104 4.216 4.216 4.119 0.097 18387 8045 1 10 . 1 1 104 104 SER C C 104 175.455 175.455 176.699 -1.244 18387 8046 1 10 . 1 1 104 104 SER CA C 104 62.019 62.019 61.875 0.144 18387 8047 1 10 . 1 1 104 104 SER CB C 104 62.891 62.891 63.076 -0.185 18387 8048 1 10 . 1 1 104 104 SER H H 104 8.544 8.544 7.872 0.672 18387 8049 1 10 . 1 1 105 105 TYR N N 105 117.278 117.278 117.944 -0.666 18387 8050 1 10 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.545 -0.273 18387 8051 1 10 . 1 1 105 105 TYR C C 105 174.750 174.750 175.751 -1.001 18387 8052 1 10 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.183 2.676 18387 8053 1 10 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.332 2.379 18387 8054 1 10 . 1 1 105 105 TYR H H 105 7.691 7.691 7.612 0.079 18387 8055 1 10 . 1 1 106 106 CYS N N 106 116.897 116.897 118.256 -1.359 18387 8056 1 10 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.082 -0.187 18387 8057 1 10 . 1 1 106 106 CYS C C 106 174.056 174.056 173.116 0.940 18387 8058 1 10 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.316 -0.706 18387 8059 1 10 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.592 -0.560 18387 8060 1 10 . 1 1 106 106 CYS H H 106 7.862 7.862 8.400 -0.538 18387 8061 1 10 . 1 1 107 107 ILE N N 107 118.885 118.885 122.115 -3.230 18387 8062 1 10 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.130 -0.791 18387 8063 1 10 . 1 1 107 107 ILE C C 107 176.793 176.793 174.999 1.794 18387 8064 1 10 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.651 3.094 18387 8065 1 10 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.944 0.135 18387 8066 1 10 . 1 1 107 107 ILE H H 107 7.707 7.707 8.169 -0.462 18387 8067 1 10 . 1 1 108 108 VAL N N 108 123.983 123.983 120.635 3.348 18387 8068 1 10 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.279 -0.005 18387 8069 1 10 . 1 1 108 108 VAL C C 108 175.476 175.476 174.912 0.564 18387 8070 1 10 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.534 0.090 18387 8071 1 10 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.510 0.498 18387 8072 1 10 . 1 1 108 108 VAL H H 108 8.656 8.656 8.194 0.462 18387 8073 1 10 . 1 1 109 109 GLY N N 109 110.120 110.120 107.189 2.931 18387 8074 1 10 . 1 1 109 109 GLY C C 109 169.982 169.982 171.832 -1.850 18387 8075 1 10 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.799 -0.196 18387 8076 1 10 . 1 1 109 109 GLY H H 109 7.500 7.500 7.006 0.494 18387 8077 1 10 . 1 1 110 110 PHE N N 110 115.276 115.276 117.919 -2.643 18387 8078 1 10 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.279 -0.505 18387 8079 1 10 . 1 1 110 110 PHE C C 110 174.361 174.361 174.245 0.116 18387 8080 1 10 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.750 -0.063 18387 8081 1 10 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.998 -0.047 18387 8082 1 10 . 1 1 110 110 PHE H H 110 8.203 8.203 8.274 -0.071 18387 8083 1 10 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.332 0.027 18387 8084 1 10 . 1 1 111 111 PRO C C 111 175.691 175.691 175.696 -0.005 18387 8085 1 10 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.666 0.492 18387 8086 1 10 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.347 1.957 18387 8087 1 10 . 1 1 112 112 HIS N N 112 123.708 123.708 120.427 3.281 18387 8088 1 10 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.949 0.014 18387 8089 1 10 . 1 1 112 112 HIS C C 112 173.649 173.649 173.797 -0.148 18387 8090 1 10 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.622 1.452 18387 8091 1 10 . 1 1 112 112 HIS CB C 112 32.197 32.197 34.205 -2.007 18387 8092 1 10 . 1 1 112 112 HIS H H 112 8.952 8.952 8.473 0.479 18387 8093 1 10 . 1 1 113 113 ILE N N 113 128.596 128.596 122.009 6.587 18387 8094 1 10 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.389 0.308 18387 8095 1 10 . 1 1 113 113 ILE C C 113 176.130 176.130 174.728 1.402 18387 8096 1 10 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.179 0.816 18387 8097 1 10 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.120 -3.065 18387 8098 1 10 . 1 1 113 113 ILE H H 113 8.808 8.808 8.643 0.165 18387 8099 1 10 . 1 1 114 114 ILE N N 114 119.668 119.668 120.828 -1.160 18387 8100 1 10 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.883 0.090 18387 8101 1 10 . 1 1 114 114 ILE C C 114 173.186 173.186 173.394 -0.208 18387 8102 1 10 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.896 -0.166 18387 8103 1 10 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.216 0.324 18387 8104 1 10 . 1 1 114 114 ILE H H 114 8.721 8.721 9.054 -0.333 18387 8105 1 10 . 1 1 115 115 LEU N N 115 122.770 122.770 124.313 -1.543 18387 8106 1 10 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.139 0.136 18387 8107 1 10 . 1 1 115 115 LEU C C 115 173.601 173.601 174.522 -0.921 18387 8108 1 10 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.412 0.370 18387 8109 1 10 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.145 0.989 18387 8110 1 10 . 1 1 115 115 LEU H H 115 8.665 8.665 9.100 -0.435 18387 8111 1 10 . 1 1 116 116 VAL N N 116 130.411 130.411 128.660 1.751 18387 8112 1 10 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.961 -0.103 18387 8113 1 10 . 1 1 116 116 VAL C C 116 174.565 174.565 175.138 -0.573 18387 8114 1 10 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.210 0.594 18387 8115 1 10 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.562 -0.647 18387 8116 1 10 . 1 1 116 116 VAL H H 116 9.472 9.472 9.263 0.209 18387 8117 1 10 . 1 1 117 117 ASP N N 117 127.896 127.896 127.037 0.859 18387 8118 1 10 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.563 -0.171 18387 8119 1 10 . 1 1 117 117 ASP C C 117 176.567 176.567 176.517 0.050 18387 8120 1 10 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.435 0.165 18387 8121 1 10 . 1 1 117 117 ASP CB C 117 40.584 40.584 39.896 0.688 18387 8122 1 10 . 1 1 117 117 ASP H H 117 9.429 9.429 8.684 0.745 18387 8123 1 10 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.098 0.096 18387 8124 1 10 . 1 1 118 118 PRO C C 118 177.534 177.534 178.332 -0.798 18387 8125 1 10 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.242 -0.077 18387 8126 1 10 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.901 0.912 18387 8127 1 10 . 1 1 119 119 GLU N N 119 114.015 114.015 117.995 -3.980 18387 8128 1 10 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.079 0.260 18387 8129 1 10 . 1 1 119 119 GLU C C 119 176.722 176.722 177.823 -1.101 18387 8130 1 10 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.975 -2.336 18387 8131 1 10 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.839 0.738 18387 8132 1 10 . 1 1 119 119 GLU H H 119 7.733 7.733 8.057 -0.324 18387 8133 1 10 . 1 1 120 120 GLY N N 120 108.218 108.218 106.342 1.876 18387 8134 1 10 . 1 1 120 120 GLY C C 120 174.110 174.110 172.793 1.317 18387 8135 1 10 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.647 0.749 18387 8136 1 10 . 1 1 120 120 GLY H H 120 8.588 8.588 8.470 0.118 18387 8137 1 10 . 1 1 121 121 LYS N N 121 121.778 121.778 120.144 1.634 18387 8138 1 10 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.172 -0.313 18387 8139 1 10 . 1 1 121 121 LYS C C 121 176.458 176.458 175.463 0.995 18387 8140 1 10 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.332 0.630 18387 8141 1 10 . 1 1 121 121 LYS CB C 121 33.452 33.452 36.044 -2.591 18387 8142 1 10 . 1 1 121 121 LYS H H 121 8.600 8.600 8.585 0.015 18387 8143 1 10 . 1 1 122 122 ILE N N 122 122.058 122.058 125.875 -3.817 18387 8144 1 10 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.298 -0.026 18387 8145 1 10 . 1 1 122 122 ILE C C 122 177.084 177.084 176.738 0.346 18387 8146 1 10 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.252 0.567 18387 8147 1 10 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.850 1.798 18387 8148 1 10 . 1 1 122 122 ILE H H 122 9.006 9.006 9.166 -0.160 18387 8149 1 10 . 1 1 123 123 VAL N N 123 120.561 120.561 129.104 -8.543 18387 8150 1 10 . 1 1 123 123 VAL HA H 123 4.755 4.755 3.892 0.863 18387 8151 1 10 . 1 1 123 123 VAL C C 123 175.584 175.584 176.067 -0.483 18387 8152 1 10 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.976 -2.825 18387 8153 1 10 . 1 1 123 123 VAL CB C 123 33.401 33.401 31.485 1.916 18387 8154 1 10 . 1 1 123 123 VAL H H 123 9.054 9.054 8.917 0.137 18387 8155 1 10 . 1 1 124 124 ALA N N 124 121.102 121.102 119.895 1.207 18387 8156 1 10 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.778 -0.121 18387 8157 1 10 . 1 1 124 124 ALA C C 124 174.832 174.832 174.907 -0.075 18387 8158 1 10 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.774 0.686 18387 8159 1 10 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.682 1.148 18387 8160 1 10 . 1 1 124 124 ALA H H 124 7.793 7.793 7.429 0.364 18387 8161 1 10 . 1 1 125 125 LYS N N 125 117.637 117.637 118.354 -0.717 18387 8162 1 10 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.912 0.121 18387 8163 1 10 . 1 1 125 125 LYS C C 125 173.417 173.417 175.828 -2.411 18387 8164 1 10 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.239 -0.097 18387 8165 1 10 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.486 1.165 18387 8166 1 10 . 1 1 125 125 LYS H H 125 8.872 8.872 8.279 0.593 18387 8167 1 10 . 1 1 126 126 GLU N N 126 115.236 115.236 115.315 -0.079 18387 8168 1 10 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.953 0.045 18387 8169 1 10 . 1 1 126 126 GLU C C 126 175.998 175.998 175.524 0.474 18387 8170 1 10 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.500 -0.538 18387 8171 1 10 . 1 1 126 126 GLU CB C 126 26.435 26.435 26.980 -0.545 18387 8172 1 10 . 1 1 126 126 GLU H H 126 7.941 7.941 8.503 -0.562 18387 8173 1 10 . 1 1 127 127 LEU N N 127 118.584 118.584 119.658 -1.074 18387 8174 1 10 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.209 0.173 18387 8175 1 10 . 1 1 127 127 LEU C C 127 176.766 176.766 176.941 -0.175 18387 8176 1 10 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.690 -0.081 18387 8177 1 10 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.428 1.535 18387 8178 1 10 . 1 1 127 127 LEU H H 127 7.300 7.300 7.957 -0.657 18387 8179 1 10 . 1 1 128 128 ARG N N 128 118.625 118.625 122.285 -3.660 18387 8180 1 10 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.305 0.170 18387 8181 1 10 . 1 1 128 128 ARG C C 128 177.113 177.113 177.577 -0.464 18387 8182 1 10 . 1 1 128 128 ARG CA C 128 53.390 53.390 55.175 -1.785 18387 8183 1 10 . 1 1 128 128 ARG CB C 128 34.612 34.612 31.140 3.472 18387 8184 1 10 . 1 1 128 128 ARG H H 128 7.929 7.929 8.231 -0.302 18387 8185 1 10 . 1 1 129 129 GLY N N 129 114.010 114.010 113.499 0.511 18387 8186 1 10 . 1 1 129 129 GLY C C 129 175.931 175.931 175.301 0.630 18387 8187 1 10 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.572 -2.111 18387 8188 1 10 . 1 1 129 129 GLY H H 129 10.649 10.649 8.783 1.866 18387 8189 1 10 . 1 1 130 130 ASP N N 130 123.975 123.975 119.169 4.806 18387 8190 1 10 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.945 0.587 18387 8191 1 10 . 1 1 130 130 ASP C C 130 177.507 177.507 177.195 0.312 18387 8192 1 10 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.080 0.292 18387 8193 1 10 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.308 0.595 18387 8194 1 10 . 1 1 130 130 ASP H H 130 8.540 8.540 8.286 0.254 18387 8195 1 10 . 1 1 131 131 ASP N N 131 116.806 116.806 120.261 -3.455 18387 8196 1 10 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.532 0.038 18387 8197 1 10 . 1 1 131 131 ASP C C 131 179.038 179.038 178.224 0.814 18387 8198 1 10 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.462 0.521 18387 8199 1 10 . 1 1 131 131 ASP CB C 131 40.934 40.934 41.164 -0.230 18387 8200 1 10 . 1 1 131 131 ASP H H 131 7.907 7.907 7.399 0.508 18387 8201 1 10 . 1 1 132 132 LEU N N 132 123.869 123.869 118.966 4.903 18387 8202 1 10 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.200 -0.409 18387 8203 1 10 . 1 1 132 132 LEU C C 132 176.343 176.343 178.393 -2.050 18387 8204 1 10 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.379 1.405 18387 8205 1 10 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.995 0.773 18387 8206 1 10 . 1 1 132 132 LEU H H 132 7.542 7.542 8.584 -1.042 18387 8207 1 10 . 1 1 133 133 TYR N N 133 120.042 120.042 119.678 0.364 18387 8208 1 10 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.098 -0.102 18387 8209 1 10 . 1 1 133 133 TYR C C 133 177.426 177.426 176.878 0.548 18387 8210 1 10 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.140 -0.007 18387 8211 1 10 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.685 -0.109 18387 8212 1 10 . 1 1 133 133 TYR H H 133 7.384 7.384 7.720 -0.336 18387 8213 1 10 . 1 1 134 134 ASN N N 134 114.936 114.936 117.592 -2.656 18387 8214 1 10 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.303 0.100 18387 8215 1 10 . 1 1 134 134 ASN C C 134 178.703 178.703 177.618 1.085 18387 8216 1 10 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.138 -0.329 18387 8217 1 10 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.102 0.106 18387 8218 1 10 . 1 1 134 134 ASN H H 134 8.399 8.399 7.751 0.648 18387 8219 1 10 . 1 1 135 135 THR N N 135 117.387 117.387 114.198 3.189 18387 8220 1 10 . 1 1 135 135 THR HA H 135 3.920 3.920 3.681 0.239 18387 8221 1 10 . 1 1 135 135 THR C C 135 175.323 175.323 176.478 -1.155 18387 8222 1 10 . 1 1 135 135 THR CA C 135 67.402 67.402 65.706 1.696 18387 8223 1 10 . 1 1 135 135 THR CB C 135 68.111 68.111 69.029 -0.919 18387 8224 1 10 . 1 1 135 135 THR H H 135 8.265 8.265 8.276 -0.011 18387 8225 1 10 . 1 1 136 136 VAL N N 136 121.207 121.207 119.474 1.733 18387 8226 1 10 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.615 -0.600 18387 8227 1 10 . 1 1 136 136 VAL C C 136 176.457 176.457 176.956 -0.499 18387 8228 1 10 . 1 1 136 136 VAL CA C 136 68.272 68.272 65.700 2.572 18387 8229 1 10 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.479 0.462 18387 8230 1 10 . 1 1 136 136 VAL H H 136 7.595 7.595 7.771 -0.176 18387 8231 1 10 . 1 1 137 137 GLU N N 137 118.266 118.266 120.168 -1.902 18387 8232 1 10 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.431 -0.749 18387 8233 1 10 . 1 1 137 137 GLU C C 137 177.482 177.482 178.030 -0.548 18387 8234 1 10 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.430 0.500 18387 8235 1 10 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.019 0.763 18387 8236 1 10 . 1 1 137 137 GLU H H 137 8.114 8.114 7.946 0.168 18387 8237 1 10 . 1 1 138 138 LYS N N 138 116.431 116.431 118.564 -2.133 18387 8238 1 10 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.908 -0.140 18387 8239 1 10 . 1 1 138 138 LYS C C 138 179.193 179.193 178.408 0.785 18387 8240 1 10 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.720 0.320 18387 8241 1 10 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.940 0.218 18387 8242 1 10 . 1 1 138 138 LYS H H 138 7.133 7.133 7.304 -0.171 18387 8243 1 10 . 1 1 139 139 PHE N N 139 116.336 116.336 117.012 -0.676 18387 8244 1 10 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.304 -0.294 18387 8245 1 10 . 1 1 139 139 PHE C C 139 177.855 177.855 177.458 0.397 18387 8246 1 10 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.029 2.354 18387 8247 1 10 . 1 1 139 139 PHE CB C 139 39.352 39.352 38.988 0.364 18387 8248 1 10 . 1 1 139 139 PHE H H 139 7.338 7.338 7.217 0.121 18387 8249 1 10 . 1 1 140 140 VAL N N 140 116.491 116.491 117.562 -1.071 18387 8250 1 10 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.500 0.024 18387 8251 1 10 . 1 1 140 140 VAL C C 140 177.747 177.747 177.612 0.135 18387 8252 1 10 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.479 -0.237 18387 8253 1 10 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.604 -0.214 18387 8254 1 10 . 1 1 140 140 VAL H H 140 8.332 8.332 8.418 -0.086 18387 8255 1 10 . 1 1 141 141 ASN N N 141 116.956 116.956 118.252 -1.296 18387 8256 1 10 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.664 0.162 18387 8257 1 10 . 1 1 141 141 ASN C C 141 176.997 176.997 176.982 0.015 18387 8258 1 10 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.793 -1.116 18387 8259 1 10 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.227 -0.779 18387 8260 1 10 . 1 1 141 141 ASN H H 141 7.862 7.862 7.463 0.399 18387 8261 1 10 . 1 1 142 142 GLY N N 142 107.938 107.938 108.818 -0.880 18387 8262 1 10 . 1 1 142 142 GLY C C 142 174.336 174.336 173.243 1.093 18387 8263 1 10 . 1 1 142 142 GLY CA C 142 45.985 45.985 43.785 2.200 18387 8264 1 10 . 1 1 142 142 GLY H H 142 7.466 7.466 8.473 -1.007 18387 8265 1 10 . 1 1 143 143 ALA N N 143 123.441 123.441 127.418 -3.977 18387 8266 1 10 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.488 -0.147 18387 8267 1 10 . 1 1 143 143 ALA C C 143 178.212 178.212 177.832 0.380 18387 8268 1 10 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.923 -0.097 18387 8269 1 10 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.344 -0.100 18387 8270 1 10 . 1 1 143 143 ALA H H 143 7.950 7.950 7.521 0.429 18387 8271 1 10 . 1 1 144 144 LYS N N 144 120.149 120.149 126.793 -6.644 18387 8272 1 10 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.673 -0.378 18387 8273 1 10 . 1 1 144 144 LYS C C 144 176.945 176.945 176.428 0.517 18387 8274 1 10 . 1 1 144 144 LYS CA C 144 56.519 56.519 55.565 0.954 18387 8275 1 10 . 1 1 144 144 LYS CB C 144 33.030 33.030 31.402 1.628 18387 8276 1 10 . 1 1 144 144 LYS H H 144 8.187 8.187 8.569 -0.382 18387 8277 1 10 . 1 1 145 145 GLU N N 145 120.992 120.992 123.009 -2.017 18387 8278 1 10 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.429 -0.134 18387 8279 1 10 . 1 1 145 145 GLU C C 145 177.116 177.116 176.934 0.182 18387 8280 1 10 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.912 -0.009 18387 8281 1 10 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.344 -0.102 18387 8282 1 10 . 1 1 145 145 GLU H H 145 8.363 8.363 8.672 -0.309 18387 8283 1 10 . 1 1 146 146 GLY N N 146 109.467 109.467 110.975 -1.508 18387 8284 1 10 . 1 1 146 146 GLY C C 146 174.108 174.108 174.306 -0.198 18387 8285 1 10 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.511 0.890 18387 8286 1 10 . 1 1 146 146 GLY H H 146 8.371 8.371 8.283 0.088 18387 8287 1 10 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.956 -0.347 18387 8288 1 10 . 1 1 151 151 HIS C C 151 174.258 174.258 174.093 0.165 18387 8289 1 10 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.737 0.428 18387 8290 1 10 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.972 -0.139 18387 8291 1 11 . 1 1 2 2 SER HA H 2 3.992 3.992 4.372 -0.380 18387 8292 1 11 . 1 1 2 2 SER CA C 2 57.555 57.555 58.823 -1.268 18387 8293 1 11 . 1 1 2 2 SER CB C 2 64.977 64.977 61.586 3.391 18387 8294 1 11 . 1 1 3 3 LEU HA H 3 4.439 4.439 3.793 0.646 18387 8295 1 11 . 1 1 3 3 LEU C C 3 176.631 176.631 176.006 0.625 18387 8296 1 11 . 1 1 3 3 LEU CA C 3 54.564 54.564 55.384 -0.820 18387 8297 1 11 . 1 1 3 3 LEU CB C 3 42.724 42.724 40.100 2.624 18387 8298 1 11 . 1 1 4 4 ALA N N 4 125.483 125.483 116.792 8.691 18387 8299 1 11 . 1 1 4 4 ALA HA H 4 4.379 4.379 3.996 0.383 18387 8300 1 11 . 1 1 4 4 ALA C C 4 179.642 179.642 177.002 2.640 18387 8301 1 11 . 1 1 4 4 ALA CA C 4 51.735 51.735 53.858 -2.123 18387 8302 1 11 . 1 1 4 4 ALA CB C 4 19.752 19.752 18.363 1.389 18387 8303 1 11 . 1 1 4 4 ALA H H 4 8.483 8.483 7.640 0.843 18387 8304 1 11 . 1 1 5 5 THR HA H 5 3.845 3.845 4.695 -0.850 18387 8305 1 11 . 1 1 5 5 THR C C 5 175.487 175.487 174.956 0.531 18387 8306 1 11 . 1 1 5 5 THR CA C 5 64.531 64.531 60.103 4.428 18387 8307 1 11 . 1 1 5 5 THR CB C 5 68.108 68.108 71.249 -3.141 18387 8308 1 11 . 1 1 6 6 GLY N N 6 114.298 114.298 113.437 0.861 18387 8309 1 11 . 1 1 6 6 GLY C C 6 174.324 174.324 174.084 0.240 18387 8310 1 11 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.044 -0.209 18387 8311 1 11 . 1 1 6 6 GLY H H 6 9.511 9.511 9.185 0.326 18387 8312 1 11 . 1 1 7 7 SER N N 7 115.270 115.270 116.497 -1.227 18387 8313 1 11 . 1 1 7 7 SER HA H 7 4.500 4.500 4.508 -0.008 18387 8314 1 11 . 1 1 7 7 SER C C 7 173.315 173.315 174.513 -1.198 18387 8315 1 11 . 1 1 7 7 SER CA C 7 58.915 58.915 58.227 0.688 18387 8316 1 11 . 1 1 7 7 SER CB C 7 64.308 64.308 64.412 -0.104 18387 8317 1 11 . 1 1 7 7 SER H H 7 7.736 7.736 7.917 -0.181 18387 8318 1 11 . 1 1 8 8 VAL N N 8 123.708 123.708 123.815 -0.107 18387 8319 1 11 . 1 1 8 8 VAL HA H 8 3.832 3.832 3.981 -0.149 18387 8320 1 11 . 1 1 8 8 VAL C C 8 176.673 176.673 175.905 0.768 18387 8321 1 11 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.003 0.670 18387 8322 1 11 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.355 -0.133 18387 8323 1 11 . 1 1 8 8 VAL H H 8 8.632 8.632 8.405 0.227 18387 8324 1 11 . 1 1 9 9 ALA N N 9 133.040 133.040 131.919 1.121 18387 8325 1 11 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.567 -0.304 18387 8326 1 11 . 1 1 9 9 ALA C C 9 175.404 175.404 175.624 -0.220 18387 8327 1 11 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.104 0.851 18387 8328 1 11 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.565 -0.535 18387 8329 1 11 . 1 1 9 9 ALA H H 9 8.448 8.448 8.640 -0.192 18387 8330 1 11 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.301 0.030 18387 8331 1 11 . 1 1 10 10 PRO C C 10 175.071 175.071 176.223 -1.152 18387 8332 1 11 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.791 -0.150 18387 8333 1 11 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.312 0.012 18387 8334 1 11 . 1 1 11 11 ALA N N 11 124.172 124.172 125.290 -1.118 18387 8335 1 11 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.481 -0.237 18387 8336 1 11 . 1 1 11 11 ALA C C 11 177.688 177.688 177.630 0.058 18387 8337 1 11 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.620 2.001 18387 8338 1 11 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.377 0.950 18387 8339 1 11 . 1 1 11 11 ALA H H 11 8.221 8.221 8.424 -0.203 18387 8340 1 11 . 1 1 12 12 ILE N N 12 117.815 117.815 126.553 -8.738 18387 8341 1 11 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.251 0.077 18387 8342 1 11 . 1 1 12 12 ILE C C 12 175.013 175.013 175.865 -0.852 18387 8343 1 11 . 1 1 12 12 ILE CA C 12 62.166 62.166 62.315 -0.148 18387 8344 1 11 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.596 5.694 18387 8345 1 11 . 1 1 12 12 ILE H H 12 7.693 7.693 8.048 -0.355 18387 8346 1 11 . 1 1 13 13 THR N N 13 121.186 121.186 123.537 -2.351 18387 8347 1 11 . 1 1 13 13 THR HA H 13 4.840 4.840 4.812 0.028 18387 8348 1 11 . 1 1 13 13 THR C C 13 172.625 172.625 173.693 -1.068 18387 8349 1 11 . 1 1 13 13 THR CA C 13 62.297 62.297 61.786 0.511 18387 8350 1 11 . 1 1 13 13 THR CB C 13 71.585 71.585 69.644 1.941 18387 8351 1 11 . 1 1 13 13 THR H H 13 8.363 8.363 9.631 -1.268 18387 8352 1 11 . 1 1 14 14 GLY N N 14 110.785 110.785 112.271 -1.486 18387 8353 1 11 . 1 1 14 14 GLY C C 14 170.040 170.040 172.118 -2.078 18387 8354 1 11 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.869 1.521 18387 8355 1 11 . 1 1 14 14 GLY H H 14 7.993 7.993 8.961 -0.968 18387 8356 1 11 . 1 1 15 15 ILE N N 15 119.088 119.088 120.018 -0.930 18387 8357 1 11 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.139 -0.014 18387 8358 1 11 . 1 1 15 15 ILE C C 15 176.359 176.359 175.711 0.648 18387 8359 1 11 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.117 -1.503 18387 8360 1 11 . 1 1 15 15 ILE CB C 15 38.639 38.639 39.989 -1.350 18387 8361 1 11 . 1 1 15 15 ILE H H 15 7.973 7.973 8.469 -0.496 18387 8362 1 11 . 1 1 16 16 ASP N N 16 126.633 126.633 127.383 -0.750 18387 8363 1 11 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.504 0.345 18387 8364 1 11 . 1 1 16 16 ASP C C 16 179.190 179.190 178.019 1.171 18387 8365 1 11 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.365 -0.485 18387 8366 1 11 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.543 -0.268 18387 8367 1 11 . 1 1 16 16 ASP H H 16 9.335 9.335 9.023 0.312 18387 8368 1 11 . 1 1 17 17 LEU N N 17 116.648 116.648 119.383 -2.735 18387 8369 1 11 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.117 0.057 18387 8370 1 11 . 1 1 17 17 LEU C C 17 178.432 178.432 178.837 -0.405 18387 8371 1 11 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.999 -0.018 18387 8372 1 11 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.535 1.450 18387 8373 1 11 . 1 1 17 17 LEU H H 17 8.071 8.071 8.952 -0.881 18387 8374 1 11 . 1 1 18 18 LYS N N 18 117.401 117.401 118.522 -1.121 18387 8375 1 11 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.180 0.329 18387 8376 1 11 . 1 1 18 18 LYS C C 18 176.793 176.793 177.362 -0.569 18387 8377 1 11 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.503 -2.068 18387 8378 1 11 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.795 0.267 18387 8379 1 11 . 1 1 18 18 LYS H H 18 8.207 8.207 8.698 -0.491 18387 8380 1 11 . 1 1 19 19 GLY N N 19 108.061 108.061 107.128 0.933 18387 8381 1 11 . 1 1 19 19 GLY C C 19 174.649 174.649 174.118 0.531 18387 8382 1 11 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.839 0.758 18387 8383 1 11 . 1 1 19 19 GLY H H 19 8.099 8.099 8.067 0.032 18387 8384 1 11 . 1 1 20 20 ASN N N 20 121.012 121.012 119.684 1.328 18387 8385 1 11 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.971 -0.066 18387 8386 1 11 . 1 1 20 20 ASN C C 20 174.827 174.827 174.643 0.184 18387 8387 1 11 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.441 0.026 18387 8388 1 11 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.993 -1.317 18387 8389 1 11 . 1 1 20 20 ASN H H 20 8.945 8.945 8.781 0.164 18387 8390 1 11 . 1 1 21 21 SER N N 21 117.285 117.285 117.918 -0.633 18387 8391 1 11 . 1 1 21 21 SER HA H 21 5.000 5.000 5.066 -0.066 18387 8392 1 11 . 1 1 21 21 SER C C 21 174.911 174.911 174.583 0.328 18387 8393 1 11 . 1 1 21 21 SER CA C 21 58.730 58.730 58.218 0.512 18387 8394 1 11 . 1 1 21 21 SER CB C 21 63.162 63.162 62.788 0.374 18387 8395 1 11 . 1 1 21 21 SER H H 21 8.740 8.740 8.693 0.047 18387 8396 1 11 . 1 1 22 22 VAL N N 22 128.665 128.665 127.608 1.057 18387 8397 1 11 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.271 0.109 18387 8398 1 11 . 1 1 22 22 VAL C C 22 176.276 176.276 175.803 0.473 18387 8399 1 11 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.842 1.111 18387 8400 1 11 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.439 2.143 18387 8401 1 11 . 1 1 22 22 VAL H H 22 9.125 9.125 8.734 0.391 18387 8402 1 11 . 1 1 23 23 SER N N 23 127.457 127.457 121.515 5.942 18387 8403 1 11 . 1 1 23 23 SER HA H 23 5.878 5.878 5.406 0.472 18387 8404 1 11 . 1 1 23 23 SER C C 23 174.436 174.436 175.282 -0.846 18387 8405 1 11 . 1 1 23 23 SER CA C 23 57.101 57.101 56.967 0.134 18387 8406 1 11 . 1 1 23 23 SER CB C 23 66.078 66.078 65.358 0.720 18387 8407 1 11 . 1 1 23 23 SER H H 23 8.971 8.971 9.447 -0.476 18387 8408 1 11 . 1 1 24 24 LEU N N 24 126.734 126.734 123.582 3.152 18387 8409 1 11 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.852 -0.385 18387 8410 1 11 . 1 1 24 24 LEU C C 24 179.852 179.852 177.708 2.144 18387 8411 1 11 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.677 1.526 18387 8412 1 11 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.161 -0.183 18387 8413 1 11 . 1 1 24 24 LEU H H 24 8.450 8.450 8.623 -0.173 18387 8414 1 11 . 1 1 25 25 ASN N N 25 115.642 115.642 116.575 -0.933 18387 8415 1 11 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.424 -0.182 18387 8416 1 11 . 1 1 25 25 ASN C C 25 176.246 176.246 176.400 -0.154 18387 8417 1 11 . 1 1 25 25 ASN CA C 25 55.370 55.370 56.083 -0.713 18387 8418 1 11 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.341 0.430 18387 8419 1 11 . 1 1 25 25 ASN H H 25 8.505 8.505 8.799 -0.294 18387 8420 1 11 . 1 1 26 26 ASP N N 26 119.722 119.722 118.498 1.224 18387 8421 1 11 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.399 -0.194 18387 8422 1 11 . 1 1 26 26 ASP C C 26 176.708 176.708 176.104 0.604 18387 8423 1 11 . 1 1 26 26 ASP CA C 26 56.525 56.525 55.459 1.066 18387 8424 1 11 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.323 -1.043 18387 8425 1 11 . 1 1 26 26 ASP H H 26 7.731 7.731 7.758 -0.027 18387 8426 1 11 . 1 1 27 27 PHE N N 27 116.827 116.827 117.539 -0.712 18387 8427 1 11 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.618 -0.138 18387 8428 1 11 . 1 1 27 27 PHE C C 27 174.227 174.227 174.500 -0.273 18387 8429 1 11 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.404 -0.333 18387 8430 1 11 . 1 1 27 27 PHE CB C 27 39.719 39.719 40.395 -0.675 18387 8431 1 11 . 1 1 27 27 PHE H H 27 7.390 7.390 7.317 0.073 18387 8432 1 11 . 1 1 28 28 LYS N N 28 120.357 120.357 122.454 -2.097 18387 8433 1 11 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.213 0.174 18387 8434 1 11 . 1 1 28 28 LYS C C 28 177.845 177.845 176.610 1.235 18387 8435 1 11 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.573 0.429 18387 8436 1 11 . 1 1 28 28 LYS CB C 28 32.544 32.544 31.150 1.394 18387 8437 1 11 . 1 1 28 28 LYS H H 28 6.883 6.883 7.592 -0.709 18387 8438 1 11 . 1 1 29 29 GLY N N 29 112.653 112.653 111.360 1.293 18387 8439 1 11 . 1 1 29 29 GLY C C 29 173.799 173.799 173.762 0.037 18387 8440 1 11 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.921 0.067 18387 8441 1 11 . 1 1 29 29 GLY H H 29 8.930 8.930 8.165 0.765 18387 8442 1 11 . 1 1 30 30 LYS N N 30 120.516 120.516 119.788 0.728 18387 8443 1 11 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.562 0.073 18387 8444 1 11 . 1 1 30 30 LYS C C 30 176.505 176.505 175.129 1.376 18387 8445 1 11 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.623 0.557 18387 8446 1 11 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.958 -1.101 18387 8447 1 11 . 1 1 30 30 LYS H H 30 8.098 8.098 7.628 0.470 18387 8448 1 11 . 1 1 31 31 TYR N N 31 117.383 117.383 119.805 -2.422 18387 8449 1 11 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.785 -0.131 18387 8450 1 11 . 1 1 31 31 TYR C C 31 175.551 175.551 175.858 -0.307 18387 8451 1 11 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.885 1.280 18387 8452 1 11 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.493 2.700 18387 8453 1 11 . 1 1 31 31 TYR H H 31 8.263 8.263 8.883 -0.620 18387 8454 1 11 . 1 1 32 32 VAL N N 32 120.900 120.900 125.064 -4.164 18387 8455 1 11 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.921 -0.482 18387 8456 1 11 . 1 1 32 32 VAL C C 32 175.975 175.975 175.012 0.963 18387 8457 1 11 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.519 -0.813 18387 8458 1 11 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.489 3.018 18387 8459 1 11 . 1 1 32 32 VAL H H 32 9.244 9.244 9.285 -0.041 18387 8460 1 11 . 1 1 33 33 LEU N N 33 130.058 130.058 130.811 -0.753 18387 8461 1 11 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.218 -0.045 18387 8462 1 11 . 1 1 33 33 LEU C C 33 174.693 174.693 175.197 -0.504 18387 8463 1 11 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.455 -0.107 18387 8464 1 11 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.781 0.540 18387 8465 1 11 . 1 1 33 33 LEU H H 33 8.161 8.161 8.439 -0.278 18387 8466 1 11 . 1 1 34 34 VAL N N 34 129.232 129.232 129.065 0.167 18387 8467 1 11 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.782 0.200 18387 8468 1 11 . 1 1 34 34 VAL C C 34 174.285 174.285 174.806 -0.521 18387 8469 1 11 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.927 0.579 18387 8470 1 11 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.747 -0.369 18387 8471 1 11 . 1 1 34 34 VAL H H 34 9.296 9.296 9.298 -0.002 18387 8472 1 11 . 1 1 35 35 ASP N N 35 123.675 123.675 129.263 -5.588 18387 8473 1 11 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.982 0.367 18387 8474 1 11 . 1 1 35 35 ASP C C 35 174.258 174.258 175.537 -1.279 18387 8475 1 11 . 1 1 35 35 ASP CA C 35 51.054 51.054 53.388 -2.334 18387 8476 1 11 . 1 1 35 35 ASP CB C 35 40.462 40.462 40.804 -0.342 18387 8477 1 11 . 1 1 35 35 ASP H H 35 8.015 8.015 8.217 -0.202 18387 8478 1 11 . 1 1 36 36 PHE N N 36 126.959 126.959 125.278 1.681 18387 8479 1 11 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.076 0.859 18387 8480 1 11 . 1 1 36 36 PHE C C 36 175.432 175.432 175.577 -0.145 18387 8481 1 11 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.452 -0.357 18387 8482 1 11 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.377 0.653 18387 8483 1 11 . 1 1 36 36 PHE H H 36 9.171 9.171 9.144 0.027 18387 8484 1 11 . 1 1 37 37 TRP N N 37 120.839 120.839 123.006 -2.167 18387 8485 1 11 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.293 0.464 18387 8486 1 11 . 1 1 37 37 TRP C C 37 172.412 172.412 173.126 -0.714 18387 8487 1 11 . 1 1 37 37 TRP CA C 37 55.909 55.909 56.267 -0.358 18387 8488 1 11 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.743 -0.063 18387 8489 1 11 . 1 1 37 37 TRP H H 37 9.280 9.280 8.953 0.327 18387 8490 1 11 . 1 1 38 38 PHE N N 38 109.215 109.215 112.356 -3.141 18387 8491 1 11 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.163 -0.230 18387 8492 1 11 . 1 1 38 38 PHE C C 38 176.141 176.141 172.726 3.415 18387 8493 1 11 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.883 0.128 18387 8494 1 11 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.064 -0.445 18387 8495 1 11 . 1 1 38 38 PHE H H 38 7.062 7.062 7.911 -0.849 18387 8496 1 11 . 1 1 39 39 ALA N N 39 125.193 125.193 123.648 1.545 18387 8497 1 11 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.357 -0.292 18387 8498 1 11 . 1 1 39 39 ALA C C 39 179.349 179.349 176.417 2.932 18387 8499 1 11 . 1 1 39 39 ALA CA C 39 56.064 56.064 52.826 3.238 18387 8500 1 11 . 1 1 39 39 ALA CB C 39 19.897 19.897 17.282 2.615 18387 8501 1 11 . 1 1 39 39 ALA H H 39 10.355 10.355 9.135 1.220 18387 8502 1 11 . 1 1 40 40 GLY N N 40 103.437 103.437 109.586 -6.149 18387 8503 1 11 . 1 1 40 40 GLY C C 40 172.732 172.732 174.071 -1.339 18387 8504 1 11 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.683 -0.747 18387 8505 1 11 . 1 1 40 40 GLY H H 40 8.583 8.583 8.009 0.574 18387 8506 1 11 . 1 1 41 41 CYS N N 41 124.859 124.859 121.826 3.033 18387 8507 1 11 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.549 -0.145 18387 8508 1 11 . 1 1 41 41 CYS C C 41 176.620 176.620 175.495 1.125 18387 8509 1 11 . 1 1 41 41 CYS CA C 41 58.375 58.375 58.255 0.120 18387 8510 1 11 . 1 1 41 41 CYS CB C 41 28.376 28.376 26.932 1.444 18387 8511 1 11 . 1 1 41 41 CYS H H 41 6.946 6.946 7.164 -0.218 18387 8512 1 11 . 1 1 42 42 SER HA H 42 4.040 4.040 4.328 -0.288 18387 8513 1 11 . 1 1 42 42 SER CA C 42 61.552 61.552 60.054 1.498 18387 8514 1 11 . 1 1 42 42 SER CB C 42 62.675 62.675 62.809 -0.134 18387 8515 1 11 . 1 1 43 43 TRP N N 43 129.748 129.748 121.714 8.034 18387 8516 1 11 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.668 -0.119 18387 8517 1 11 . 1 1 43 43 TRP C C 43 180.400 180.400 177.235 3.165 18387 8518 1 11 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.898 1.351 18387 8519 1 11 . 1 1 43 43 TRP CB C 43 29.592 29.592 30.172 -0.580 18387 8520 1 11 . 1 1 44 44 CYS N N 44 124.462 124.462 117.734 6.728 18387 8521 1 11 . 1 1 44 44 CYS HA H 44 4.251 4.251 3.981 0.270 18387 8522 1 11 . 1 1 44 44 CYS C C 44 178.643 178.643 176.874 1.769 18387 8523 1 11 . 1 1 44 44 CYS CA C 44 64.849 64.849 64.003 0.846 18387 8524 1 11 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.846 2.576 18387 8525 1 11 . 1 1 44 44 CYS H H 44 9.591 9.591 8.038 1.553 18387 8526 1 11 . 1 1 45 45 ARG N N 45 117.248 117.248 117.949 -0.701 18387 8527 1 11 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.260 -0.084 18387 8528 1 11 . 1 1 45 45 ARG C C 45 180.302 180.302 177.303 2.999 18387 8529 1 11 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.768 -0.825 18387 8530 1 11 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.446 -1.815 18387 8531 1 11 . 1 1 45 45 ARG H H 45 7.955 7.955 8.304 -0.349 18387 8532 1 11 . 1 1 46 46 LYS N N 46 120.318 120.318 117.667 2.651 18387 8533 1 11 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.038 0.234 18387 8534 1 11 . 1 1 46 46 LYS C C 46 177.755 177.755 177.275 0.480 18387 8535 1 11 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.939 0.830 18387 8536 1 11 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.007 1.150 18387 8537 1 11 . 1 1 46 46 LYS H H 46 8.129 8.129 7.501 0.628 18387 8538 1 11 . 1 1 47 47 GLU N N 47 114.278 114.278 117.580 -3.302 18387 8539 1 11 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.330 0.561 18387 8540 1 11 . 1 1 47 47 GLU C C 47 178.701 178.701 178.191 0.510 18387 8541 1 11 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.420 -1.866 18387 8542 1 11 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.611 0.155 18387 8543 1 11 . 1 1 47 47 GLU H H 47 7.386 7.386 7.438 -0.052 18387 8544 1 11 . 1 1 48 48 THR N N 48 115.665 115.665 117.083 -1.418 18387 8545 1 11 . 1 1 48 48 THR HA H 48 4.048 4.048 4.212 -0.164 18387 8546 1 11 . 1 1 48 48 THR C C 48 172.392 172.392 174.394 -2.002 18387 8547 1 11 . 1 1 48 48 THR CA C 48 69.426 69.426 68.574 0.852 18387 8548 1 11 . 1 1 48 48 THR CB C 48 66.906 66.906 66.453 0.453 18387 8549 1 11 . 1 1 48 48 THR H H 48 7.810 7.810 7.689 0.121 18387 8550 1 11 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.088 0.201 18387 8551 1 11 . 1 1 49 49 PRO C C 49 179.828 179.828 178.847 0.981 18387 8552 1 11 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.070 0.529 18387 8553 1 11 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.930 0.104 18387 8554 1 11 . 1 1 50 50 TYR N N 50 116.950 116.950 116.125 0.825 18387 8555 1 11 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.141 -0.003 18387 8556 1 11 . 1 1 50 50 TYR C C 50 179.488 179.488 178.551 0.937 18387 8557 1 11 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.376 -0.241 18387 8558 1 11 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.868 0.433 18387 8559 1 11 . 1 1 50 50 TYR H H 50 7.071 7.071 7.315 -0.244 18387 8560 1 11 . 1 1 51 51 LEU N N 51 123.989 123.989 120.774 3.215 18387 8561 1 11 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.849 -0.179 18387 8562 1 11 . 1 1 51 51 LEU C C 51 178.072 178.072 178.899 -0.827 18387 8563 1 11 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.205 0.471 18387 8564 1 11 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.580 1.037 18387 8565 1 11 . 1 1 51 51 LEU H H 51 8.243 8.243 8.274 -0.031 18387 8566 1 11 . 1 1 52 52 LEU N N 52 119.857 119.857 119.631 0.226 18387 8567 1 11 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.210 0.117 18387 8568 1 11 . 1 1 52 52 LEU C C 52 178.704 178.704 178.288 0.416 18387 8569 1 11 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.482 0.093 18387 8570 1 11 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.702 1.036 18387 8571 1 11 . 1 1 52 52 LEU H H 52 9.085 9.085 8.892 0.193 18387 8572 1 11 . 1 1 53 53 LYS N N 53 118.658 118.658 119.412 -0.754 18387 8573 1 11 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.954 0.155 18387 8574 1 11 . 1 1 53 53 LYS C C 53 179.786 179.786 178.924 0.862 18387 8575 1 11 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.165 0.556 18387 8576 1 11 . 1 1 53 53 LYS CB C 53 33.159 33.159 31.643 1.516 18387 8577 1 11 . 1 1 53 53 LYS H H 53 7.807 7.807 7.881 -0.074 18387 8578 1 11 . 1 1 54 54 THR N N 54 116.869 116.869 116.773 0.096 18387 8579 1 11 . 1 1 54 54 THR HA H 54 3.965 3.965 4.042 -0.077 18387 8580 1 11 . 1 1 54 54 THR C C 54 175.328 175.328 176.452 -1.124 18387 8581 1 11 . 1 1 54 54 THR CA C 54 67.683 67.683 67.268 0.415 18387 8582 1 11 . 1 1 54 54 THR CB C 54 68.452 68.452 68.840 -0.388 18387 8583 1 11 . 1 1 54 54 THR H H 54 7.771 7.771 8.385 -0.614 18387 8584 1 11 . 1 1 55 55 TYR N N 55 122.202 122.202 123.055 -0.853 18387 8585 1 11 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.280 -0.008 18387 8586 1 11 . 1 1 55 55 TYR C C 55 176.809 176.809 177.365 -0.556 18387 8587 1 11 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.033 0.704 18387 8588 1 11 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.305 0.975 18387 8589 1 11 . 1 1 55 55 TYR H H 55 9.145 9.145 8.784 0.361 18387 8590 1 11 . 1 1 56 56 ASN N N 56 113.858 113.858 117.239 -3.381 18387 8591 1 11 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.266 -0.003 18387 8592 1 11 . 1 1 56 56 ASN C C 56 177.427 177.427 177.013 0.414 18387 8593 1 11 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.603 0.327 18387 8594 1 11 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.386 -0.432 18387 8595 1 11 . 1 1 56 56 ASN H H 56 8.850 8.850 8.484 0.366 18387 8596 1 11 . 1 1 57 57 ALA N N 57 118.829 118.829 120.336 -1.507 18387 8597 1 11 . 1 1 57 57 ALA HA H 57 4.064 4.064 3.914 0.150 18387 8598 1 11 . 1 1 57 57 ALA C C 57 180.445 180.445 178.201 2.244 18387 8599 1 11 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.968 0.383 18387 8600 1 11 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.451 0.743 18387 8601 1 11 . 1 1 57 57 ALA H H 57 7.436 7.436 7.620 -0.184 18387 8602 1 11 . 1 1 58 58 PHE N N 58 112.082 112.082 114.275 -2.193 18387 8603 1 11 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.782 0.139 18387 8604 1 11 . 1 1 58 58 PHE C C 58 176.999 176.999 176.355 0.644 18387 8605 1 11 . 1 1 58 58 PHE CA C 58 58.067 58.067 56.621 1.446 18387 8606 1 11 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.052 1.438 18387 8607 1 11 . 1 1 58 58 PHE H H 58 7.480 7.480 7.492 -0.012 18387 8608 1 11 . 1 1 59 59 LYS N N 59 120.666 120.666 121.868 -1.202 18387 8609 1 11 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.322 0.481 18387 8610 1 11 . 1 1 59 59 LYS C C 59 177.157 177.157 178.247 -1.090 18387 8611 1 11 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.868 -0.787 18387 8612 1 11 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.532 -0.964 18387 8613 1 11 . 1 1 59 59 LYS H H 59 8.411 8.411 7.804 0.607 18387 8614 1 11 . 1 1 60 60 ASP N N 60 118.908 118.908 119.031 -0.123 18387 8615 1 11 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.508 0.617 18387 8616 1 11 . 1 1 60 60 ASP C C 60 176.889 176.889 178.646 -1.757 18387 8617 1 11 . 1 1 60 60 ASP CA C 60 54.649 54.649 57.045 -2.397 18387 8618 1 11 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.456 0.256 18387 8619 1 11 . 1 1 60 60 ASP H H 60 8.574 8.574 8.658 -0.084 18387 8620 1 11 . 1 1 61 61 LYS N N 61 121.021 121.021 120.746 0.275 18387 8621 1 11 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.190 0.524 18387 8622 1 11 . 1 1 61 61 LYS C C 61 175.968 175.968 178.170 -2.202 18387 8623 1 11 . 1 1 61 61 LYS CA C 61 55.137 55.137 58.601 -3.464 18387 8624 1 11 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.014 0.063 18387 8625 1 11 . 1 1 61 61 LYS H H 61 8.278 8.278 8.476 -0.198 18387 8626 1 11 . 1 1 62 62 GLY C C 62 173.837 173.837 172.438 1.399 18387 8627 1 11 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.535 1.515 18387 8628 1 11 . 1 1 63 63 PHE N N 63 120.476 120.476 122.165 -1.689 18387 8629 1 11 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.826 0.207 18387 8630 1 11 . 1 1 63 63 PHE C C 63 173.613 173.613 172.917 0.696 18387 8631 1 11 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.174 -0.324 18387 8632 1 11 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.041 -0.366 18387 8633 1 11 . 1 1 63 63 PHE H H 63 7.413 7.413 8.384 -0.971 18387 8634 1 11 . 1 1 64 64 THR N N 64 119.903 119.903 121.032 -1.129 18387 8635 1 11 . 1 1 64 64 THR HA H 64 4.097 4.097 4.621 -0.524 18387 8636 1 11 . 1 1 64 64 THR C C 64 170.397 170.397 172.697 -2.300 18387 8637 1 11 . 1 1 64 64 THR CA C 64 60.261 60.261 61.432 -1.171 18387 8638 1 11 . 1 1 64 64 THR CB C 64 69.507 69.507 72.206 -2.699 18387 8639 1 11 . 1 1 64 64 THR H H 64 7.665 7.665 8.504 -0.839 18387 8640 1 11 . 1 1 65 65 ILE N N 65 117.277 117.277 123.616 -6.339 18387 8641 1 11 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.106 0.370 18387 8642 1 11 . 1 1 65 65 ILE C C 65 173.056 173.056 173.935 -0.879 18387 8643 1 11 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.730 -1.022 18387 8644 1 11 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.865 0.980 18387 8645 1 11 . 1 1 65 65 ILE H H 65 7.321 7.321 8.585 -1.264 18387 8646 1 11 . 1 1 66 66 TYR N N 66 131.968 131.968 128.739 3.229 18387 8647 1 11 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.007 0.240 18387 8648 1 11 . 1 1 66 66 TYR C C 66 174.074 174.074 174.646 -0.572 18387 8649 1 11 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.268 -0.303 18387 8650 1 11 . 1 1 66 66 TYR CB C 66 41.117 41.117 40.020 1.097 18387 8651 1 11 . 1 1 66 66 TYR H H 66 9.038 9.038 9.153 -0.115 18387 8652 1 11 . 1 1 67 67 GLY N N 67 114.364 114.364 115.452 -1.088 18387 8653 1 11 . 1 1 67 67 GLY C C 67 172.461 172.461 172.406 0.055 18387 8654 1 11 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.285 0.715 18387 8655 1 11 . 1 1 67 67 GLY H H 67 9.188 9.188 9.260 -0.072 18387 8656 1 11 . 1 1 68 68 VAL N N 68 126.938 126.938 121.433 5.505 18387 8657 1 11 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.776 -0.640 18387 8658 1 11 . 1 1 68 68 VAL C C 68 173.822 173.822 174.754 -0.932 18387 8659 1 11 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.930 1.568 18387 8660 1 11 . 1 1 68 68 VAL CB C 68 33.558 33.558 31.973 1.585 18387 8661 1 11 . 1 1 68 68 VAL H H 68 9.309 9.309 8.626 0.683 18387 8662 1 11 . 1 1 69 69 SER N N 69 118.813 118.813 123.158 -4.345 18387 8663 1 11 . 1 1 69 69 SER HA H 69 5.527 5.527 4.590 0.937 18387 8664 1 11 . 1 1 69 69 SER C C 69 175.753 175.753 173.252 2.501 18387 8665 1 11 . 1 1 69 69 SER CA C 69 54.407 54.407 57.190 -2.783 18387 8666 1 11 . 1 1 69 69 SER CB C 69 63.630 63.630 64.963 -1.333 18387 8667 1 11 . 1 1 69 69 SER H H 69 8.124 8.124 9.009 -0.885 18387 8668 1 11 . 1 1 70 70 THR N N 70 113.861 113.861 117.463 -3.602 18387 8669 1 11 . 1 1 70 70 THR HA H 70 4.381 4.381 4.468 -0.087 18387 8670 1 11 . 1 1 70 70 THR C C 70 175.001 175.001 172.852 2.149 18387 8671 1 11 . 1 1 70 70 THR CA C 70 60.259 60.259 59.625 0.634 18387 8672 1 11 . 1 1 70 70 THR CB C 70 67.291 67.291 68.427 -1.136 18387 8673 1 11 . 1 1 70 70 THR H H 70 7.656 7.656 8.129 -0.473 18387 8674 1 11 . 1 1 71 71 ASP N N 71 125.133 125.133 120.959 4.174 18387 8675 1 11 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.496 -0.426 18387 8676 1 11 . 1 1 71 71 ASP C C 71 175.685 175.685 176.794 -1.109 18387 8677 1 11 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.346 2.267 18387 8678 1 11 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.333 1.036 18387 8679 1 11 . 1 1 71 71 ASP H H 71 8.931 8.931 7.548 1.383 18387 8680 1 11 . 1 1 72 72 ARG N N 72 118.814 118.814 118.612 0.202 18387 8681 1 11 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.217 -0.022 18387 8682 1 11 . 1 1 72 72 ARG C C 72 177.300 177.300 176.586 0.714 18387 8683 1 11 . 1 1 72 72 ARG CA C 72 56.809 56.809 55.901 0.908 18387 8684 1 11 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.364 0.747 18387 8685 1 11 . 1 1 72 72 ARG H H 72 8.057 8.057 8.827 -0.770 18387 8686 1 11 . 1 1 73 73 ARG N N 73 118.174 118.174 117.287 0.887 18387 8687 1 11 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.513 0.241 18387 8688 1 11 . 1 1 73 73 ARG C C 73 176.503 176.503 175.044 1.459 18387 8689 1 11 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.188 -0.652 18387 8690 1 11 . 1 1 73 73 ARG CB C 73 31.028 31.028 31.581 -0.553 18387 8691 1 11 . 1 1 73 73 ARG H H 73 8.639 8.639 7.372 1.267 18387 8692 1 11 . 1 1 74 74 GLU N N 74 127.609 127.609 123.002 4.607 18387 8693 1 11 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.171 -0.092 18387 8694 1 11 . 1 1 74 74 GLU C C 74 178.107 178.107 177.633 0.474 18387 8695 1 11 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.650 -0.865 18387 8696 1 11 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.945 0.153 18387 8697 1 11 . 1 1 74 74 GLU H H 74 9.129 9.129 9.007 0.122 18387 8698 1 11 . 1 1 75 75 GLU N N 75 117.874 117.874 118.880 -1.006 18387 8699 1 11 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.099 0.001 18387 8700 1 11 . 1 1 75 75 GLU C C 75 178.993 178.993 178.573 0.420 18387 8701 1 11 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.752 0.375 18387 8702 1 11 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.872 0.419 18387 8703 1 11 . 1 1 75 75 GLU H H 75 9.745 9.745 8.788 0.957 18387 8704 1 11 . 1 1 76 76 ASP N N 76 119.182 119.182 119.753 -0.571 18387 8705 1 11 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.436 -0.070 18387 8706 1 11 . 1 1 76 76 ASP C C 76 178.107 178.107 177.964 0.143 18387 8707 1 11 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.577 -0.604 18387 8708 1 11 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.427 0.093 18387 8709 1 11 . 1 1 76 76 ASP H H 76 7.004 7.004 8.405 -1.401 18387 8710 1 11 . 1 1 77 77 TRP N N 77 123.008 123.008 122.255 0.753 18387 8711 1 11 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.193 -0.044 18387 8712 1 11 . 1 1 77 77 TRP C C 77 176.236 176.236 178.295 -2.059 18387 8713 1 11 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.773 -0.290 18387 8714 1 11 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.332 -0.797 18387 8715 1 11 . 1 1 77 77 TRP H H 77 7.112 7.112 8.463 -1.351 18387 8716 1 11 . 1 1 78 78 LYS N N 78 115.727 115.727 118.681 -2.954 18387 8717 1 11 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.399 -0.154 18387 8718 1 11 . 1 1 78 78 LYS C C 78 179.426 179.426 178.972 0.454 18387 8719 1 11 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.541 0.891 18387 8720 1 11 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.626 1.119 18387 8721 1 11 . 1 1 78 78 LYS H H 78 8.431 8.431 8.549 -0.118 18387 8722 1 11 . 1 1 79 79 LYS N N 79 118.321 118.321 119.341 -1.020 18387 8723 1 11 . 1 1 79 79 LYS HA H 79 4.020 4.020 4.008 0.012 18387 8724 1 11 . 1 1 79 79 LYS C C 79 178.239 178.239 178.666 -0.427 18387 8725 1 11 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.060 0.007 18387 8726 1 11 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.364 0.099 18387 8727 1 11 . 1 1 79 79 LYS H H 79 7.690 7.690 7.979 -0.289 18387 8728 1 11 . 1 1 80 80 ALA N N 80 120.679 120.679 122.205 -1.526 18387 8729 1 11 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.142 0.013 18387 8730 1 11 . 1 1 80 80 ALA C C 80 178.811 178.811 179.986 -1.175 18387 8731 1 11 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.098 -0.011 18387 8732 1 11 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.455 0.303 18387 8733 1 11 . 1 1 80 80 ALA H H 80 7.560 7.560 8.286 -0.726 18387 8734 1 11 . 1 1 81 81 ILE N N 81 118.019 118.019 119.628 -1.609 18387 8735 1 11 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.522 -0.120 18387 8736 1 11 . 1 1 81 81 ILE C C 81 178.113 178.113 178.088 0.025 18387 8737 1 11 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.834 -0.314 18387 8738 1 11 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.661 0.543 18387 8739 1 11 . 1 1 81 81 ILE H H 81 7.514 7.514 8.371 -0.857 18387 8740 1 11 . 1 1 82 82 GLU N N 82 117.252 117.252 119.752 -2.500 18387 8741 1 11 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.845 0.249 18387 8742 1 11 . 1 1 82 82 GLU C C 82 179.558 179.558 178.749 0.809 18387 8743 1 11 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.918 -0.338 18387 8744 1 11 . 1 1 82 82 GLU CB C 82 29.383 29.383 28.845 0.538 18387 8745 1 11 . 1 1 82 82 GLU H H 82 7.401 7.401 7.682 -0.281 18387 8746 1 11 . 1 1 83 83 GLU N N 83 119.340 119.340 118.865 0.475 18387 8747 1 11 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.014 -0.116 18387 8748 1 11 . 1 1 83 83 GLU C C 83 178.740 178.740 178.241 0.499 18387 8749 1 11 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.045 -0.046 18387 8750 1 11 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.738 0.183 18387 8751 1 11 . 1 1 83 83 GLU H H 83 8.191 8.191 8.263 -0.072 18387 8752 1 11 . 1 1 84 84 ASP N N 84 118.449 118.449 116.398 2.051 18387 8753 1 11 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.443 -0.169 18387 8754 1 11 . 1 1 84 84 ASP C C 84 175.597 175.597 176.174 -0.577 18387 8755 1 11 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.831 0.216 18387 8756 1 11 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.315 -1.419 18387 8757 1 11 . 1 1 84 84 ASP H H 84 8.252 8.252 7.783 0.469 18387 8758 1 11 . 1 1 85 85 LYS N N 85 116.410 116.410 114.778 1.632 18387 8759 1 11 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.197 -0.024 18387 8760 1 11 . 1 1 85 85 LYS C C 85 176.856 176.856 175.050 1.806 18387 8761 1 11 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.810 -0.837 18387 8762 1 11 . 1 1 85 85 LYS CB C 85 28.868 28.868 30.622 -1.754 18387 8763 1 11 . 1 1 85 85 LYS H H 85 7.890 7.890 7.889 0.001 18387 8764 1 11 . 1 1 86 86 SER N N 86 112.295 112.295 114.615 -2.320 18387 8765 1 11 . 1 1 86 86 SER HA H 86 3.139 3.139 3.418 -0.279 18387 8766 1 11 . 1 1 86 86 SER C C 86 175.805 175.805 172.724 3.081 18387 8767 1 11 . 1 1 86 86 SER CA C 86 53.637 53.637 56.743 -3.106 18387 8768 1 11 . 1 1 86 86 SER CB C 86 60.736 60.736 61.288 -0.552 18387 8769 1 11 . 1 1 86 86 SER H H 86 7.327 7.327 7.224 0.103 18387 8770 1 11 . 1 1 87 87 TYR N N 87 120.962 120.962 125.130 -4.168 18387 8771 1 11 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.137 0.168 18387 8772 1 11 . 1 1 87 87 TYR C C 87 177.064 177.064 174.459 2.605 18387 8773 1 11 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.949 -0.726 18387 8774 1 11 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.670 -0.317 18387 8775 1 11 . 1 1 87 87 TYR H H 87 6.933 6.933 7.492 -0.559 18387 8776 1 11 . 1 1 88 88 TRP N N 88 118.597 118.597 120.608 -2.011 18387 8777 1 11 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.770 0.081 18387 8778 1 11 . 1 1 88 88 TRP C C 88 175.456 175.456 174.455 1.001 18387 8779 1 11 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.525 1.711 18387 8780 1 11 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.256 -3.529 18387 8781 1 11 . 1 1 88 88 TRP H H 88 6.552 6.552 7.078 -0.526 18387 8782 1 11 . 1 1 89 89 ASN N N 89 118.067 118.067 121.657 -3.590 18387 8783 1 11 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.827 0.222 18387 8784 1 11 . 1 1 89 89 ASN C C 89 173.773 173.773 174.506 -0.733 18387 8785 1 11 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.073 1.383 18387 8786 1 11 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.950 0.247 18387 8787 1 11 . 1 1 89 89 ASN H H 89 7.864 7.864 8.805 -0.941 18387 8788 1 11 . 1 1 90 90 GLN N N 90 125.392 125.392 122.440 2.952 18387 8789 1 11 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.523 -0.026 18387 8790 1 11 . 1 1 90 90 GLN C C 90 176.491 176.491 175.260 1.231 18387 8791 1 11 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.512 0.948 18387 8792 1 11 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.466 -2.239 18387 8793 1 11 . 1 1 90 90 GLN H H 90 7.904 7.904 8.552 -0.648 18387 8794 1 11 . 1 1 91 91 VAL N N 91 114.434 114.434 114.943 -0.509 18387 8795 1 11 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.892 0.588 18387 8796 1 11 . 1 1 91 91 VAL C C 91 174.248 174.248 172.865 1.383 18387 8797 1 11 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.451 -0.445 18387 8798 1 11 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.354 1.284 18387 8799 1 11 . 1 1 91 91 VAL H H 91 9.585 9.585 9.118 0.467 18387 8800 1 11 . 1 1 92 92 LEU N N 92 126.910 126.910 124.310 2.600 18387 8801 1 11 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.347 -0.278 18387 8802 1 11 . 1 1 92 92 LEU C C 92 177.696 177.696 176.050 1.646 18387 8803 1 11 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.628 0.216 18387 8804 1 11 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.151 -0.204 18387 8805 1 11 . 1 1 92 92 LEU H H 92 8.941 8.941 8.406 0.535 18387 8806 1 11 . 1 1 93 93 LEU N N 93 125.673 125.673 127.210 -1.537 18387 8807 1 11 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.103 0.297 18387 8808 1 11 . 1 1 93 93 LEU C C 93 177.291 177.291 176.691 0.600 18387 8809 1 11 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.888 -0.937 18387 8810 1 11 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.398 1.781 18387 8811 1 11 . 1 1 93 93 LEU H H 93 8.038 8.038 8.526 -0.488 18387 8812 1 11 . 1 1 94 94 GLN N N 94 122.206 122.206 121.383 0.823 18387 8813 1 11 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.349 -0.112 18387 8814 1 11 . 1 1 94 94 GLN C C 94 178.246 178.246 176.974 1.272 18387 8815 1 11 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.218 0.557 18387 8816 1 11 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.912 -0.657 18387 8817 1 11 . 1 1 94 94 GLN H H 94 9.298 9.298 8.485 0.813 18387 8818 1 11 . 1 1 95 95 LYS N N 95 122.668 122.668 119.874 2.794 18387 8819 1 11 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.938 0.028 18387 8820 1 11 . 1 1 95 95 LYS C C 95 178.787 178.787 178.034 0.753 18387 8821 1 11 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.695 0.377 18387 8822 1 11 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.111 0.354 18387 8823 1 11 . 1 1 95 95 LYS H H 95 8.645 8.645 8.738 -0.093 18387 8824 1 11 . 1 1 96 96 ASP N N 96 116.775 116.775 118.608 -1.833 18387 8825 1 11 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.472 0.108 18387 8826 1 11 . 1 1 96 96 ASP C C 96 176.220 176.220 177.736 -1.516 18387 8827 1 11 . 1 1 96 96 ASP CA C 96 56.346 56.346 57.103 -0.757 18387 8828 1 11 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.669 -0.112 18387 8829 1 11 . 1 1 96 96 ASP H H 96 8.606 8.606 8.326 0.280 18387 8830 1 11 . 1 1 97 97 ASP N N 97 118.213 118.213 121.518 -3.305 18387 8831 1 11 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.376 0.551 18387 8832 1 11 . 1 1 97 97 ASP C C 97 176.954 176.954 178.147 -1.193 18387 8833 1 11 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.494 -2.135 18387 8834 1 11 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.866 1.458 18387 8835 1 11 . 1 1 97 97 ASP H H 97 7.988 7.988 8.218 -0.230 18387 8836 1 11 . 1 1 98 98 VAL N N 98 118.907 118.907 119.317 -0.410 18387 8837 1 11 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.635 -0.219 18387 8838 1 11 . 1 1 98 98 VAL C C 98 176.470 176.470 178.273 -1.803 18387 8839 1 11 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.626 1.152 18387 8840 1 11 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.028 1.363 18387 8841 1 11 . 1 1 98 98 VAL H H 98 7.098 7.098 8.557 -1.459 18387 8842 1 11 . 1 1 99 99 LYS N N 99 117.909 117.909 119.850 -1.941 18387 8843 1 11 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.972 -0.029 18387 8844 1 11 . 1 1 99 99 LYS C C 99 178.762 178.762 178.961 -0.199 18387 8845 1 11 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.967 0.178 18387 8846 1 11 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.178 -0.166 18387 8847 1 11 . 1 1 99 99 LYS H H 99 8.304 8.304 7.553 0.751 18387 8848 1 11 . 1 1 100 100 ASP N N 100 117.843 117.843 119.049 -1.206 18387 8849 1 11 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.508 -0.030 18387 8850 1 11 . 1 1 100 100 ASP C C 100 179.694 179.694 178.923 0.771 18387 8851 1 11 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.740 -0.214 18387 8852 1 11 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.637 0.191 18387 8853 1 11 . 1 1 100 100 ASP H H 100 8.024 8.024 7.952 0.072 18387 8854 1 11 . 1 1 101 101 VAL N N 101 122.202 122.202 120.316 1.886 18387 8855 1 11 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.902 0.093 18387 8856 1 11 . 1 1 101 101 VAL C C 101 178.533 178.533 177.925 0.608 18387 8857 1 11 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.658 0.344 18387 8858 1 11 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.679 0.358 18387 8859 1 11 . 1 1 101 101 VAL H H 101 8.205 8.205 8.236 -0.031 18387 8860 1 11 . 1 1 102 102 LEU N N 102 118.798 118.798 119.814 -1.016 18387 8861 1 11 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.906 -0.126 18387 8862 1 11 . 1 1 102 102 LEU C C 102 180.254 180.254 178.904 1.350 18387 8863 1 11 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.189 0.752 18387 8864 1 11 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.535 -1.097 18387 8865 1 11 . 1 1 102 102 LEU H H 102 8.422 8.422 7.712 0.710 18387 8866 1 11 . 1 1 103 103 GLU N N 103 116.915 116.915 119.487 -2.572 18387 8867 1 11 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.935 0.200 18387 8868 1 11 . 1 1 103 103 GLU C C 103 180.910 180.910 179.065 1.845 18387 8869 1 11 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.209 0.194 18387 8870 1 11 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.122 0.609 18387 8871 1 11 . 1 1 103 103 GLU H H 103 8.262 8.262 7.953 0.309 18387 8872 1 11 . 1 1 104 104 SER N N 104 117.866 117.866 116.096 1.770 18387 8873 1 11 . 1 1 104 104 SER HA H 104 4.216 4.216 4.063 0.153 18387 8874 1 11 . 1 1 104 104 SER C C 104 175.455 175.455 176.631 -1.176 18387 8875 1 11 . 1 1 104 104 SER CA C 104 62.019 62.019 62.265 -0.246 18387 8876 1 11 . 1 1 104 104 SER CB C 104 62.891 62.891 63.125 -0.234 18387 8877 1 11 . 1 1 104 104 SER H H 104 8.544 8.544 7.873 0.671 18387 8878 1 11 . 1 1 105 105 TYR N N 105 117.278 117.278 118.312 -1.034 18387 8879 1 11 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.223 0.049 18387 8880 1 11 . 1 1 105 105 TYR C C 105 174.750 174.750 175.150 -0.400 18387 8881 1 11 . 1 1 105 105 TYR CA C 105 59.859 59.859 59.266 0.593 18387 8882 1 11 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.376 2.335 18387 8883 1 11 . 1 1 105 105 TYR H H 105 7.691 7.691 7.520 0.171 18387 8884 1 11 . 1 1 106 106 CYS N N 106 116.897 116.897 115.886 1.011 18387 8885 1 11 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.061 -0.166 18387 8886 1 11 . 1 1 106 106 CYS C C 106 174.056 174.056 173.961 0.095 18387 8887 1 11 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.017 -0.407 18387 8888 1 11 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.967 0.065 18387 8889 1 11 . 1 1 106 106 CYS H H 106 7.862 7.862 8.387 -0.525 18387 8890 1 11 . 1 1 107 107 ILE N N 107 118.885 118.885 120.579 -1.694 18387 8891 1 11 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.670 -0.331 18387 8892 1 11 . 1 1 107 107 ILE C C 107 176.793 176.793 175.539 1.254 18387 8893 1 11 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.441 3.304 18387 8894 1 11 . 1 1 107 107 ILE CB C 107 38.079 38.079 34.757 3.322 18387 8895 1 11 . 1 1 107 107 ILE H H 107 7.707 7.707 7.851 -0.144 18387 8896 1 11 . 1 1 108 108 VAL N N 108 123.983 123.983 123.518 0.465 18387 8897 1 11 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.116 0.158 18387 8898 1 11 . 1 1 108 108 VAL C C 108 175.476 175.476 176.331 -0.855 18387 8899 1 11 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.734 -1.110 18387 8900 1 11 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.467 0.541 18387 8901 1 11 . 1 1 108 108 VAL H H 108 8.656 8.656 7.519 1.137 18387 8902 1 11 . 1 1 109 109 GLY N N 109 110.120 110.120 107.052 3.068 18387 8903 1 11 . 1 1 109 109 GLY C C 109 169.982 169.982 172.178 -2.196 18387 8904 1 11 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.700 -0.097 18387 8905 1 11 . 1 1 109 109 GLY H H 109 7.500 7.500 7.662 -0.162 18387 8906 1 11 . 1 1 110 110 PHE N N 110 115.276 115.276 120.979 -5.703 18387 8907 1 11 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.220 -0.446 18387 8908 1 11 . 1 1 110 110 PHE C C 110 174.361 174.361 174.470 -0.109 18387 8909 1 11 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.685 0.002 18387 8910 1 11 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.422 0.529 18387 8911 1 11 . 1 1 110 110 PHE H H 110 8.203 8.203 8.713 -0.510 18387 8912 1 11 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.037 0.322 18387 8913 1 11 . 1 1 111 111 PRO C C 111 175.691 175.691 175.376 0.315 18387 8914 1 11 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.741 0.416 18387 8915 1 11 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.311 1.993 18387 8916 1 11 . 1 1 112 112 HIS N N 112 123.708 123.708 118.454 5.254 18387 8917 1 11 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.965 -0.002 18387 8918 1 11 . 1 1 112 112 HIS C C 112 173.649 173.649 173.812 -0.163 18387 8919 1 11 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.391 0.683 18387 8920 1 11 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.910 -0.713 18387 8921 1 11 . 1 1 112 112 HIS H H 112 8.952 8.952 8.439 0.513 18387 8922 1 11 . 1 1 113 113 ILE N N 113 128.596 128.596 126.537 2.059 18387 8923 1 11 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.357 0.340 18387 8924 1 11 . 1 1 113 113 ILE C C 113 176.130 176.130 174.622 1.508 18387 8925 1 11 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.281 0.714 18387 8926 1 11 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.054 -1.999 18387 8927 1 11 . 1 1 113 113 ILE H H 113 8.808 8.808 8.852 -0.044 18387 8928 1 11 . 1 1 114 114 ILE N N 114 119.668 119.668 122.388 -2.720 18387 8929 1 11 . 1 1 114 114 ILE HA H 114 4.973 4.973 5.283 -0.310 18387 8930 1 11 . 1 1 114 114 ILE C C 114 173.186 173.186 173.721 -0.535 18387 8931 1 11 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.679 0.051 18387 8932 1 11 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.169 0.371 18387 8933 1 11 . 1 1 114 114 ILE H H 114 8.721 8.721 8.819 -0.098 18387 8934 1 11 . 1 1 115 115 LEU N N 115 122.770 122.770 125.084 -2.314 18387 8935 1 11 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.473 -0.198 18387 8936 1 11 . 1 1 115 115 LEU C C 115 173.601 173.601 174.995 -1.394 18387 8937 1 11 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.222 0.560 18387 8938 1 11 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.224 0.910 18387 8939 1 11 . 1 1 115 115 LEU H H 115 8.665 8.665 9.072 -0.407 18387 8940 1 11 . 1 1 116 116 VAL N N 116 130.411 130.411 122.999 7.412 18387 8941 1 11 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.231 -0.373 18387 8942 1 11 . 1 1 116 116 VAL C C 116 174.565 174.565 175.405 -0.840 18387 8943 1 11 . 1 1 116 116 VAL CA C 116 60.804 60.804 59.034 1.770 18387 8944 1 11 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.375 -0.460 18387 8945 1 11 . 1 1 116 116 VAL H H 116 9.472 9.472 9.225 0.247 18387 8946 1 11 . 1 1 117 117 ASP N N 117 127.896 127.896 123.713 4.183 18387 8947 1 11 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.984 -0.592 18387 8948 1 11 . 1 1 117 117 ASP C C 117 176.567 176.567 176.475 0.092 18387 8949 1 11 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.125 0.475 18387 8950 1 11 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.539 0.045 18387 8951 1 11 . 1 1 117 117 ASP H H 117 9.429 9.429 8.739 0.690 18387 8952 1 11 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.355 -0.161 18387 8953 1 11 . 1 1 118 118 PRO C C 118 177.534 177.534 177.757 -0.223 18387 8954 1 11 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.139 0.026 18387 8955 1 11 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.588 1.225 18387 8956 1 11 . 1 1 119 119 GLU N N 119 114.015 114.015 115.951 -1.936 18387 8957 1 11 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.278 0.061 18387 8958 1 11 . 1 1 119 119 GLU C C 119 176.722 176.722 177.332 -0.610 18387 8959 1 11 . 1 1 119 119 GLU CA C 119 55.639 55.639 55.943 -0.304 18387 8960 1 11 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.592 0.985 18387 8961 1 11 . 1 1 119 119 GLU H H 119 7.733 7.733 8.673 -0.940 18387 8962 1 11 . 1 1 120 120 GLY N N 120 108.218 108.218 109.333 -1.115 18387 8963 1 11 . 1 1 120 120 GLY C C 120 174.110 174.110 173.774 0.336 18387 8964 1 11 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.883 -0.487 18387 8965 1 11 . 1 1 120 120 GLY H H 120 8.588 8.588 8.329 0.259 18387 8966 1 11 . 1 1 121 121 LYS N N 121 121.778 121.778 119.424 2.354 18387 8967 1 11 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.185 -0.326 18387 8968 1 11 . 1 1 121 121 LYS C C 121 176.458 176.458 176.135 0.323 18387 8969 1 11 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.163 0.799 18387 8970 1 11 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.435 -1.983 18387 8971 1 11 . 1 1 121 121 LYS H H 121 8.600 8.600 8.567 0.033 18387 8972 1 11 . 1 1 122 122 ILE N N 122 122.058 122.058 125.368 -3.310 18387 8973 1 11 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.246 0.026 18387 8974 1 11 . 1 1 122 122 ILE C C 122 177.084 177.084 177.122 -0.038 18387 8975 1 11 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.851 -0.032 18387 8976 1 11 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.662 1.986 18387 8977 1 11 . 1 1 122 122 ILE H H 122 9.006 9.006 8.596 0.410 18387 8978 1 11 . 1 1 123 123 VAL N N 123 120.561 120.561 125.017 -4.456 18387 8979 1 11 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.363 0.392 18387 8980 1 11 . 1 1 123 123 VAL C C 123 175.584 175.584 175.763 -0.179 18387 8981 1 11 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.557 -1.406 18387 8982 1 11 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.613 0.788 18387 8983 1 11 . 1 1 123 123 VAL H H 123 9.054 9.054 8.489 0.565 18387 8984 1 11 . 1 1 124 124 ALA N N 124 121.102 121.102 122.600 -1.498 18387 8985 1 11 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.839 -0.182 18387 8986 1 11 . 1 1 124 124 ALA C C 124 174.832 174.832 175.108 -0.276 18387 8987 1 11 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.648 0.812 18387 8988 1 11 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.429 1.401 18387 8989 1 11 . 1 1 124 124 ALA H H 124 7.793 7.793 7.865 -0.072 18387 8990 1 11 . 1 1 125 125 LYS N N 125 117.637 117.637 119.371 -1.734 18387 8991 1 11 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.605 0.428 18387 8992 1 11 . 1 1 125 125 LYS C C 125 173.417 173.417 175.547 -2.130 18387 8993 1 11 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.800 -0.659 18387 8994 1 11 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.427 1.224 18387 8995 1 11 . 1 1 125 125 LYS H H 125 8.872 8.872 8.337 0.535 18387 8996 1 11 . 1 1 126 126 GLU N N 126 115.236 115.236 116.659 -1.423 18387 8997 1 11 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.928 0.070 18387 8998 1 11 . 1 1 126 126 GLU C C 126 175.998 175.998 175.723 0.275 18387 8999 1 11 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.681 -0.719 18387 9000 1 11 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.849 -1.414 18387 9001 1 11 . 1 1 126 126 GLU H H 126 7.941 7.941 8.614 -0.673 18387 9002 1 11 . 1 1 127 127 LEU N N 127 118.584 118.584 118.657 -0.073 18387 9003 1 11 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.347 0.035 18387 9004 1 11 . 1 1 127 127 LEU C C 127 176.766 176.766 176.396 0.370 18387 9005 1 11 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.727 -0.118 18387 9006 1 11 . 1 1 127 127 LEU CB C 127 43.963 43.963 43.147 0.816 18387 9007 1 11 . 1 1 127 127 LEU H H 127 7.300 7.300 7.355 -0.055 18387 9008 1 11 . 1 1 128 128 ARG N N 128 118.625 118.625 118.909 -0.284 18387 9009 1 11 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.761 -0.286 18387 9010 1 11 . 1 1 128 128 ARG C C 128 177.113 177.113 178.150 -1.037 18387 9011 1 11 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.127 -0.737 18387 9012 1 11 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.089 1.523 18387 9013 1 11 . 1 1 128 128 ARG H H 128 7.929 7.929 8.144 -0.215 18387 9014 1 11 . 1 1 129 129 GLY N N 129 114.010 114.010 110.363 3.647 18387 9015 1 11 . 1 1 129 129 GLY C C 129 175.931 175.931 175.229 0.702 18387 9016 1 11 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.567 -2.106 18387 9017 1 11 . 1 1 129 129 GLY H H 129 10.649 10.649 9.792 0.857 18387 9018 1 11 . 1 1 130 130 ASP N N 130 123.975 123.975 120.561 3.414 18387 9019 1 11 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.395 1.137 18387 9020 1 11 . 1 1 130 130 ASP C C 130 177.507 177.507 178.009 -0.502 18387 9021 1 11 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.880 -0.508 18387 9022 1 11 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.307 0.596 18387 9023 1 11 . 1 1 130 130 ASP H H 130 8.540 8.540 8.242 0.298 18387 9024 1 11 . 1 1 131 131 ASP N N 131 116.806 116.806 120.305 -3.499 18387 9025 1 11 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.494 0.076 18387 9026 1 11 . 1 1 131 131 ASP C C 131 179.038 179.038 178.147 0.891 18387 9027 1 11 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.805 0.178 18387 9028 1 11 . 1 1 131 131 ASP CB C 131 40.934 40.934 41.276 -0.342 18387 9029 1 11 . 1 1 131 131 ASP H H 131 7.907 7.907 7.593 0.314 18387 9030 1 11 . 1 1 132 132 LEU N N 132 123.869 123.869 119.557 4.312 18387 9031 1 11 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.044 -0.253 18387 9032 1 11 . 1 1 132 132 LEU C C 132 176.343 176.343 178.707 -2.364 18387 9033 1 11 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.163 1.621 18387 9034 1 11 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.603 1.165 18387 9035 1 11 . 1 1 132 132 LEU H H 132 7.542 7.542 8.603 -1.061 18387 9036 1 11 . 1 1 133 133 TYR N N 133 120.042 120.042 121.112 -1.070 18387 9037 1 11 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.242 -0.246 18387 9038 1 11 . 1 1 133 133 TYR C C 133 177.426 177.426 177.386 0.040 18387 9039 1 11 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.356 0.777 18387 9040 1 11 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.517 0.060 18387 9041 1 11 . 1 1 133 133 TYR H H 133 7.384 7.384 8.196 -0.812 18387 9042 1 11 . 1 1 134 134 ASN N N 134 114.936 114.936 116.881 -1.945 18387 9043 1 11 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.071 0.332 18387 9044 1 11 . 1 1 134 134 ASN C C 134 178.703 178.703 177.883 0.820 18387 9045 1 11 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.115 -0.306 18387 9046 1 11 . 1 1 134 134 ASN CB C 134 38.208 38.208 37.805 0.403 18387 9047 1 11 . 1 1 134 134 ASN H H 134 8.399 8.399 7.831 0.568 18387 9048 1 11 . 1 1 135 135 THR N N 135 117.387 117.387 117.444 -0.057 18387 9049 1 11 . 1 1 135 135 THR HA H 135 3.920 3.920 3.872 0.048 18387 9050 1 11 . 1 1 135 135 THR C C 135 175.323 175.323 176.542 -1.219 18387 9051 1 11 . 1 1 135 135 THR CA C 135 67.402 67.402 66.879 0.523 18387 9052 1 11 . 1 1 135 135 THR CB C 135 68.111 68.111 68.828 -0.717 18387 9053 1 11 . 1 1 135 135 THR H H 135 8.265 8.265 8.616 -0.351 18387 9054 1 11 . 1 1 136 136 VAL N N 136 121.207 121.207 121.086 0.121 18387 9055 1 11 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.552 -0.537 18387 9056 1 11 . 1 1 136 136 VAL C C 136 176.457 176.457 177.103 -0.646 18387 9057 1 11 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.732 1.540 18387 9058 1 11 . 1 1 136 136 VAL CB C 136 30.941 30.941 31.343 -0.402 18387 9059 1 11 . 1 1 136 136 VAL H H 136 7.595 7.595 7.994 -0.399 18387 9060 1 11 . 1 1 137 137 GLU N N 137 118.266 118.266 120.167 -1.901 18387 9061 1 11 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.322 -0.640 18387 9062 1 11 . 1 1 137 137 GLU C C 137 177.482 177.482 177.734 -0.252 18387 9063 1 11 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.812 0.118 18387 9064 1 11 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.310 0.472 18387 9065 1 11 . 1 1 137 137 GLU H H 137 8.114 8.114 8.435 -0.321 18387 9066 1 11 . 1 1 138 138 LYS N N 138 116.431 116.431 119.127 -2.696 18387 9067 1 11 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.832 -0.064 18387 9068 1 11 . 1 1 138 138 LYS C C 138 179.193 179.193 178.262 0.931 18387 9069 1 11 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.894 0.146 18387 9070 1 11 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.826 0.333 18387 9071 1 11 . 1 1 138 138 LYS H H 138 7.133 7.133 7.614 -0.481 18387 9072 1 11 . 1 1 139 139 PHE N N 139 116.336 116.336 116.306 0.030 18387 9073 1 11 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.239 -0.229 18387 9074 1 11 . 1 1 139 139 PHE C C 139 177.855 177.855 177.744 0.111 18387 9075 1 11 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.807 1.577 18387 9076 1 11 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.558 -0.206 18387 9077 1 11 . 1 1 139 139 PHE H H 139 7.338 7.338 7.319 0.019 18387 9078 1 11 . 1 1 140 140 VAL N N 140 116.491 116.491 116.233 0.258 18387 9079 1 11 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.584 -0.060 18387 9080 1 11 . 1 1 140 140 VAL C C 140 177.747 177.747 177.145 0.602 18387 9081 1 11 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.512 0.730 18387 9082 1 11 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.298 0.092 18387 9083 1 11 . 1 1 140 140 VAL H H 140 8.332 8.332 8.383 -0.051 18387 9084 1 11 . 1 1 141 141 ASN N N 141 116.956 116.956 118.050 -1.094 18387 9085 1 11 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.696 0.130 18387 9086 1 11 . 1 1 141 141 ASN C C 141 176.997 176.997 174.649 2.348 18387 9087 1 11 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.006 -0.329 18387 9088 1 11 . 1 1 141 141 ASN CB C 141 38.448 38.448 40.757 -2.309 18387 9089 1 11 . 1 1 141 141 ASN H H 141 7.862 7.862 7.481 0.381 18387 9090 1 11 . 1 1 142 142 GLY N N 142 107.938 107.938 105.845 2.093 18387 9091 1 11 . 1 1 142 142 GLY C C 142 174.336 174.336 173.342 0.994 18387 9092 1 11 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.154 0.831 18387 9093 1 11 . 1 1 142 142 GLY H H 142 7.466 7.466 7.683 -0.217 18387 9094 1 11 . 1 1 143 143 ALA N N 143 123.441 123.441 126.136 -2.695 18387 9095 1 11 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.275 0.066 18387 9096 1 11 . 1 1 143 143 ALA C C 143 178.212 178.212 177.056 1.156 18387 9097 1 11 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.314 -0.488 18387 9098 1 11 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.475 -0.231 18387 9099 1 11 . 1 1 143 143 ALA H H 143 7.950 7.950 8.408 -0.458 18387 9100 1 11 . 1 1 144 144 LYS N N 144 120.149 120.149 118.569 1.580 18387 9101 1 11 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.490 -0.195 18387 9102 1 11 . 1 1 144 144 LYS C C 144 176.945 176.945 176.145 0.800 18387 9103 1 11 . 1 1 144 144 LYS CA C 144 56.519 56.519 55.583 0.936 18387 9104 1 11 . 1 1 144 144 LYS CB C 144 33.030 33.030 33.632 -0.602 18387 9105 1 11 . 1 1 144 144 LYS H H 144 8.187 8.187 7.928 0.259 18387 9106 1 11 . 1 1 145 145 GLU N N 145 120.992 120.992 121.310 -0.318 18387 9107 1 11 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.393 -0.098 18387 9108 1 11 . 1 1 145 145 GLU C C 145 177.116 177.116 176.639 0.477 18387 9109 1 11 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.236 0.667 18387 9110 1 11 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.669 0.574 18387 9111 1 11 . 1 1 145 145 GLU H H 145 8.363 8.363 8.603 -0.240 18387 9112 1 11 . 1 1 146 146 GLY N N 146 109.467 109.467 108.787 0.680 18387 9113 1 11 . 1 1 146 146 GLY C C 146 174.108 174.108 174.161 -0.053 18387 9114 1 11 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.503 0.898 18387 9115 1 11 . 1 1 146 146 GLY H H 146 8.371 8.371 7.826 0.545 18387 9116 1 11 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.182 0.427 18387 9117 1 11 . 1 1 151 151 HIS C C 151 174.258 174.258 173.333 0.925 18387 9118 1 11 . 1 1 151 151 HIS CA C 151 56.165 56.165 57.209 -1.044 18387 9119 1 11 . 1 1 151 151 HIS CB C 151 30.833 30.833 27.822 3.011 18387 9120 1 12 . 1 1 2 2 SER HA H 2 3.992 3.992 4.607 -0.615 18387 9121 1 12 . 1 1 2 2 SER CA C 2 57.555 57.555 57.603 -0.048 18387 9122 1 12 . 1 1 2 2 SER CB C 2 64.977 64.977 64.315 0.662 18387 9123 1 12 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.242 0.197 18387 9124 1 12 . 1 1 3 3 LEU C C 3 176.631 176.631 175.498 1.133 18387 9125 1 12 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.900 -0.336 18387 9126 1 12 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.358 0.366 18387 9127 1 12 . 1 1 4 4 ALA N N 4 125.483 125.483 124.428 1.055 18387 9128 1 12 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.774 -0.395 18387 9129 1 12 . 1 1 4 4 ALA C C 4 179.642 179.642 176.527 3.115 18387 9130 1 12 . 1 1 4 4 ALA CA C 4 51.735 51.735 52.050 -0.315 18387 9131 1 12 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.126 -1.374 18387 9132 1 12 . 1 1 4 4 ALA H H 4 8.483 8.483 8.602 -0.119 18387 9133 1 12 . 1 1 5 5 THR HA H 5 3.845 3.845 4.777 -0.932 18387 9134 1 12 . 1 1 5 5 THR C C 5 175.487 175.487 175.448 0.039 18387 9135 1 12 . 1 1 5 5 THR CA C 5 64.531 64.531 59.991 4.540 18387 9136 1 12 . 1 1 5 5 THR CB C 5 68.108 68.108 70.927 -2.819 18387 9137 1 12 . 1 1 6 6 GLY N N 6 114.298 114.298 113.620 0.678 18387 9138 1 12 . 1 1 6 6 GLY C C 6 174.324 174.324 174.534 -0.210 18387 9139 1 12 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.471 -0.636 18387 9140 1 12 . 1 1 6 6 GLY H H 6 9.511 9.511 9.227 0.284 18387 9141 1 12 . 1 1 7 7 SER N N 7 115.270 115.270 117.550 -2.280 18387 9142 1 12 . 1 1 7 7 SER HA H 7 4.500 4.500 4.461 0.039 18387 9143 1 12 . 1 1 7 7 SER C C 7 173.315 173.315 174.383 -1.068 18387 9144 1 12 . 1 1 7 7 SER CA C 7 58.915 58.915 58.802 0.113 18387 9145 1 12 . 1 1 7 7 SER CB C 7 64.308 64.308 63.732 0.576 18387 9146 1 12 . 1 1 7 7 SER H H 7 7.736 7.736 7.974 -0.238 18387 9147 1 12 . 1 1 8 8 VAL N N 8 123.708 123.708 126.107 -2.399 18387 9148 1 12 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.154 -0.322 18387 9149 1 12 . 1 1 8 8 VAL C C 8 176.673 176.673 175.700 0.973 18387 9150 1 12 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.643 2.030 18387 9151 1 12 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.777 -0.555 18387 9152 1 12 . 1 1 8 8 VAL H H 8 8.632 8.632 8.482 0.150 18387 9153 1 12 . 1 1 9 9 ALA N N 9 133.040 133.040 132.310 0.730 18387 9154 1 12 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.691 -0.428 18387 9155 1 12 . 1 1 9 9 ALA C C 9 175.404 175.404 175.317 0.087 18387 9156 1 12 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.294 0.661 18387 9157 1 12 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.799 -0.769 18387 9158 1 12 . 1 1 9 9 ALA H H 9 8.448 8.448 8.864 -0.416 18387 9159 1 12 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.338 -0.007 18387 9160 1 12 . 1 1 10 10 PRO C C 10 175.071 175.071 176.023 -0.952 18387 9161 1 12 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.437 0.204 18387 9162 1 12 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.307 0.017 18387 9163 1 12 . 1 1 11 11 ALA N N 11 124.172 124.172 123.665 0.507 18387 9164 1 12 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.424 -0.180 18387 9165 1 12 . 1 1 11 11 ALA C C 11 177.688 177.688 177.452 0.236 18387 9166 1 12 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.395 2.226 18387 9167 1 12 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.668 0.659 18387 9168 1 12 . 1 1 11 11 ALA H H 11 8.221 8.221 8.264 -0.043 18387 9169 1 12 . 1 1 12 12 ILE N N 12 117.815 117.815 124.250 -6.435 18387 9170 1 12 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.083 0.245 18387 9171 1 12 . 1 1 12 12 ILE C C 12 175.013 175.013 176.034 -1.021 18387 9172 1 12 . 1 1 12 12 ILE CA C 12 62.166 62.166 62.230 -0.064 18387 9173 1 12 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.209 5.081 18387 9174 1 12 . 1 1 12 12 ILE H H 12 7.693 7.693 8.004 -0.311 18387 9175 1 12 . 1 1 13 13 THR N N 13 121.186 121.186 121.572 -0.386 18387 9176 1 12 . 1 1 13 13 THR HA H 13 4.840 4.840 5.097 -0.257 18387 9177 1 12 . 1 1 13 13 THR C C 13 172.625 172.625 173.986 -1.361 18387 9178 1 12 . 1 1 13 13 THR CA C 13 62.297 62.297 60.602 1.696 18387 9179 1 12 . 1 1 13 13 THR CB C 13 71.585 71.585 69.423 2.162 18387 9180 1 12 . 1 1 13 13 THR H H 13 8.363 8.363 8.431 -0.068 18387 9181 1 12 . 1 1 14 14 GLY N N 14 110.785 110.785 113.651 -2.866 18387 9182 1 12 . 1 1 14 14 GLY C C 14 170.040 170.040 172.773 -2.733 18387 9183 1 12 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.880 1.510 18387 9184 1 12 . 1 1 14 14 GLY H H 14 7.993 7.993 8.630 -0.637 18387 9185 1 12 . 1 1 15 15 ILE N N 15 119.088 119.088 122.473 -3.385 18387 9186 1 12 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.743 0.382 18387 9187 1 12 . 1 1 15 15 ILE C C 15 176.359 176.359 176.331 0.028 18387 9188 1 12 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.461 -2.847 18387 9189 1 12 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.511 0.128 18387 9190 1 12 . 1 1 15 15 ILE H H 15 7.973 7.973 8.906 -0.933 18387 9191 1 12 . 1 1 16 16 ASP N N 16 126.633 126.633 127.493 -0.860 18387 9192 1 12 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.007 0.842 18387 9193 1 12 . 1 1 16 16 ASP C C 16 179.190 179.190 177.063 2.127 18387 9194 1 12 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.410 -0.530 18387 9195 1 12 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.874 -0.599 18387 9196 1 12 . 1 1 16 16 ASP H H 16 9.335 9.335 8.914 0.421 18387 9197 1 12 . 1 1 17 17 LEU N N 17 116.648 116.648 119.006 -2.358 18387 9198 1 12 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.364 -0.190 18387 9199 1 12 . 1 1 17 17 LEU C C 17 178.432 178.432 178.427 0.005 18387 9200 1 12 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.520 0.461 18387 9201 1 12 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.419 1.567 18387 9202 1 12 . 1 1 17 17 LEU H H 17 8.071 8.071 8.881 -0.810 18387 9203 1 12 . 1 1 18 18 LYS N N 18 117.401 117.401 117.637 -0.236 18387 9204 1 12 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.303 0.206 18387 9205 1 12 . 1 1 18 18 LYS C C 18 176.793 176.793 177.179 -0.386 18387 9206 1 12 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.554 -2.119 18387 9207 1 12 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.309 -0.246 18387 9208 1 12 . 1 1 18 18 LYS H H 18 8.207 8.207 8.576 -0.369 18387 9209 1 12 . 1 1 19 19 GLY N N 19 108.061 108.061 106.729 1.332 18387 9210 1 12 . 1 1 19 19 GLY C C 19 174.649 174.649 173.921 0.728 18387 9211 1 12 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.637 0.960 18387 9212 1 12 . 1 1 19 19 GLY H H 19 8.099 8.099 8.310 -0.211 18387 9213 1 12 . 1 1 20 20 ASN N N 20 121.012 121.012 121.008 0.004 18387 9214 1 12 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.955 -0.050 18387 9215 1 12 . 1 1 20 20 ASN C C 20 174.827 174.827 174.759 0.068 18387 9216 1 12 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.922 -0.455 18387 9217 1 12 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.232 -0.556 18387 9218 1 12 . 1 1 20 20 ASN H H 20 8.945 8.945 9.094 -0.149 18387 9219 1 12 . 1 1 21 21 SER N N 21 117.285 117.285 118.799 -1.514 18387 9220 1 12 . 1 1 21 21 SER HA H 21 5.000 5.000 4.800 0.200 18387 9221 1 12 . 1 1 21 21 SER C C 21 174.911 174.911 174.515 0.396 18387 9222 1 12 . 1 1 21 21 SER CA C 21 58.730 58.730 58.340 0.390 18387 9223 1 12 . 1 1 21 21 SER CB C 21 63.162 63.162 62.865 0.297 18387 9224 1 12 . 1 1 21 21 SER H H 21 8.740 8.740 8.781 -0.041 18387 9225 1 12 . 1 1 22 22 VAL N N 22 128.665 128.665 128.534 0.131 18387 9226 1 12 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.248 0.132 18387 9227 1 12 . 1 1 22 22 VAL C C 22 176.276 176.276 175.415 0.861 18387 9228 1 12 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.210 0.743 18387 9229 1 12 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.423 2.159 18387 9230 1 12 . 1 1 22 22 VAL H H 22 9.125 9.125 9.123 0.002 18387 9231 1 12 . 1 1 23 23 SER N N 23 127.457 127.457 120.364 7.093 18387 9232 1 12 . 1 1 23 23 SER HA H 23 5.878 5.878 5.429 0.449 18387 9233 1 12 . 1 1 23 23 SER C C 23 174.436 174.436 175.982 -1.546 18387 9234 1 12 . 1 1 23 23 SER CA C 23 57.101 57.101 57.502 -0.401 18387 9235 1 12 . 1 1 23 23 SER CB C 23 66.078 66.078 64.611 1.468 18387 9236 1 12 . 1 1 23 23 SER H H 23 8.971 8.971 9.125 -0.154 18387 9237 1 12 . 1 1 24 24 LEU N N 24 126.734 126.734 124.472 2.262 18387 9238 1 12 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.908 -0.441 18387 9239 1 12 . 1 1 24 24 LEU C C 24 179.852 179.852 177.756 2.096 18387 9240 1 12 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.272 0.931 18387 9241 1 12 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.076 -0.098 18387 9242 1 12 . 1 1 24 24 LEU H H 24 8.450 8.450 9.053 -0.603 18387 9243 1 12 . 1 1 25 25 ASN N N 25 115.642 115.642 116.092 -0.450 18387 9244 1 12 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.428 -0.186 18387 9245 1 12 . 1 1 25 25 ASN C C 25 176.246 176.246 176.522 -0.276 18387 9246 1 12 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.972 -0.602 18387 9247 1 12 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.372 0.399 18387 9248 1 12 . 1 1 25 25 ASN H H 25 8.505 8.505 8.774 -0.269 18387 9249 1 12 . 1 1 26 26 ASP N N 26 119.722 119.722 119.371 0.351 18387 9250 1 12 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.366 -0.161 18387 9251 1 12 . 1 1 26 26 ASP C C 26 176.708 176.708 176.447 0.261 18387 9252 1 12 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.116 0.409 18387 9253 1 12 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.295 -1.015 18387 9254 1 12 . 1 1 26 26 ASP H H 26 7.731 7.731 7.835 -0.104 18387 9255 1 12 . 1 1 27 27 PHE N N 27 116.827 116.827 117.103 -0.276 18387 9256 1 12 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.584 -0.104 18387 9257 1 12 . 1 1 27 27 PHE C C 27 174.227 174.227 175.972 -1.745 18387 9258 1 12 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.149 -0.078 18387 9259 1 12 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.778 -0.059 18387 9260 1 12 . 1 1 27 27 PHE H H 27 7.390 7.390 7.349 0.041 18387 9261 1 12 . 1 1 28 28 LYS N N 28 120.357 120.357 120.731 -0.374 18387 9262 1 12 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.022 0.365 18387 9263 1 12 . 1 1 28 28 LYS C C 28 177.845 177.845 177.554 0.291 18387 9264 1 12 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.741 0.261 18387 9265 1 12 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.896 -0.352 18387 9266 1 12 . 1 1 28 28 LYS H H 28 6.883 6.883 7.566 -0.683 18387 9267 1 12 . 1 1 29 29 GLY N N 29 112.653 112.653 105.695 6.958 18387 9268 1 12 . 1 1 29 29 GLY C C 29 173.799 173.799 173.220 0.579 18387 9269 1 12 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.559 -0.571 18387 9270 1 12 . 1 1 29 29 GLY H H 29 8.930 8.930 8.406 0.524 18387 9271 1 12 . 1 1 30 30 LYS N N 30 120.516 120.516 117.432 3.084 18387 9272 1 12 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.641 -0.006 18387 9273 1 12 . 1 1 30 30 LYS C C 30 176.505 176.505 174.885 1.620 18387 9274 1 12 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.379 0.801 18387 9275 1 12 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.960 -1.103 18387 9276 1 12 . 1 1 30 30 LYS H H 30 8.098 8.098 7.202 0.896 18387 9277 1 12 . 1 1 31 31 TYR N N 31 117.383 117.383 120.221 -2.838 18387 9278 1 12 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.752 -0.098 18387 9279 1 12 . 1 1 31 31 TYR C C 31 175.551 175.551 175.755 -0.204 18387 9280 1 12 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.831 1.334 18387 9281 1 12 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.731 2.462 18387 9282 1 12 . 1 1 31 31 TYR H H 31 8.263 8.263 9.125 -0.862 18387 9283 1 12 . 1 1 32 32 VAL N N 32 120.900 120.900 125.601 -4.701 18387 9284 1 12 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.344 0.095 18387 9285 1 12 . 1 1 32 32 VAL C C 32 175.975 175.975 174.705 1.270 18387 9286 1 12 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.137 -1.431 18387 9287 1 12 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.761 2.747 18387 9288 1 12 . 1 1 32 32 VAL H H 32 9.244 9.244 9.184 0.060 18387 9289 1 12 . 1 1 33 33 LEU N N 33 130.058 130.058 131.522 -1.464 18387 9290 1 12 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.875 0.298 18387 9291 1 12 . 1 1 33 33 LEU C C 33 174.693 174.693 174.950 -0.257 18387 9292 1 12 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.756 -0.408 18387 9293 1 12 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.010 1.311 18387 9294 1 12 . 1 1 33 33 LEU H H 33 8.161 8.161 8.691 -0.530 18387 9295 1 12 . 1 1 34 34 VAL N N 34 129.232 129.232 130.519 -1.287 18387 9296 1 12 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.624 0.358 18387 9297 1 12 . 1 1 34 34 VAL C C 34 174.285 174.285 174.757 -0.472 18387 9298 1 12 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.646 -0.140 18387 9299 1 12 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.175 0.203 18387 9300 1 12 . 1 1 34 34 VAL H H 34 9.296 9.296 9.300 -0.004 18387 9301 1 12 . 1 1 35 35 ASP N N 35 123.675 123.675 129.332 -5.657 18387 9302 1 12 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.011 0.338 18387 9303 1 12 . 1 1 35 35 ASP C C 35 174.258 174.258 175.364 -1.106 18387 9304 1 12 . 1 1 35 35 ASP CA C 35 51.054 51.054 53.974 -2.920 18387 9305 1 12 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.454 -1.992 18387 9306 1 12 . 1 1 35 35 ASP H H 35 8.015 8.015 8.422 -0.407 18387 9307 1 12 . 1 1 36 36 PHE N N 36 126.959 126.959 124.515 2.444 18387 9308 1 12 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.502 0.433 18387 9309 1 12 . 1 1 36 36 PHE C C 36 175.432 175.432 175.896 -0.464 18387 9310 1 12 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.214 -0.119 18387 9311 1 12 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.282 -0.252 18387 9312 1 12 . 1 1 36 36 PHE H H 36 9.171 9.171 9.168 0.003 18387 9313 1 12 . 1 1 37 37 TRP N N 37 120.839 120.839 123.131 -2.292 18387 9314 1 12 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.279 0.478 18387 9315 1 12 . 1 1 37 37 TRP C C 37 172.412 172.412 173.683 -1.271 18387 9316 1 12 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.195 0.714 18387 9317 1 12 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.961 -0.281 18387 9318 1 12 . 1 1 37 37 TRP H H 37 9.280 9.280 9.284 -0.004 18387 9319 1 12 . 1 1 38 38 PHE N N 38 109.215 109.215 112.743 -3.528 18387 9320 1 12 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.741 -0.808 18387 9321 1 12 . 1 1 38 38 PHE C C 38 176.141 176.141 173.956 2.185 18387 9322 1 12 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.373 0.638 18387 9323 1 12 . 1 1 38 38 PHE CB C 38 39.619 39.619 41.285 -1.666 18387 9324 1 12 . 1 1 38 38 PHE H H 38 7.062 7.062 8.084 -1.022 18387 9325 1 12 . 1 1 39 39 ALA N N 39 125.193 125.193 123.315 1.878 18387 9326 1 12 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.408 -0.343 18387 9327 1 12 . 1 1 39 39 ALA C C 39 179.349 179.349 176.603 2.746 18387 9328 1 12 . 1 1 39 39 ALA CA C 39 56.064 56.064 52.458 3.606 18387 9329 1 12 . 1 1 39 39 ALA CB C 39 19.897 19.897 17.251 2.646 18387 9330 1 12 . 1 1 39 39 ALA H H 39 10.355 10.355 9.409 0.946 18387 9331 1 12 . 1 1 40 40 GLY N N 40 103.437 103.437 110.191 -6.754 18387 9332 1 12 . 1 1 40 40 GLY C C 40 172.732 172.732 173.600 -0.868 18387 9333 1 12 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.535 -0.599 18387 9334 1 12 . 1 1 40 40 GLY H H 40 8.583 8.583 7.936 0.647 18387 9335 1 12 . 1 1 41 41 CYS N N 41 124.859 124.859 121.906 2.953 18387 9336 1 12 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.247 0.157 18387 9337 1 12 . 1 1 41 41 CYS C C 41 176.620 176.620 175.153 1.467 18387 9338 1 12 . 1 1 41 41 CYS CA C 41 58.375 58.375 59.281 -0.906 18387 9339 1 12 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.581 -0.205 18387 9340 1 12 . 1 1 41 41 CYS H H 41 6.946 6.946 6.881 0.065 18387 9341 1 12 . 1 1 42 42 SER HA H 42 4.040 4.040 4.106 -0.066 18387 9342 1 12 . 1 1 42 42 SER CA C 42 61.552 61.552 60.971 0.581 18387 9343 1 12 . 1 1 42 42 SER CB C 42 62.675 62.675 62.558 0.117 18387 9344 1 12 . 1 1 43 43 TRP N N 43 129.748 129.748 120.997 8.751 18387 9345 1 12 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.470 0.079 18387 9346 1 12 . 1 1 43 43 TRP C C 43 180.400 180.400 177.864 2.536 18387 9347 1 12 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.898 1.351 18387 9348 1 12 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.363 0.229 18387 9349 1 12 . 1 1 44 44 CYS N N 44 124.462 124.462 115.887 8.575 18387 9350 1 12 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.268 -0.017 18387 9351 1 12 . 1 1 44 44 CYS C C 44 178.643 178.643 176.508 2.135 18387 9352 1 12 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.737 2.112 18387 9353 1 12 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.137 2.285 18387 9354 1 12 . 1 1 44 44 CYS H H 44 9.591 9.591 7.681 1.910 18387 9355 1 12 . 1 1 45 45 ARG N N 45 117.248 117.248 116.716 0.532 18387 9356 1 12 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.491 -0.315 18387 9357 1 12 . 1 1 45 45 ARG C C 45 180.302 180.302 177.276 3.026 18387 9358 1 12 . 1 1 45 45 ARG CA C 45 56.943 56.943 56.504 0.439 18387 9359 1 12 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.999 -2.368 18387 9360 1 12 . 1 1 45 45 ARG H H 45 7.955 7.955 7.422 0.533 18387 9361 1 12 . 1 1 46 46 LYS N N 46 120.318 120.318 119.170 1.148 18387 9362 1 12 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.334 -0.062 18387 9363 1 12 . 1 1 46 46 LYS C C 46 177.755 177.755 178.514 -0.759 18387 9364 1 12 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.968 0.801 18387 9365 1 12 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.583 0.574 18387 9366 1 12 . 1 1 46 46 LYS H H 46 8.129 8.129 7.848 0.281 18387 9367 1 12 . 1 1 47 47 GLU N N 47 114.278 114.278 118.739 -4.461 18387 9368 1 12 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.636 0.255 18387 9369 1 12 . 1 1 47 47 GLU C C 47 178.701 178.701 178.680 0.021 18387 9370 1 12 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.625 -2.071 18387 9371 1 12 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.117 0.648 18387 9372 1 12 . 1 1 47 47 GLU H H 47 7.386 7.386 7.919 -0.533 18387 9373 1 12 . 1 1 48 48 THR N N 48 115.665 115.665 117.205 -1.540 18387 9374 1 12 . 1 1 48 48 THR HA H 48 4.048 4.048 4.237 -0.189 18387 9375 1 12 . 1 1 48 48 THR C C 48 172.392 172.392 174.262 -1.870 18387 9376 1 12 . 1 1 48 48 THR CA C 48 69.426 69.426 68.769 0.658 18387 9377 1 12 . 1 1 48 48 THR CB C 48 66.906 66.906 66.366 0.540 18387 9378 1 12 . 1 1 48 48 THR H H 48 7.810 7.810 8.045 -0.235 18387 9379 1 12 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.115 0.174 18387 9380 1 12 . 1 1 49 49 PRO C C 49 179.828 179.828 178.455 1.373 18387 9381 1 12 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.447 0.152 18387 9382 1 12 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.042 -0.008 18387 9383 1 12 . 1 1 50 50 TYR N N 50 116.950 116.950 116.002 0.948 18387 9384 1 12 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.336 -0.198 18387 9385 1 12 . 1 1 50 50 TYR C C 50 179.488 179.488 178.923 0.565 18387 9386 1 12 . 1 1 50 50 TYR CA C 50 61.135 61.135 60.731 0.404 18387 9387 1 12 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.646 0.655 18387 9388 1 12 . 1 1 50 50 TYR H H 50 7.071 7.071 7.139 -0.068 18387 9389 1 12 . 1 1 51 51 LEU N N 51 123.989 123.989 121.911 2.078 18387 9390 1 12 . 1 1 51 51 LEU HA H 51 3.670 3.670 4.105 -0.435 18387 9391 1 12 . 1 1 51 51 LEU C C 51 178.072 178.072 178.611 -0.539 18387 9392 1 12 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.620 1.056 18387 9393 1 12 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.471 1.146 18387 9394 1 12 . 1 1 51 51 LEU H H 51 8.243 8.243 8.625 -0.382 18387 9395 1 12 . 1 1 52 52 LEU N N 52 119.857 119.857 120.286 -0.429 18387 9396 1 12 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.324 0.003 18387 9397 1 12 . 1 1 52 52 LEU C C 52 178.704 178.704 178.465 0.239 18387 9398 1 12 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.720 -0.145 18387 9399 1 12 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.624 1.114 18387 9400 1 12 . 1 1 52 52 LEU H H 52 9.085 9.085 8.832 0.253 18387 9401 1 12 . 1 1 53 53 LYS N N 53 118.658 118.658 118.932 -0.274 18387 9402 1 12 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.997 0.112 18387 9403 1 12 . 1 1 53 53 LYS C C 53 179.786 179.786 179.056 0.730 18387 9404 1 12 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.919 -0.198 18387 9405 1 12 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.164 0.995 18387 9406 1 12 . 1 1 53 53 LYS H H 53 7.807 7.807 7.902 -0.095 18387 9407 1 12 . 1 1 54 54 THR N N 54 116.869 116.869 116.650 0.219 18387 9408 1 12 . 1 1 54 54 THR HA H 54 3.965 3.965 4.545 -0.580 18387 9409 1 12 . 1 1 54 54 THR C C 54 175.328 175.328 176.741 -1.413 18387 9410 1 12 . 1 1 54 54 THR CA C 54 67.683 67.683 67.040 0.643 18387 9411 1 12 . 1 1 54 54 THR CB C 54 68.452 68.452 68.902 -0.450 18387 9412 1 12 . 1 1 54 54 THR H H 54 7.771 7.771 8.186 -0.415 18387 9413 1 12 . 1 1 55 55 TYR N N 55 122.202 122.202 123.368 -1.166 18387 9414 1 12 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.240 0.032 18387 9415 1 12 . 1 1 55 55 TYR C C 55 176.809 176.809 177.502 -0.693 18387 9416 1 12 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.337 0.400 18387 9417 1 12 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.603 0.677 18387 9418 1 12 . 1 1 55 55 TYR H H 55 9.145 9.145 8.760 0.385 18387 9419 1 12 . 1 1 56 56 ASN N N 56 113.858 113.858 116.642 -2.784 18387 9420 1 12 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.273 -0.010 18387 9421 1 12 . 1 1 56 56 ASN C C 56 177.427 177.427 177.115 0.312 18387 9422 1 12 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.886 0.044 18387 9423 1 12 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.093 -0.139 18387 9424 1 12 . 1 1 56 56 ASN H H 56 8.850 8.850 8.509 0.341 18387 9425 1 12 . 1 1 57 57 ALA N N 57 118.829 118.829 120.544 -1.715 18387 9426 1 12 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.038 0.026 18387 9427 1 12 . 1 1 57 57 ALA C C 57 180.445 180.445 178.581 1.864 18387 9428 1 12 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.310 0.041 18387 9429 1 12 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.894 0.300 18387 9430 1 12 . 1 1 57 57 ALA H H 57 7.436 7.436 7.680 -0.244 18387 9431 1 12 . 1 1 58 58 PHE N N 58 112.082 112.082 115.389 -3.307 18387 9432 1 12 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.565 0.356 18387 9433 1 12 . 1 1 58 58 PHE C C 58 176.999 176.999 175.276 1.723 18387 9434 1 12 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.637 0.430 18387 9435 1 12 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.752 0.738 18387 9436 1 12 . 1 1 58 58 PHE H H 58 7.480 7.480 7.867 -0.387 18387 9437 1 12 . 1 1 59 59 LYS N N 59 120.666 120.666 120.058 0.608 18387 9438 1 12 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.292 0.511 18387 9439 1 12 . 1 1 59 59 LYS C C 59 177.157 177.157 176.824 0.333 18387 9440 1 12 . 1 1 59 59 LYS CA C 59 59.081 59.081 57.448 1.633 18387 9441 1 12 . 1 1 59 59 LYS CB C 59 30.568 30.568 32.745 -2.177 18387 9442 1 12 . 1 1 59 59 LYS H H 59 8.411 8.411 7.784 0.627 18387 9443 1 12 . 1 1 60 60 ASP N N 60 118.908 118.908 119.208 -0.300 18387 9444 1 12 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.384 0.741 18387 9445 1 12 . 1 1 60 60 ASP C C 60 176.889 176.889 175.924 0.965 18387 9446 1 12 . 1 1 60 60 ASP CA C 60 54.649 54.649 56.377 -1.728 18387 9447 1 12 . 1 1 60 60 ASP CB C 60 40.712 40.712 38.939 1.773 18387 9448 1 12 . 1 1 60 60 ASP H H 60 8.574 8.574 9.178 -0.604 18387 9449 1 12 . 1 1 61 61 LYS N N 61 121.021 121.021 118.332 2.689 18387 9450 1 12 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.556 0.158 18387 9451 1 12 . 1 1 61 61 LYS C C 61 175.968 175.968 175.969 -0.001 18387 9452 1 12 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.541 -0.404 18387 9453 1 12 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.761 0.317 18387 9454 1 12 . 1 1 61 61 LYS H H 61 8.278 8.278 7.717 0.561 18387 9455 1 12 . 1 1 62 62 GLY C C 62 173.837 173.837 172.865 0.972 18387 9456 1 12 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.170 1.880 18387 9457 1 12 . 1 1 63 63 PHE N N 63 120.476 120.476 119.852 0.624 18387 9458 1 12 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.695 0.338 18387 9459 1 12 . 1 1 63 63 PHE C C 63 173.613 173.613 173.333 0.280 18387 9460 1 12 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.624 -0.775 18387 9461 1 12 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.024 -0.349 18387 9462 1 12 . 1 1 63 63 PHE H H 63 7.413 7.413 7.788 -0.375 18387 9463 1 12 . 1 1 64 64 THR N N 64 119.903 119.903 118.729 1.174 18387 9464 1 12 . 1 1 64 64 THR HA H 64 4.097 4.097 4.673 -0.576 18387 9465 1 12 . 1 1 64 64 THR C C 64 170.397 170.397 172.159 -1.762 18387 9466 1 12 . 1 1 64 64 THR CA C 64 60.261 60.261 60.010 0.251 18387 9467 1 12 . 1 1 64 64 THR CB C 64 69.507 69.507 71.864 -2.357 18387 9468 1 12 . 1 1 64 64 THR H H 64 7.665 7.665 8.498 -0.833 18387 9469 1 12 . 1 1 65 65 ILE N N 65 117.277 117.277 124.369 -7.092 18387 9470 1 12 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.247 0.229 18387 9471 1 12 . 1 1 65 65 ILE C C 65 173.056 173.056 173.744 -0.688 18387 9472 1 12 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.656 -0.948 18387 9473 1 12 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.435 0.410 18387 9474 1 12 . 1 1 65 65 ILE H H 65 7.321 7.321 8.416 -1.095 18387 9475 1 12 . 1 1 66 66 TYR N N 66 131.968 131.968 129.329 2.639 18387 9476 1 12 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.228 0.019 18387 9477 1 12 . 1 1 66 66 TYR C C 66 174.074 174.074 175.063 -0.989 18387 9478 1 12 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.120 -0.155 18387 9479 1 12 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.637 1.480 18387 9480 1 12 . 1 1 66 66 TYR H H 66 9.038 9.038 9.261 -0.223 18387 9481 1 12 . 1 1 67 67 GLY N N 67 114.364 114.364 115.707 -1.343 18387 9482 1 12 . 1 1 67 67 GLY C C 67 172.461 172.461 172.938 -0.477 18387 9483 1 12 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.896 0.104 18387 9484 1 12 . 1 1 67 67 GLY H H 67 9.188 9.188 9.264 -0.076 18387 9485 1 12 . 1 1 68 68 VAL N N 68 126.938 126.938 127.678 -0.740 18387 9486 1 12 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.177 -0.041 18387 9487 1 12 . 1 1 68 68 VAL C C 68 173.822 173.822 174.558 -0.736 18387 9488 1 12 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.345 0.153 18387 9489 1 12 . 1 1 68 68 VAL CB C 68 33.558 33.558 31.560 1.998 18387 9490 1 12 . 1 1 68 68 VAL H H 68 9.309 9.309 9.101 0.208 18387 9491 1 12 . 1 1 69 69 SER N N 69 118.813 118.813 122.601 -3.788 18387 9492 1 12 . 1 1 69 69 SER HA H 69 5.527 5.527 5.332 0.195 18387 9493 1 12 . 1 1 69 69 SER C C 69 175.753 175.753 173.307 2.446 18387 9494 1 12 . 1 1 69 69 SER CA C 69 54.407 54.407 56.215 -1.808 18387 9495 1 12 . 1 1 69 69 SER CB C 69 63.630 63.630 64.622 -0.992 18387 9496 1 12 . 1 1 69 69 SER H H 69 8.124 8.124 8.861 -0.737 18387 9497 1 12 . 1 1 70 70 THR N N 70 113.861 113.861 118.780 -4.919 18387 9498 1 12 . 1 1 70 70 THR HA H 70 4.381 4.381 4.475 -0.094 18387 9499 1 12 . 1 1 70 70 THR C C 70 175.001 175.001 172.704 2.297 18387 9500 1 12 . 1 1 70 70 THR CA C 70 60.259 60.259 59.855 0.404 18387 9501 1 12 . 1 1 70 70 THR CB C 70 67.291 67.291 68.686 -1.395 18387 9502 1 12 . 1 1 70 70 THR H H 70 7.656 7.656 7.916 -0.260 18387 9503 1 12 . 1 1 71 71 ASP N N 71 125.133 125.133 123.398 1.735 18387 9504 1 12 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.546 -0.476 18387 9505 1 12 . 1 1 71 71 ASP C C 71 175.685 175.685 175.940 -0.255 18387 9506 1 12 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.200 2.412 18387 9507 1 12 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.390 0.979 18387 9508 1 12 . 1 1 71 71 ASP H H 71 8.931 8.931 7.897 1.034 18387 9509 1 12 . 1 1 72 72 ARG N N 72 118.814 118.814 117.795 1.019 18387 9510 1 12 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.414 -0.219 18387 9511 1 12 . 1 1 72 72 ARG C C 72 177.300 177.300 175.833 1.467 18387 9512 1 12 . 1 1 72 72 ARG CA C 72 56.809 56.809 55.306 1.503 18387 9513 1 12 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.452 0.659 18387 9514 1 12 . 1 1 72 72 ARG H H 72 8.057 8.057 8.522 -0.465 18387 9515 1 12 . 1 1 73 73 ARG N N 73 118.174 118.174 120.576 -2.402 18387 9516 1 12 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.697 0.057 18387 9517 1 12 . 1 1 73 73 ARG C C 73 176.503 176.503 176.377 0.126 18387 9518 1 12 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.306 -0.770 18387 9519 1 12 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.063 -1.035 18387 9520 1 12 . 1 1 73 73 ARG H H 73 8.639 8.639 7.799 0.840 18387 9521 1 12 . 1 1 74 74 GLU N N 74 127.609 127.609 126.280 1.329 18387 9522 1 12 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.213 -0.134 18387 9523 1 12 . 1 1 74 74 GLU C C 74 178.107 178.107 177.580 0.527 18387 9524 1 12 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.870 -0.085 18387 9525 1 12 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.772 0.326 18387 9526 1 12 . 1 1 74 74 GLU H H 74 9.129 9.129 9.161 -0.032 18387 9527 1 12 . 1 1 75 75 GLU N N 75 117.874 117.874 119.830 -1.956 18387 9528 1 12 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.106 -0.006 18387 9529 1 12 . 1 1 75 75 GLU C C 75 178.993 178.993 178.712 0.281 18387 9530 1 12 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.847 0.280 18387 9531 1 12 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.874 0.417 18387 9532 1 12 . 1 1 75 75 GLU H H 75 9.745 9.745 8.814 0.931 18387 9533 1 12 . 1 1 76 76 ASP N N 76 119.182 119.182 119.225 -0.043 18387 9534 1 12 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.475 -0.109 18387 9535 1 12 . 1 1 76 76 ASP C C 76 178.107 178.107 178.148 -0.041 18387 9536 1 12 . 1 1 76 76 ASP CA C 76 56.973 56.973 58.036 -1.063 18387 9537 1 12 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.611 -0.091 18387 9538 1 12 . 1 1 76 76 ASP H H 76 7.004 7.004 8.566 -1.562 18387 9539 1 12 . 1 1 77 77 TRP N N 77 123.008 123.008 122.759 0.249 18387 9540 1 12 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.287 -0.138 18387 9541 1 12 . 1 1 77 77 TRP C C 77 176.236 176.236 178.098 -1.862 18387 9542 1 12 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.237 -0.754 18387 9543 1 12 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.216 -0.681 18387 9544 1 12 . 1 1 77 77 TRP H H 77 7.112 7.112 7.875 -0.763 18387 9545 1 12 . 1 1 78 78 LYS N N 78 115.727 115.727 118.656 -2.929 18387 9546 1 12 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.519 -0.274 18387 9547 1 12 . 1 1 78 78 LYS C C 78 179.426 179.426 179.134 0.292 18387 9548 1 12 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.514 0.918 18387 9549 1 12 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.860 0.885 18387 9550 1 12 . 1 1 78 78 LYS H H 78 8.431 8.431 8.453 -0.022 18387 9551 1 12 . 1 1 79 79 LYS N N 79 118.321 118.321 119.308 -0.987 18387 9552 1 12 . 1 1 79 79 LYS HA H 79 4.020 4.020 4.071 -0.051 18387 9553 1 12 . 1 1 79 79 LYS C C 79 178.239 178.239 178.636 -0.397 18387 9554 1 12 . 1 1 79 79 LYS CA C 79 59.067 59.067 58.764 0.303 18387 9555 1 12 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.460 0.003 18387 9556 1 12 . 1 1 79 79 LYS H H 79 7.690 7.690 8.099 -0.409 18387 9557 1 12 . 1 1 80 80 ALA N N 80 120.679 120.679 122.359 -1.680 18387 9558 1 12 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.436 -0.281 18387 9559 1 12 . 1 1 80 80 ALA C C 80 178.811 178.811 179.891 -1.080 18387 9560 1 12 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.883 0.204 18387 9561 1 12 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.439 0.319 18387 9562 1 12 . 1 1 80 80 ALA H H 80 7.560 7.560 8.243 -0.683 18387 9563 1 12 . 1 1 81 81 ILE N N 81 118.019 118.019 118.670 -0.651 18387 9564 1 12 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.536 -0.134 18387 9565 1 12 . 1 1 81 81 ILE C C 81 178.113 178.113 178.213 -0.100 18387 9566 1 12 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.333 0.187 18387 9567 1 12 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.623 0.581 18387 9568 1 12 . 1 1 81 81 ILE H H 81 7.514 7.514 7.851 -0.337 18387 9569 1 12 . 1 1 82 82 GLU N N 82 117.252 117.252 119.941 -2.689 18387 9570 1 12 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.951 0.143 18387 9571 1 12 . 1 1 82 82 GLU C C 82 179.558 179.558 178.216 1.342 18387 9572 1 12 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.761 -0.180 18387 9573 1 12 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.183 0.200 18387 9574 1 12 . 1 1 82 82 GLU H H 82 7.401 7.401 7.649 -0.248 18387 9575 1 12 . 1 1 83 83 GLU N N 83 119.340 119.340 119.018 0.322 18387 9576 1 12 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.011 -0.113 18387 9577 1 12 . 1 1 83 83 GLU C C 83 178.740 178.740 178.280 0.460 18387 9578 1 12 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.599 0.400 18387 9579 1 12 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.951 -0.031 18387 9580 1 12 . 1 1 83 83 GLU H H 83 8.191 8.191 7.841 0.350 18387 9581 1 12 . 1 1 84 84 ASP N N 84 118.449 118.449 115.335 3.114 18387 9582 1 12 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.504 -0.230 18387 9583 1 12 . 1 1 84 84 ASP C C 84 175.597 175.597 175.848 -0.251 18387 9584 1 12 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.338 0.709 18387 9585 1 12 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.015 -1.119 18387 9586 1 12 . 1 1 84 84 ASP H H 84 8.252 8.252 7.717 0.535 18387 9587 1 12 . 1 1 85 85 LYS N N 85 116.410 116.410 114.965 1.445 18387 9588 1 12 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.451 -0.278 18387 9589 1 12 . 1 1 85 85 LYS C C 85 176.856 176.856 174.721 2.135 18387 9590 1 12 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.373 -0.400 18387 9591 1 12 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.150 -0.282 18387 9592 1 12 . 1 1 85 85 LYS H H 85 7.890 7.890 7.657 0.233 18387 9593 1 12 . 1 1 86 86 SER N N 86 112.295 112.295 113.675 -1.380 18387 9594 1 12 . 1 1 86 86 SER HA H 86 3.139 3.139 3.522 -0.383 18387 9595 1 12 . 1 1 86 86 SER C C 86 175.805 175.805 173.242 2.563 18387 9596 1 12 . 1 1 86 86 SER CA C 86 53.637 53.637 57.487 -3.850 18387 9597 1 12 . 1 1 86 86 SER CB C 86 60.736 60.736 62.171 -1.435 18387 9598 1 12 . 1 1 86 86 SER H H 86 7.327 7.327 7.051 0.276 18387 9599 1 12 . 1 1 87 87 TYR N N 87 120.962 120.962 126.499 -5.537 18387 9600 1 12 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.316 -0.011 18387 9601 1 12 . 1 1 87 87 TYR C C 87 177.064 177.064 174.484 2.580 18387 9602 1 12 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.123 0.100 18387 9603 1 12 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.364 -1.012 18387 9604 1 12 . 1 1 87 87 TYR H H 87 6.933 6.933 7.760 -0.827 18387 9605 1 12 . 1 1 88 88 TRP N N 88 118.597 118.597 120.414 -1.817 18387 9606 1 12 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.823 0.028 18387 9607 1 12 . 1 1 88 88 TRP C C 88 175.456 175.456 174.239 1.217 18387 9608 1 12 . 1 1 88 88 TRP CA C 88 56.236 56.236 55.517 0.719 18387 9609 1 12 . 1 1 88 88 TRP CB C 88 25.727 25.727 30.005 -4.278 18387 9610 1 12 . 1 1 88 88 TRP H H 88 6.552 6.552 7.181 -0.629 18387 9611 1 12 . 1 1 89 89 ASN N N 89 118.067 118.067 120.982 -2.915 18387 9612 1 12 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.737 0.312 18387 9613 1 12 . 1 1 89 89 ASN C C 89 173.773 173.773 174.816 -1.043 18387 9614 1 12 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.626 1.830 18387 9615 1 12 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.874 1.323 18387 9616 1 12 . 1 1 89 89 ASN H H 89 7.864 7.864 8.572 -0.708 18387 9617 1 12 . 1 1 90 90 GLN N N 90 125.392 125.392 123.454 1.938 18387 9618 1 12 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.410 0.087 18387 9619 1 12 . 1 1 90 90 GLN C C 90 176.491 176.491 175.311 1.180 18387 9620 1 12 . 1 1 90 90 GLN CA C 90 55.460 55.460 55.109 0.350 18387 9621 1 12 . 1 1 90 90 GLN CB C 90 31.227 31.227 31.647 -0.420 18387 9622 1 12 . 1 1 90 90 GLN H H 90 7.904 7.904 8.212 -0.308 18387 9623 1 12 . 1 1 91 91 VAL N N 91 114.434 114.434 118.336 -3.902 18387 9624 1 12 . 1 1 91 91 VAL HA H 91 5.480 5.480 5.121 0.359 18387 9625 1 12 . 1 1 91 91 VAL C C 91 174.248 174.248 172.867 1.381 18387 9626 1 12 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.136 -0.130 18387 9627 1 12 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.512 1.126 18387 9628 1 12 . 1 1 91 91 VAL H H 91 9.585 9.585 9.210 0.375 18387 9629 1 12 . 1 1 92 92 LEU N N 92 126.910 126.910 123.468 3.442 18387 9630 1 12 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.526 -0.457 18387 9631 1 12 . 1 1 92 92 LEU C C 92 177.696 177.696 175.789 1.907 18387 9632 1 12 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.108 0.736 18387 9633 1 12 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.543 -0.596 18387 9634 1 12 . 1 1 92 92 LEU H H 92 8.941 8.941 8.385 0.556 18387 9635 1 12 . 1 1 93 93 LEU N N 93 125.673 125.673 127.450 -1.777 18387 9636 1 12 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.265 0.135 18387 9637 1 12 . 1 1 93 93 LEU C C 93 177.291 177.291 176.618 0.673 18387 9638 1 12 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.851 -0.900 18387 9639 1 12 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.603 1.576 18387 9640 1 12 . 1 1 93 93 LEU H H 93 8.038 8.038 8.503 -0.465 18387 9641 1 12 . 1 1 94 94 GLN N N 94 122.206 122.206 121.244 0.962 18387 9642 1 12 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.258 -0.021 18387 9643 1 12 . 1 1 94 94 GLN C C 94 178.246 178.246 177.062 1.184 18387 9644 1 12 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.563 0.212 18387 9645 1 12 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.602 -0.347 18387 9646 1 12 . 1 1 94 94 GLN H H 94 9.298 9.298 8.255 1.043 18387 9647 1 12 . 1 1 95 95 LYS N N 95 122.668 122.668 120.008 2.660 18387 9648 1 12 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.873 0.093 18387 9649 1 12 . 1 1 95 95 LYS C C 95 178.787 178.787 178.781 0.006 18387 9650 1 12 . 1 1 95 95 LYS CA C 95 60.072 60.072 60.342 -0.270 18387 9651 1 12 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.244 0.221 18387 9652 1 12 . 1 1 95 95 LYS H H 95 8.645 8.645 8.632 0.013 18387 9653 1 12 . 1 1 96 96 ASP N N 96 116.775 116.775 117.450 -0.675 18387 9654 1 12 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.536 0.044 18387 9655 1 12 . 1 1 96 96 ASP C C 96 176.220 176.220 177.720 -1.500 18387 9656 1 12 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.540 -0.194 18387 9657 1 12 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.689 -0.132 18387 9658 1 12 . 1 1 96 96 ASP H H 96 8.606 8.606 8.402 0.204 18387 9659 1 12 . 1 1 97 97 ASP N N 97 118.213 118.213 119.639 -1.426 18387 9660 1 12 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.404 0.523 18387 9661 1 12 . 1 1 97 97 ASP C C 97 176.954 176.954 178.240 -1.286 18387 9662 1 12 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.025 -1.666 18387 9663 1 12 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.648 1.676 18387 9664 1 12 . 1 1 97 97 ASP H H 97 7.988 7.988 8.141 -0.153 18387 9665 1 12 . 1 1 98 98 VAL N N 98 118.907 118.907 119.695 -0.788 18387 9666 1 12 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.587 -0.171 18387 9667 1 12 . 1 1 98 98 VAL C C 98 176.470 176.470 177.646 -1.176 18387 9668 1 12 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.867 0.911 18387 9669 1 12 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.566 0.825 18387 9670 1 12 . 1 1 98 98 VAL H H 98 7.098 7.098 8.412 -1.314 18387 9671 1 12 . 1 1 99 99 LYS N N 99 117.909 117.909 119.986 -2.077 18387 9672 1 12 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.906 0.037 18387 9673 1 12 . 1 1 99 99 LYS C C 99 178.762 178.762 178.491 0.271 18387 9674 1 12 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.839 0.306 18387 9675 1 12 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.094 -0.082 18387 9676 1 12 . 1 1 99 99 LYS H H 99 8.304 8.304 7.453 0.851 18387 9677 1 12 . 1 1 100 100 ASP N N 100 117.843 117.843 119.918 -2.075 18387 9678 1 12 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.456 0.022 18387 9679 1 12 . 1 1 100 100 ASP C C 100 179.694 179.694 179.221 0.473 18387 9680 1 12 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.924 -0.398 18387 9681 1 12 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.775 0.053 18387 9682 1 12 . 1 1 100 100 ASP H H 100 8.024 8.024 7.651 0.373 18387 9683 1 12 . 1 1 101 101 VAL N N 101 122.202 122.202 121.091 1.111 18387 9684 1 12 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.891 0.104 18387 9685 1 12 . 1 1 101 101 VAL C C 101 178.533 178.533 178.256 0.277 18387 9686 1 12 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.477 0.525 18387 9687 1 12 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.735 0.302 18387 9688 1 12 . 1 1 101 101 VAL H H 101 8.205 8.205 8.304 -0.099 18387 9689 1 12 . 1 1 102 102 LEU N N 102 118.798 118.798 119.276 -0.478 18387 9690 1 12 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.813 -0.033 18387 9691 1 12 . 1 1 102 102 LEU C C 102 180.254 180.254 178.861 1.393 18387 9692 1 12 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.039 0.902 18387 9693 1 12 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.426 -0.987 18387 9694 1 12 . 1 1 102 102 LEU H H 102 8.422 8.422 7.906 0.516 18387 9695 1 12 . 1 1 103 103 GLU N N 103 116.915 116.915 119.512 -2.597 18387 9696 1 12 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.889 0.246 18387 9697 1 12 . 1 1 103 103 GLU C C 103 180.910 180.910 179.200 1.710 18387 9698 1 12 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.191 0.212 18387 9699 1 12 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.331 0.400 18387 9700 1 12 . 1 1 103 103 GLU H H 103 8.262 8.262 7.865 0.397 18387 9701 1 12 . 1 1 104 104 SER N N 104 117.866 117.866 116.387 1.479 18387 9702 1 12 . 1 1 104 104 SER HA H 104 4.216 4.216 4.079 0.137 18387 9703 1 12 . 1 1 104 104 SER C C 104 175.455 175.455 176.744 -1.289 18387 9704 1 12 . 1 1 104 104 SER CA C 104 62.019 62.019 61.764 0.255 18387 9705 1 12 . 1 1 104 104 SER CB C 104 62.891 62.891 62.727 0.164 18387 9706 1 12 . 1 1 104 104 SER H H 104 8.544 8.544 8.126 0.418 18387 9707 1 12 . 1 1 105 105 TYR N N 105 117.278 117.278 120.639 -3.361 18387 9708 1 12 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.316 -0.044 18387 9709 1 12 . 1 1 105 105 TYR C C 105 174.750 174.750 175.218 -0.468 18387 9710 1 12 . 1 1 105 105 TYR CA C 105 59.859 59.859 59.497 0.362 18387 9711 1 12 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.469 2.242 18387 9712 1 12 . 1 1 105 105 TYR H H 105 7.691 7.691 7.584 0.107 18387 9713 1 12 . 1 1 106 106 CYS N N 106 116.897 116.897 115.303 1.594 18387 9714 1 12 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.042 -0.147 18387 9715 1 12 . 1 1 106 106 CYS C C 106 174.056 174.056 173.761 0.295 18387 9716 1 12 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.888 -0.278 18387 9717 1 12 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.775 0.257 18387 9718 1 12 . 1 1 106 106 CYS H H 106 7.862 7.862 8.343 -0.481 18387 9719 1 12 . 1 1 107 107 ILE N N 107 118.885 118.885 121.123 -2.238 18387 9720 1 12 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.762 -0.423 18387 9721 1 12 . 1 1 107 107 ILE C C 107 176.793 176.793 175.338 1.455 18387 9722 1 12 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.766 2.979 18387 9723 1 12 . 1 1 107 107 ILE CB C 107 38.079 38.079 34.924 3.155 18387 9724 1 12 . 1 1 107 107 ILE H H 107 7.707 7.707 7.930 -0.223 18387 9725 1 12 . 1 1 108 108 VAL N N 108 123.983 123.983 125.866 -1.883 18387 9726 1 12 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.096 0.178 18387 9727 1 12 . 1 1 108 108 VAL C C 108 175.476 175.476 175.541 -0.065 18387 9728 1 12 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.882 -0.258 18387 9729 1 12 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.581 0.427 18387 9730 1 12 . 1 1 108 108 VAL H H 108 8.656 8.656 7.743 0.913 18387 9731 1 12 . 1 1 109 109 GLY N N 109 110.120 110.120 106.561 3.559 18387 9732 1 12 . 1 1 109 109 GLY C C 109 169.982 169.982 172.055 -2.073 18387 9733 1 12 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.886 -0.284 18387 9734 1 12 . 1 1 109 109 GLY H H 109 7.500 7.500 7.149 0.351 18387 9735 1 12 . 1 1 110 110 PHE N N 110 115.276 115.276 119.135 -3.859 18387 9736 1 12 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.256 -0.482 18387 9737 1 12 . 1 1 110 110 PHE C C 110 174.361 174.361 175.002 -0.641 18387 9738 1 12 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.758 -0.071 18387 9739 1 12 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.681 1.270 18387 9740 1 12 . 1 1 110 110 PHE H H 110 8.203 8.203 8.564 -0.361 18387 9741 1 12 . 1 1 111 111 PRO HA H 111 5.359 5.359 4.968 0.391 18387 9742 1 12 . 1 1 111 111 PRO C C 111 175.691 175.691 175.498 0.193 18387 9743 1 12 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.989 0.168 18387 9744 1 12 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.260 2.044 18387 9745 1 12 . 1 1 112 112 HIS N N 112 123.708 123.708 116.131 7.577 18387 9746 1 12 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.890 0.073 18387 9747 1 12 . 1 1 112 112 HIS C C 112 173.649 173.649 173.476 0.173 18387 9748 1 12 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.583 0.492 18387 9749 1 12 . 1 1 112 112 HIS CB C 112 32.197 32.197 33.393 -1.196 18387 9750 1 12 . 1 1 112 112 HIS H H 112 8.952 8.952 8.577 0.375 18387 9751 1 12 . 1 1 113 113 ILE N N 113 128.596 128.596 124.463 4.133 18387 9752 1 12 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.256 0.441 18387 9753 1 12 . 1 1 113 113 ILE C C 113 176.130 176.130 174.349 1.781 18387 9754 1 12 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.263 0.732 18387 9755 1 12 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.239 -3.184 18387 9756 1 12 . 1 1 113 113 ILE H H 113 8.808 8.808 8.855 -0.047 18387 9757 1 12 . 1 1 114 114 ILE N N 114 119.668 119.668 120.913 -1.245 18387 9758 1 12 . 1 1 114 114 ILE HA H 114 4.973 4.973 5.175 -0.202 18387 9759 1 12 . 1 1 114 114 ILE C C 114 173.186 173.186 173.512 -0.326 18387 9760 1 12 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.920 -0.190 18387 9761 1 12 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.352 0.188 18387 9762 1 12 . 1 1 114 114 ILE H H 114 8.721 8.721 9.118 -0.397 18387 9763 1 12 . 1 1 115 115 LEU N N 115 122.770 122.770 126.565 -3.795 18387 9764 1 12 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.060 0.215 18387 9765 1 12 . 1 1 115 115 LEU C C 115 173.601 173.601 174.655 -1.054 18387 9766 1 12 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.328 0.454 18387 9767 1 12 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.094 2.040 18387 9768 1 12 . 1 1 115 115 LEU H H 115 8.665 8.665 9.203 -0.538 18387 9769 1 12 . 1 1 116 116 VAL N N 116 130.411 130.411 128.121 2.290 18387 9770 1 12 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.769 0.089 18387 9771 1 12 . 1 1 116 116 VAL C C 116 174.565 174.565 175.233 -0.668 18387 9772 1 12 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.957 -0.153 18387 9773 1 12 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.760 0.156 18387 9774 1 12 . 1 1 116 116 VAL H H 116 9.472 9.472 9.245 0.227 18387 9775 1 12 . 1 1 117 117 ASP N N 117 127.896 127.896 126.659 1.237 18387 9776 1 12 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.734 -0.342 18387 9777 1 12 . 1 1 117 117 ASP C C 117 176.567 176.567 176.160 0.407 18387 9778 1 12 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.880 0.720 18387 9779 1 12 . 1 1 117 117 ASP CB C 117 40.584 40.584 41.060 -0.476 18387 9780 1 12 . 1 1 117 117 ASP H H 117 9.429 9.429 8.790 0.639 18387 9781 1 12 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.330 -0.136 18387 9782 1 12 . 1 1 118 118 PRO C C 118 177.534 177.534 178.673 -1.139 18387 9783 1 12 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.301 -0.136 18387 9784 1 12 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.782 1.031 18387 9785 1 12 . 1 1 119 119 GLU N N 119 114.015 114.015 117.300 -3.285 18387 9786 1 12 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.145 0.194 18387 9787 1 12 . 1 1 119 119 GLU C C 119 176.722 176.722 177.185 -0.463 18387 9788 1 12 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.777 -2.138 18387 9789 1 12 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.306 0.271 18387 9790 1 12 . 1 1 119 119 GLU H H 119 7.733 7.733 9.031 -1.298 18387 9791 1 12 . 1 1 120 120 GLY N N 120 108.218 108.218 105.613 2.605 18387 9792 1 12 . 1 1 120 120 GLY C C 120 174.110 174.110 172.974 1.136 18387 9793 1 12 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.710 0.686 18387 9794 1 12 . 1 1 120 120 GLY H H 120 8.588 8.588 8.083 0.505 18387 9795 1 12 . 1 1 121 121 LYS N N 121 121.778 121.778 120.155 1.623 18387 9796 1 12 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.098 -0.239 18387 9797 1 12 . 1 1 121 121 LYS C C 121 176.458 176.458 175.784 0.674 18387 9798 1 12 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.292 0.670 18387 9799 1 12 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.713 -2.261 18387 9800 1 12 . 1 1 121 121 LYS H H 121 8.600 8.600 8.770 -0.170 18387 9801 1 12 . 1 1 122 122 ILE N N 122 122.058 122.058 125.645 -3.587 18387 9802 1 12 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.475 -0.203 18387 9803 1 12 . 1 1 122 122 ILE C C 122 177.084 177.084 176.817 0.267 18387 9804 1 12 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.510 0.309 18387 9805 1 12 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.122 1.526 18387 9806 1 12 . 1 1 122 122 ILE H H 122 9.006 9.006 9.139 -0.133 18387 9807 1 12 . 1 1 123 123 VAL N N 123 120.561 120.561 125.901 -5.340 18387 9808 1 12 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.309 0.446 18387 9809 1 12 . 1 1 123 123 VAL C C 123 175.584 175.584 175.569 0.015 18387 9810 1 12 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.994 -1.843 18387 9811 1 12 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.229 1.172 18387 9812 1 12 . 1 1 123 123 VAL H H 123 9.054 9.054 8.704 0.350 18387 9813 1 12 . 1 1 124 124 ALA N N 124 121.102 121.102 122.220 -1.118 18387 9814 1 12 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.742 -0.085 18387 9815 1 12 . 1 1 124 124 ALA C C 124 174.832 174.832 174.809 0.023 18387 9816 1 12 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.761 0.699 18387 9817 1 12 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.398 1.432 18387 9818 1 12 . 1 1 124 124 ALA H H 124 7.793 7.793 7.477 0.316 18387 9819 1 12 . 1 1 125 125 LYS N N 125 117.637 117.637 123.466 -5.829 18387 9820 1 12 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.693 0.340 18387 9821 1 12 . 1 1 125 125 LYS C C 125 173.417 173.417 176.035 -2.618 18387 9822 1 12 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.707 -0.566 18387 9823 1 12 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.403 1.248 18387 9824 1 12 . 1 1 125 125 LYS H H 125 8.872 8.872 8.500 0.372 18387 9825 1 12 . 1 1 126 126 GLU N N 126 115.236 115.236 122.098 -6.862 18387 9826 1 12 . 1 1 126 126 GLU HA H 126 3.998 3.998 4.064 -0.066 18387 9827 1 12 . 1 1 126 126 GLU C C 126 175.998 175.998 175.868 0.130 18387 9828 1 12 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.365 -0.403 18387 9829 1 12 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.565 -1.130 18387 9830 1 12 . 1 1 126 126 GLU H H 126 7.941 7.941 8.962 -1.021 18387 9831 1 12 . 1 1 127 127 LEU N N 127 118.584 118.584 119.085 -0.501 18387 9832 1 12 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.353 0.029 18387 9833 1 12 . 1 1 127 127 LEU C C 127 176.766 176.766 175.769 0.997 18387 9834 1 12 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.540 0.069 18387 9835 1 12 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.721 1.242 18387 9836 1 12 . 1 1 127 127 LEU H H 127 7.300 7.300 7.247 0.053 18387 9837 1 12 . 1 1 128 128 ARG N N 128 118.625 118.625 120.487 -1.862 18387 9838 1 12 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.535 -0.060 18387 9839 1 12 . 1 1 128 128 ARG C C 128 177.113 177.113 176.427 0.686 18387 9840 1 12 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.562 -1.172 18387 9841 1 12 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.419 1.193 18387 9842 1 12 . 1 1 128 128 ARG H H 128 7.929 7.929 8.137 -0.208 18387 9843 1 12 . 1 1 129 129 GLY N N 129 114.010 114.010 114.996 -0.986 18387 9844 1 12 . 1 1 129 129 GLY C C 129 175.931 175.931 174.546 1.385 18387 9845 1 12 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.183 -0.722 18387 9846 1 12 . 1 1 129 129 GLY H H 129 10.649 10.649 9.334 1.315 18387 9847 1 12 . 1 1 130 130 ASP N N 130 123.975 123.975 123.434 0.541 18387 9848 1 12 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.457 0.075 18387 9849 1 12 . 1 1 130 130 ASP C C 130 177.507 177.507 177.207 0.300 18387 9850 1 12 . 1 1 130 130 ASP CA C 130 57.372 57.372 55.422 1.950 18387 9851 1 12 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.608 0.295 18387 9852 1 12 . 1 1 130 130 ASP H H 130 8.540 8.540 8.102 0.438 18387 9853 1 12 . 1 1 131 131 ASP N N 131 116.806 116.806 120.730 -3.924 18387 9854 1 12 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.292 0.278 18387 9855 1 12 . 1 1 131 131 ASP C C 131 179.038 179.038 178.467 0.571 18387 9856 1 12 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.617 -0.634 18387 9857 1 12 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.384 0.550 18387 9858 1 12 . 1 1 131 131 ASP H H 131 7.907 7.907 7.759 0.148 18387 9859 1 12 . 1 1 132 132 LEU N N 132 123.869 123.869 118.300 5.569 18387 9860 1 12 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.157 -0.366 18387 9861 1 12 . 1 1 132 132 LEU C C 132 176.343 176.343 178.257 -1.914 18387 9862 1 12 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.545 1.239 18387 9863 1 12 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.925 0.843 18387 9864 1 12 . 1 1 132 132 LEU H H 132 7.542 7.542 7.622 -0.080 18387 9865 1 12 . 1 1 133 133 TYR N N 133 120.042 120.042 120.113 -0.071 18387 9866 1 12 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.054 -0.058 18387 9867 1 12 . 1 1 133 133 TYR C C 133 177.426 177.426 177.264 0.162 18387 9868 1 12 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.343 -0.210 18387 9869 1 12 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.652 -0.076 18387 9870 1 12 . 1 1 133 133 TYR H H 133 7.384 7.384 7.314 0.070 18387 9871 1 12 . 1 1 134 134 ASN N N 134 114.936 114.936 117.239 -2.303 18387 9872 1 12 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.346 0.057 18387 9873 1 12 . 1 1 134 134 ASN C C 134 178.703 178.703 177.866 0.837 18387 9874 1 12 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.898 -1.089 18387 9875 1 12 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.346 -0.138 18387 9876 1 12 . 1 1 134 134 ASN H H 134 8.399 8.399 8.558 -0.159 18387 9877 1 12 . 1 1 135 135 THR N N 135 117.387 117.387 117.700 -0.313 18387 9878 1 12 . 1 1 135 135 THR HA H 135 3.920 3.920 3.640 0.280 18387 9879 1 12 . 1 1 135 135 THR C C 135 175.323 175.323 176.292 -0.969 18387 9880 1 12 . 1 1 135 135 THR CA C 135 67.402 67.402 66.337 1.065 18387 9881 1 12 . 1 1 135 135 THR CB C 135 68.111 68.111 68.749 -0.638 18387 9882 1 12 . 1 1 135 135 THR H H 135 8.265 8.265 7.986 0.279 18387 9883 1 12 . 1 1 136 136 VAL N N 136 121.207 121.207 120.713 0.494 18387 9884 1 12 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.432 -0.417 18387 9885 1 12 . 1 1 136 136 VAL C C 136 176.457 176.457 177.275 -0.818 18387 9886 1 12 . 1 1 136 136 VAL CA C 136 68.272 68.272 65.689 2.583 18387 9887 1 12 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.284 0.657 18387 9888 1 12 . 1 1 136 136 VAL H H 136 7.595 7.595 7.576 0.019 18387 9889 1 12 . 1 1 137 137 GLU N N 137 118.266 118.266 120.228 -1.962 18387 9890 1 12 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.111 -1.429 18387 9891 1 12 . 1 1 137 137 GLU C C 137 177.482 177.482 178.308 -0.826 18387 9892 1 12 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.924 0.006 18387 9893 1 12 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.128 0.654 18387 9894 1 12 . 1 1 137 137 GLU H H 137 8.114 8.114 8.371 -0.257 18387 9895 1 12 . 1 1 138 138 LYS N N 138 116.431 116.431 118.529 -2.098 18387 9896 1 12 . 1 1 138 138 LYS HA H 138 3.768 3.768 4.167 -0.399 18387 9897 1 12 . 1 1 138 138 LYS C C 138 179.193 179.193 178.354 0.839 18387 9898 1 12 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.433 0.607 18387 9899 1 12 . 1 1 138 138 LYS CB C 138 32.158 32.158 31.876 0.282 18387 9900 1 12 . 1 1 138 138 LYS H H 138 7.133 7.133 7.432 -0.299 18387 9901 1 12 . 1 1 139 139 PHE N N 139 116.336 116.336 118.220 -1.884 18387 9902 1 12 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.291 -0.281 18387 9903 1 12 . 1 1 139 139 PHE C C 139 177.855 177.855 177.291 0.564 18387 9904 1 12 . 1 1 139 139 PHE CA C 139 62.384 62.384 59.933 2.451 18387 9905 1 12 . 1 1 139 139 PHE CB C 139 39.352 39.352 38.972 0.380 18387 9906 1 12 . 1 1 139 139 PHE H H 139 7.338 7.338 7.251 0.087 18387 9907 1 12 . 1 1 140 140 VAL N N 140 116.491 116.491 115.797 0.694 18387 9908 1 12 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.594 -0.070 18387 9909 1 12 . 1 1 140 140 VAL C C 140 177.747 177.747 177.934 -0.187 18387 9910 1 12 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.970 0.272 18387 9911 1 12 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.838 -0.448 18387 9912 1 12 . 1 1 140 140 VAL H H 140 8.332 8.332 8.366 -0.034 18387 9913 1 12 . 1 1 141 141 ASN N N 141 116.956 116.956 118.659 -1.703 18387 9914 1 12 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.699 0.127 18387 9915 1 12 . 1 1 141 141 ASN C C 141 176.997 176.997 177.183 -0.186 18387 9916 1 12 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.007 -1.330 18387 9917 1 12 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.198 -0.750 18387 9918 1 12 . 1 1 141 141 ASN H H 141 7.862 7.862 7.806 0.056 18387 9919 1 12 . 1 1 142 142 GLY N N 142 107.938 107.938 107.844 0.094 18387 9920 1 12 . 1 1 142 142 GLY C C 142 174.336 174.336 173.429 0.907 18387 9921 1 12 . 1 1 142 142 GLY CA C 142 45.985 45.985 43.810 2.175 18387 9922 1 12 . 1 1 142 142 GLY H H 142 7.466 7.466 8.548 -1.082 18387 9923 1 12 . 1 1 143 143 ALA N N 143 123.441 123.441 124.091 -0.650 18387 9924 1 12 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.402 -0.061 18387 9925 1 12 . 1 1 143 143 ALA C C 143 178.212 178.212 177.932 0.280 18387 9926 1 12 . 1 1 143 143 ALA CA C 143 52.826 52.826 54.564 -1.738 18387 9927 1 12 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.300 -0.056 18387 9928 1 12 . 1 1 143 143 ALA H H 143 7.950 7.950 7.341 0.609 18387 9929 1 12 . 1 1 144 144 LYS N N 144 120.149 120.149 114.519 5.630 18387 9930 1 12 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.489 -0.194 18387 9931 1 12 . 1 1 144 144 LYS C C 144 176.945 176.945 176.168 0.777 18387 9932 1 12 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.072 0.447 18387 9933 1 12 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.601 0.429 18387 9934 1 12 . 1 1 144 144 LYS H H 144 8.187 8.187 8.240 -0.053 18387 9935 1 12 . 1 1 145 145 GLU N N 145 120.992 120.992 119.961 1.031 18387 9936 1 12 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.305 -0.010 18387 9937 1 12 . 1 1 145 145 GLU C C 145 177.116 177.116 176.157 0.959 18387 9938 1 12 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.919 0.984 18387 9939 1 12 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.496 -0.254 18387 9940 1 12 . 1 1 145 145 GLU H H 145 8.363 8.363 7.887 0.476 18387 9941 1 12 . 1 1 146 146 GLY N N 146 109.467 109.467 107.332 2.135 18387 9942 1 12 . 1 1 146 146 GLY C C 146 174.108 174.108 175.135 -1.027 18387 9943 1 12 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.101 0.300 18387 9944 1 12 . 1 1 146 146 GLY H H 146 8.371 8.371 8.397 -0.026 18387 9945 1 12 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.702 -0.093 18387 9946 1 12 . 1 1 151 151 HIS C C 151 174.258 174.258 173.733 0.525 18387 9947 1 12 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.494 0.671 18387 9948 1 12 . 1 1 151 151 HIS CB C 151 30.833 30.833 31.323 -0.490 18387 9949 1 13 . 1 1 2 2 SER HA H 2 3.992 3.992 4.617 -0.625 18387 9950 1 13 . 1 1 2 2 SER CA C 2 57.555 57.555 58.763 -1.208 18387 9951 1 13 . 1 1 2 2 SER CB C 2 64.977 64.977 64.945 0.032 18387 9952 1 13 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.650 -0.211 18387 9953 1 13 . 1 1 3 3 LEU C C 3 176.631 176.631 175.425 1.206 18387 9954 1 13 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.127 0.437 18387 9955 1 13 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.295 -0.571 18387 9956 1 13 . 1 1 4 4 ALA N N 4 125.483 125.483 125.967 -0.484 18387 9957 1 13 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.552 -0.173 18387 9958 1 13 . 1 1 4 4 ALA C C 4 179.642 179.642 176.299 3.343 18387 9959 1 13 . 1 1 4 4 ALA CA C 4 51.735 51.735 52.339 -0.604 18387 9960 1 13 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.076 -0.324 18387 9961 1 13 . 1 1 4 4 ALA H H 4 8.483 8.483 8.140 0.343 18387 9962 1 13 . 1 1 5 5 THR HA H 5 3.845 3.845 4.874 -1.029 18387 9963 1 13 . 1 1 5 5 THR C C 5 175.487 175.487 175.033 0.454 18387 9964 1 13 . 1 1 5 5 THR CA C 5 64.531 64.531 60.507 4.024 18387 9965 1 13 . 1 1 5 5 THR CB C 5 68.108 68.108 70.871 -2.763 18387 9966 1 13 . 1 1 6 6 GLY N N 6 114.298 114.298 114.731 -0.433 18387 9967 1 13 . 1 1 6 6 GLY C C 6 174.324 174.324 174.355 -0.031 18387 9968 1 13 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.354 -0.519 18387 9969 1 13 . 1 1 6 6 GLY H H 6 9.511 9.511 8.940 0.571 18387 9970 1 13 . 1 1 7 7 SER N N 7 115.270 115.270 116.684 -1.414 18387 9971 1 13 . 1 1 7 7 SER HA H 7 4.500 4.500 4.417 0.083 18387 9972 1 13 . 1 1 7 7 SER C C 7 173.315 173.315 174.455 -1.140 18387 9973 1 13 . 1 1 7 7 SER CA C 7 58.915 58.915 57.735 1.180 18387 9974 1 13 . 1 1 7 7 SER CB C 7 64.308 64.308 63.871 0.437 18387 9975 1 13 . 1 1 7 7 SER H H 7 7.736 7.736 7.775 -0.039 18387 9976 1 13 . 1 1 8 8 VAL N N 8 123.708 123.708 125.071 -1.363 18387 9977 1 13 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.001 -0.169 18387 9978 1 13 . 1 1 8 8 VAL C C 8 176.673 176.673 175.461 1.212 18387 9979 1 13 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.951 1.722 18387 9980 1 13 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.542 -0.320 18387 9981 1 13 . 1 1 8 8 VAL H H 8 8.632 8.632 8.457 0.175 18387 9982 1 13 . 1 1 9 9 ALA N N 9 133.040 133.040 131.617 1.423 18387 9983 1 13 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.738 -0.475 18387 9984 1 13 . 1 1 9 9 ALA C C 9 175.404 175.404 174.932 0.472 18387 9985 1 13 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.542 1.413 18387 9986 1 13 . 1 1 9 9 ALA CB C 9 18.030 18.030 19.207 -1.177 18387 9987 1 13 . 1 1 9 9 ALA H H 9 8.448 8.448 8.890 -0.442 18387 9988 1 13 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.492 -0.161 18387 9989 1 13 . 1 1 10 10 PRO C C 10 175.071 175.071 176.155 -1.084 18387 9990 1 13 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.559 0.082 18387 9991 1 13 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.366 -0.042 18387 9992 1 13 . 1 1 11 11 ALA N N 11 124.172 124.172 124.025 0.147 18387 9993 1 13 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.468 -0.224 18387 9994 1 13 . 1 1 11 11 ALA C C 11 177.688 177.688 177.668 0.020 18387 9995 1 13 . 1 1 11 11 ALA CA C 11 53.621 53.621 52.132 1.489 18387 9996 1 13 . 1 1 11 11 ALA CB C 11 19.327 19.327 20.007 -0.680 18387 9997 1 13 . 1 1 11 11 ALA H H 11 8.221 8.221 8.266 -0.045 18387 9998 1 13 . 1 1 12 12 ILE N N 12 117.815 117.815 122.361 -4.546 18387 9999 1 13 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.139 0.189 18387 10000 1 13 . 1 1 12 12 ILE C C 12 175.013 175.013 175.631 -0.618 18387 10001 1 13 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.649 1.517 18387 10002 1 13 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.214 5.076 18387 10003 1 13 . 1 1 12 12 ILE H H 12 7.693 7.693 8.518 -0.825 18387 10004 1 13 . 1 1 13 13 THR N N 13 121.186 121.186 122.587 -1.401 18387 10005 1 13 . 1 1 13 13 THR HA H 13 4.840 4.840 5.035 -0.195 18387 10006 1 13 . 1 1 13 13 THR C C 13 172.625 172.625 173.695 -1.070 18387 10007 1 13 . 1 1 13 13 THR CA C 13 62.297 62.297 61.366 0.931 18387 10008 1 13 . 1 1 13 13 THR CB C 13 71.585 71.585 69.652 1.933 18387 10009 1 13 . 1 1 13 13 THR H H 13 8.363 8.363 9.012 -0.649 18387 10010 1 13 . 1 1 14 14 GLY N N 14 110.785 110.785 112.362 -1.577 18387 10011 1 13 . 1 1 14 14 GLY C C 14 170.040 170.040 171.844 -1.804 18387 10012 1 13 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.911 0.479 18387 10013 1 13 . 1 1 14 14 GLY H H 14 7.993 7.993 9.250 -1.257 18387 10014 1 13 . 1 1 15 15 ILE N N 15 119.088 119.088 122.809 -3.721 18387 10015 1 13 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.879 0.246 18387 10016 1 13 . 1 1 15 15 ILE C C 15 176.359 176.359 176.308 0.051 18387 10017 1 13 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.149 -2.535 18387 10018 1 13 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.472 0.167 18387 10019 1 13 . 1 1 15 15 ILE H H 15 7.973 7.973 8.795 -0.822 18387 10020 1 13 . 1 1 16 16 ASP N N 16 126.633 126.633 127.562 -0.929 18387 10021 1 13 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.403 0.446 18387 10022 1 13 . 1 1 16 16 ASP C C 16 179.190 179.190 177.440 1.750 18387 10023 1 13 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.484 -0.604 18387 10024 1 13 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.758 -0.483 18387 10025 1 13 . 1 1 16 16 ASP H H 16 9.335 9.335 8.953 0.382 18387 10026 1 13 . 1 1 17 17 LEU N N 17 116.648 116.648 118.069 -1.421 18387 10027 1 13 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.909 0.265 18387 10028 1 13 . 1 1 17 17 LEU C C 17 178.432 178.432 178.804 -0.372 18387 10029 1 13 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.305 0.676 18387 10030 1 13 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.786 1.200 18387 10031 1 13 . 1 1 17 17 LEU H H 17 8.071 8.071 8.571 -0.500 18387 10032 1 13 . 1 1 18 18 LYS N N 18 117.401 117.401 116.219 1.182 18387 10033 1 13 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.161 0.348 18387 10034 1 13 . 1 1 18 18 LYS C C 18 176.793 176.793 177.477 -0.684 18387 10035 1 13 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.298 -1.863 18387 10036 1 13 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.137 -0.074 18387 10037 1 13 . 1 1 18 18 LYS H H 18 8.207 8.207 8.752 -0.545 18387 10038 1 13 . 1 1 19 19 GLY N N 19 108.061 108.061 106.796 1.265 18387 10039 1 13 . 1 1 19 19 GLY C C 19 174.649 174.649 174.040 0.609 18387 10040 1 13 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.672 0.925 18387 10041 1 13 . 1 1 19 19 GLY H H 19 8.099 8.099 8.218 -0.119 18387 10042 1 13 . 1 1 20 20 ASN N N 20 121.012 121.012 119.857 1.155 18387 10043 1 13 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.076 -0.171 18387 10044 1 13 . 1 1 20 20 ASN C C 20 174.827 174.827 174.647 0.180 18387 10045 1 13 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.393 0.074 18387 10046 1 13 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.596 -1.920 18387 10047 1 13 . 1 1 20 20 ASN H H 20 8.945 8.945 9.212 -0.267 18387 10048 1 13 . 1 1 21 21 SER N N 21 117.285 117.285 117.893 -0.608 18387 10049 1 13 . 1 1 21 21 SER HA H 21 5.000 5.000 4.660 0.340 18387 10050 1 13 . 1 1 21 21 SER C C 21 174.911 174.911 174.322 0.589 18387 10051 1 13 . 1 1 21 21 SER CA C 21 58.730 58.730 58.617 0.113 18387 10052 1 13 . 1 1 21 21 SER CB C 21 63.162 63.162 62.849 0.313 18387 10053 1 13 . 1 1 21 21 SER H H 21 8.740 8.740 8.619 0.121 18387 10054 1 13 . 1 1 22 22 VAL N N 22 128.665 128.665 126.943 1.722 18387 10055 1 13 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.364 0.016 18387 10056 1 13 . 1 1 22 22 VAL C C 22 176.276 176.276 175.314 0.962 18387 10057 1 13 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.242 1.712 18387 10058 1 13 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.014 1.569 18387 10059 1 13 . 1 1 22 22 VAL H H 22 9.125 9.125 9.097 0.028 18387 10060 1 13 . 1 1 23 23 SER N N 23 127.457 127.457 119.378 8.079 18387 10061 1 13 . 1 1 23 23 SER HA H 23 5.878 5.878 5.635 0.243 18387 10062 1 13 . 1 1 23 23 SER C C 23 174.436 174.436 175.766 -1.330 18387 10063 1 13 . 1 1 23 23 SER CA C 23 57.101 57.101 56.414 0.687 18387 10064 1 13 . 1 1 23 23 SER CB C 23 66.078 66.078 66.219 -0.141 18387 10065 1 13 . 1 1 23 23 SER H H 23 8.971 8.971 8.499 0.472 18387 10066 1 13 . 1 1 24 24 LEU N N 24 126.734 126.734 123.704 3.030 18387 10067 1 13 . 1 1 24 24 LEU HA H 24 3.467 3.467 4.357 -0.890 18387 10068 1 13 . 1 1 24 24 LEU C C 24 179.852 179.852 177.895 1.957 18387 10069 1 13 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.120 2.083 18387 10070 1 13 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.100 -0.122 18387 10071 1 13 . 1 1 24 24 LEU H H 24 8.450 8.450 8.484 -0.034 18387 10072 1 13 . 1 1 25 25 ASN N N 25 115.642 115.642 117.699 -2.057 18387 10073 1 13 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.475 -0.233 18387 10074 1 13 . 1 1 25 25 ASN C C 25 176.246 176.246 176.967 -0.721 18387 10075 1 13 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.831 -0.461 18387 10076 1 13 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.812 0.959 18387 10077 1 13 . 1 1 25 25 ASN H H 25 8.505 8.505 8.498 0.007 18387 10078 1 13 . 1 1 26 26 ASP N N 26 119.722 119.722 120.619 -0.897 18387 10079 1 13 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.321 -0.116 18387 10080 1 13 . 1 1 26 26 ASP C C 26 176.708 176.708 176.727 -0.019 18387 10081 1 13 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.368 0.157 18387 10082 1 13 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.357 -1.077 18387 10083 1 13 . 1 1 26 26 ASP H H 26 7.731 7.731 7.879 -0.148 18387 10084 1 13 . 1 1 27 27 PHE N N 27 116.827 116.827 116.272 0.555 18387 10085 1 13 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.453 0.027 18387 10086 1 13 . 1 1 27 27 PHE C C 27 174.227 174.227 175.645 -1.418 18387 10087 1 13 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.731 -0.660 18387 10088 1 13 . 1 1 27 27 PHE CB C 27 39.719 39.719 38.914 0.805 18387 10089 1 13 . 1 1 27 27 PHE H H 27 7.390 7.390 7.381 0.009 18387 10090 1 13 . 1 1 28 28 LYS N N 28 120.357 120.357 121.533 -1.176 18387 10091 1 13 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.414 -0.027 18387 10092 1 13 . 1 1 28 28 LYS C C 28 177.845 177.845 176.501 1.344 18387 10093 1 13 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.690 1.312 18387 10094 1 13 . 1 1 28 28 LYS CB C 28 32.544 32.544 30.874 1.670 18387 10095 1 13 . 1 1 28 28 LYS H H 28 6.883 6.883 7.158 -0.275 18387 10096 1 13 . 1 1 29 29 GLY N N 29 112.653 112.653 110.965 1.688 18387 10097 1 13 . 1 1 29 29 GLY C C 29 173.799 173.799 173.737 0.062 18387 10098 1 13 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.711 0.277 18387 10099 1 13 . 1 1 29 29 GLY H H 29 8.930 8.930 8.054 0.876 18387 10100 1 13 . 1 1 30 30 LYS N N 30 120.516 120.516 119.723 0.793 18387 10101 1 13 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.864 -0.229 18387 10102 1 13 . 1 1 30 30 LYS C C 30 176.505 176.505 175.005 1.500 18387 10103 1 13 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.537 0.643 18387 10104 1 13 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.659 -0.802 18387 10105 1 13 . 1 1 30 30 LYS H H 30 8.098 8.098 7.413 0.685 18387 10106 1 13 . 1 1 31 31 TYR N N 31 117.383 117.383 119.341 -1.958 18387 10107 1 13 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.503 0.151 18387 10108 1 13 . 1 1 31 31 TYR C C 31 175.551 175.551 175.314 0.237 18387 10109 1 13 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.829 1.336 18387 10110 1 13 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.931 2.262 18387 10111 1 13 . 1 1 31 31 TYR H H 31 8.263 8.263 9.091 -0.828 18387 10112 1 13 . 1 1 32 32 VAL N N 32 120.900 120.900 124.267 -3.367 18387 10113 1 13 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.550 -0.111 18387 10114 1 13 . 1 1 32 32 VAL C C 32 175.975 175.975 174.647 1.328 18387 10115 1 13 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.134 -1.428 18387 10116 1 13 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.989 2.518 18387 10117 1 13 . 1 1 32 32 VAL H H 32 9.244 9.244 9.183 0.061 18387 10118 1 13 . 1 1 33 33 LEU N N 33 130.058 130.058 130.126 -0.068 18387 10119 1 13 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.086 0.087 18387 10120 1 13 . 1 1 33 33 LEU C C 33 174.693 174.693 175.172 -0.479 18387 10121 1 13 . 1 1 33 33 LEU CA C 33 53.348 53.348 52.986 0.362 18387 10122 1 13 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.592 1.729 18387 10123 1 13 . 1 1 33 33 LEU H H 33 8.161 8.161 8.491 -0.330 18387 10124 1 13 . 1 1 34 34 VAL N N 34 129.232 129.232 128.667 0.565 18387 10125 1 13 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.616 0.366 18387 10126 1 13 . 1 1 34 34 VAL C C 34 174.285 174.285 174.469 -0.184 18387 10127 1 13 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.762 -0.256 18387 10128 1 13 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.935 -0.557 18387 10129 1 13 . 1 1 34 34 VAL H H 34 9.296 9.296 9.065 0.231 18387 10130 1 13 . 1 1 35 35 ASP N N 35 123.675 123.675 127.185 -3.510 18387 10131 1 13 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.487 -0.138 18387 10132 1 13 . 1 1 35 35 ASP C C 35 174.258 174.258 174.492 -0.234 18387 10133 1 13 . 1 1 35 35 ASP CA C 35 51.054 51.054 51.218 -0.164 18387 10134 1 13 . 1 1 35 35 ASP CB C 35 40.462 40.462 45.074 -4.612 18387 10135 1 13 . 1 1 35 35 ASP H H 35 8.015 8.015 8.683 -0.668 18387 10136 1 13 . 1 1 36 36 PHE N N 36 126.959 126.959 122.784 4.175 18387 10137 1 13 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.715 0.220 18387 10138 1 13 . 1 1 36 36 PHE C C 36 175.432 175.432 175.126 0.306 18387 10139 1 13 . 1 1 36 36 PHE CA C 36 58.095 58.095 56.332 1.763 18387 10140 1 13 . 1 1 36 36 PHE CB C 36 40.030 40.030 41.532 -1.502 18387 10141 1 13 . 1 1 36 36 PHE H H 36 9.171 9.171 8.189 0.982 18387 10142 1 13 . 1 1 37 37 TRP N N 37 120.839 120.839 121.635 -0.796 18387 10143 1 13 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.590 0.167 18387 10144 1 13 . 1 1 37 37 TRP C C 37 172.412 172.412 173.755 -1.343 18387 10145 1 13 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.898 0.011 18387 10146 1 13 . 1 1 37 37 TRP CB C 37 32.680 32.680 33.423 -0.743 18387 10147 1 13 . 1 1 37 37 TRP H H 37 9.280 9.280 8.941 0.339 18387 10148 1 13 . 1 1 38 38 PHE N N 38 109.215 109.215 114.512 -5.297 18387 10149 1 13 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.943 -1.010 18387 10150 1 13 . 1 1 38 38 PHE C C 38 176.141 176.141 174.891 1.250 18387 10151 1 13 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.256 0.755 18387 10152 1 13 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.656 -1.037 18387 10153 1 13 . 1 1 38 38 PHE H H 38 7.062 7.062 8.633 -1.571 18387 10154 1 13 . 1 1 39 39 ALA N N 39 125.193 125.193 123.028 2.165 18387 10155 1 13 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.264 -0.199 18387 10156 1 13 . 1 1 39 39 ALA C C 39 179.349 179.349 178.232 1.117 18387 10157 1 13 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.743 1.321 18387 10158 1 13 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.938 0.959 18387 10159 1 13 . 1 1 39 39 ALA H H 39 10.355 10.355 9.501 0.854 18387 10160 1 13 . 1 1 40 40 GLY N N 40 103.437 103.437 104.377 -0.940 18387 10161 1 13 . 1 1 40 40 GLY C C 40 172.732 172.732 174.071 -1.339 18387 10162 1 13 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.062 -0.126 18387 10163 1 13 . 1 1 40 40 GLY H H 40 8.583 8.583 7.452 1.131 18387 10164 1 13 . 1 1 41 41 CYS N N 41 124.859 124.859 119.333 5.526 18387 10165 1 13 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.592 -0.188 18387 10166 1 13 . 1 1 41 41 CYS C C 41 176.620 176.620 175.390 1.230 18387 10167 1 13 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.727 0.648 18387 10168 1 13 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.601 -0.225 18387 10169 1 13 . 1 1 41 41 CYS H H 41 6.946 6.946 6.891 0.055 18387 10170 1 13 . 1 1 42 42 SER HA H 42 4.040 4.040 4.266 -0.226 18387 10171 1 13 . 1 1 42 42 SER CA C 42 61.552 61.552 59.735 1.817 18387 10172 1 13 . 1 1 42 42 SER CB C 42 62.675 62.675 62.545 0.130 18387 10173 1 13 . 1 1 43 43 TRP N N 43 129.748 129.748 119.591 10.157 18387 10174 1 13 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.747 -0.198 18387 10175 1 13 . 1 1 43 43 TRP C C 43 180.400 180.400 177.734 2.666 18387 10176 1 13 . 1 1 43 43 TRP CA C 43 60.249 60.249 57.835 2.414 18387 10177 1 13 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.874 -0.282 18387 10178 1 13 . 1 1 44 44 CYS N N 44 124.462 124.462 116.240 8.222 18387 10179 1 13 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.526 -0.275 18387 10180 1 13 . 1 1 44 44 CYS C C 44 178.643 178.643 177.030 1.613 18387 10181 1 13 . 1 1 44 44 CYS CA C 44 64.849 64.849 60.851 3.998 18387 10182 1 13 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.578 1.844 18387 10183 1 13 . 1 1 44 44 CYS H H 44 9.591 9.591 7.821 1.770 18387 10184 1 13 . 1 1 45 45 ARG N N 45 117.248 117.248 119.095 -1.847 18387 10185 1 13 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.375 -0.199 18387 10186 1 13 . 1 1 45 45 ARG C C 45 180.302 180.302 177.000 3.302 18387 10187 1 13 . 1 1 45 45 ARG CA C 45 56.943 56.943 55.880 1.063 18387 10188 1 13 . 1 1 45 45 ARG CB C 45 27.631 27.631 28.887 -1.256 18387 10189 1 13 . 1 1 45 45 ARG H H 45 7.955 7.955 8.168 -0.213 18387 10190 1 13 . 1 1 46 46 LYS N N 46 120.318 120.318 118.806 1.512 18387 10191 1 13 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.302 -0.030 18387 10192 1 13 . 1 1 46 46 LYS C C 46 177.755 177.755 177.232 0.523 18387 10193 1 13 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.952 0.817 18387 10194 1 13 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.822 0.336 18387 10195 1 13 . 1 1 46 46 LYS H H 46 8.129 8.129 7.685 0.444 18387 10196 1 13 . 1 1 47 47 GLU N N 47 114.278 114.278 117.556 -3.278 18387 10197 1 13 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.825 0.066 18387 10198 1 13 . 1 1 47 47 GLU C C 47 178.701 178.701 177.901 0.800 18387 10199 1 13 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.462 -0.908 18387 10200 1 13 . 1 1 47 47 GLU CB C 47 29.766 29.766 30.099 -0.333 18387 10201 1 13 . 1 1 47 47 GLU H H 47 7.386 7.386 7.571 -0.185 18387 10202 1 13 . 1 1 48 48 THR N N 48 115.665 115.665 117.211 -1.546 18387 10203 1 13 . 1 1 48 48 THR HA H 48 4.048 4.048 4.278 -0.230 18387 10204 1 13 . 1 1 48 48 THR C C 48 172.392 172.392 174.602 -2.210 18387 10205 1 13 . 1 1 48 48 THR CA C 48 69.426 69.426 68.943 0.483 18387 10206 1 13 . 1 1 48 48 THR CB C 48 66.906 66.906 66.608 0.298 18387 10207 1 13 . 1 1 48 48 THR H H 48 7.810 7.810 7.646 0.164 18387 10208 1 13 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.191 0.098 18387 10209 1 13 . 1 1 49 49 PRO C C 49 179.828 179.828 178.671 1.157 18387 10210 1 13 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.166 0.433 18387 10211 1 13 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.781 0.253 18387 10212 1 13 . 1 1 50 50 TYR N N 50 116.950 116.950 117.192 -0.242 18387 10213 1 13 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.365 -0.227 18387 10214 1 13 . 1 1 50 50 TYR C C 50 179.488 179.488 178.808 0.680 18387 10215 1 13 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.007 0.128 18387 10216 1 13 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.654 0.647 18387 10217 1 13 . 1 1 50 50 TYR H H 50 7.071 7.071 7.103 -0.032 18387 10218 1 13 . 1 1 51 51 LEU N N 51 123.989 123.989 119.859 4.130 18387 10219 1 13 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.813 -0.143 18387 10220 1 13 . 1 1 51 51 LEU C C 51 178.072 178.072 178.932 -0.860 18387 10221 1 13 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.722 0.954 18387 10222 1 13 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.233 1.384 18387 10223 1 13 . 1 1 51 51 LEU H H 51 8.243 8.243 8.501 -0.258 18387 10224 1 13 . 1 1 52 52 LEU N N 52 119.857 119.857 120.619 -0.762 18387 10225 1 13 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.172 0.155 18387 10226 1 13 . 1 1 52 52 LEU C C 52 178.704 178.704 178.325 0.379 18387 10227 1 13 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.585 -0.010 18387 10228 1 13 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.778 0.960 18387 10229 1 13 . 1 1 52 52 LEU H H 52 9.085 9.085 8.721 0.364 18387 10230 1 13 . 1 1 53 53 LYS N N 53 118.658 118.658 118.744 -0.086 18387 10231 1 13 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.997 0.112 18387 10232 1 13 . 1 1 53 53 LYS C C 53 179.786 179.786 179.034 0.752 18387 10233 1 13 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.971 -0.250 18387 10234 1 13 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.345 0.814 18387 10235 1 13 . 1 1 53 53 LYS H H 53 7.807 7.807 8.162 -0.355 18387 10236 1 13 . 1 1 54 54 THR N N 54 116.869 116.869 116.797 0.072 18387 10237 1 13 . 1 1 54 54 THR HA H 54 3.965 3.965 4.534 -0.569 18387 10238 1 13 . 1 1 54 54 THR C C 54 175.328 175.328 176.755 -1.427 18387 10239 1 13 . 1 1 54 54 THR CA C 54 67.683 67.683 67.266 0.417 18387 10240 1 13 . 1 1 54 54 THR CB C 54 68.452 68.452 69.114 -0.662 18387 10241 1 13 . 1 1 54 54 THR H H 54 7.771 7.771 8.039 -0.268 18387 10242 1 13 . 1 1 55 55 TYR N N 55 122.202 122.202 122.233 -0.031 18387 10243 1 13 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.304 -0.032 18387 10244 1 13 . 1 1 55 55 TYR C C 55 176.809 176.809 177.558 -0.749 18387 10245 1 13 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.853 0.883 18387 10246 1 13 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.642 0.638 18387 10247 1 13 . 1 1 55 55 TYR H H 55 9.145 9.145 8.756 0.389 18387 10248 1 13 . 1 1 56 56 ASN N N 56 113.858 113.858 117.663 -3.805 18387 10249 1 13 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.464 -0.201 18387 10250 1 13 . 1 1 56 56 ASN C C 56 177.427 177.427 176.773 0.654 18387 10251 1 13 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.696 0.234 18387 10252 1 13 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.515 -0.561 18387 10253 1 13 . 1 1 56 56 ASN H H 56 8.850 8.850 8.225 0.625 18387 10254 1 13 . 1 1 57 57 ALA N N 57 118.829 118.829 119.893 -1.064 18387 10255 1 13 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.243 -0.179 18387 10256 1 13 . 1 1 57 57 ALA C C 57 180.445 180.445 178.533 1.912 18387 10257 1 13 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.906 0.446 18387 10258 1 13 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.092 0.102 18387 10259 1 13 . 1 1 57 57 ALA H H 57 7.436 7.436 7.563 -0.127 18387 10260 1 13 . 1 1 58 58 PHE N N 58 112.082 112.082 116.380 -4.298 18387 10261 1 13 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.512 0.409 18387 10262 1 13 . 1 1 58 58 PHE C C 58 176.999 176.999 177.475 -0.476 18387 10263 1 13 . 1 1 58 58 PHE CA C 58 58.067 58.067 59.067 -1.000 18387 10264 1 13 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.929 0.561 18387 10265 1 13 . 1 1 58 58 PHE H H 58 7.480 7.480 8.155 -0.675 18387 10266 1 13 . 1 1 59 59 LYS N N 59 120.666 120.666 121.122 -0.456 18387 10267 1 13 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.236 0.567 18387 10268 1 13 . 1 1 59 59 LYS C C 59 177.157 177.157 177.304 -0.147 18387 10269 1 13 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.084 -0.003 18387 10270 1 13 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.711 -1.143 18387 10271 1 13 . 1 1 59 59 LYS H H 59 8.411 8.411 7.725 0.686 18387 10272 1 13 . 1 1 60 60 ASP N N 60 118.908 118.908 118.620 0.288 18387 10273 1 13 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.680 0.445 18387 10274 1 13 . 1 1 60 60 ASP C C 60 176.889 176.889 176.567 0.322 18387 10275 1 13 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.582 -0.933 18387 10276 1 13 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.259 0.453 18387 10277 1 13 . 1 1 60 60 ASP H H 60 8.574 8.574 8.488 0.086 18387 10278 1 13 . 1 1 61 61 LYS N N 61 121.021 121.021 119.176 1.845 18387 10279 1 13 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.629 0.085 18387 10280 1 13 . 1 1 61 61 LYS C C 61 175.968 175.968 176.475 -0.507 18387 10281 1 13 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.556 -0.419 18387 10282 1 13 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.388 0.690 18387 10283 1 13 . 1 1 61 61 LYS H H 61 8.278 8.278 7.774 0.504 18387 10284 1 13 . 1 1 62 62 GLY C C 62 173.837 173.837 173.645 0.192 18387 10285 1 13 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.683 1.367 18387 10286 1 13 . 1 1 63 63 PHE N N 63 120.476 120.476 120.307 0.169 18387 10287 1 13 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.770 0.263 18387 10288 1 13 . 1 1 63 63 PHE C C 63 173.613 173.613 173.282 0.331 18387 10289 1 13 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.363 -0.513 18387 10290 1 13 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.166 -0.492 18387 10291 1 13 . 1 1 63 63 PHE H H 63 7.413 7.413 7.709 -0.296 18387 10292 1 13 . 1 1 64 64 THR N N 64 119.903 119.903 119.037 0.866 18387 10293 1 13 . 1 1 64 64 THR HA H 64 4.097 4.097 4.994 -0.897 18387 10294 1 13 . 1 1 64 64 THR C C 64 170.397 170.397 172.443 -2.046 18387 10295 1 13 . 1 1 64 64 THR CA C 64 60.261 60.261 60.031 0.230 18387 10296 1 13 . 1 1 64 64 THR CB C 64 69.507 69.507 71.647 -2.140 18387 10297 1 13 . 1 1 64 64 THR H H 64 7.665 7.665 8.527 -0.862 18387 10298 1 13 . 1 1 65 65 ILE N N 65 117.277 117.277 128.602 -11.325 18387 10299 1 13 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.192 0.284 18387 10300 1 13 . 1 1 65 65 ILE C C 65 173.056 173.056 175.115 -2.059 18387 10301 1 13 . 1 1 65 65 ILE CA C 65 59.708 59.708 61.325 -1.617 18387 10302 1 13 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.119 1.726 18387 10303 1 13 . 1 1 65 65 ILE H H 65 7.321 7.321 9.099 -1.778 18387 10304 1 13 . 1 1 66 66 TYR N N 66 131.968 131.968 131.076 0.892 18387 10305 1 13 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.165 0.082 18387 10306 1 13 . 1 1 66 66 TYR C C 66 174.074 174.074 174.935 -0.861 18387 10307 1 13 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.120 -0.155 18387 10308 1 13 . 1 1 66 66 TYR CB C 66 41.117 41.117 38.523 2.594 18387 10309 1 13 . 1 1 66 66 TYR H H 66 9.038 9.038 9.168 -0.130 18387 10310 1 13 . 1 1 67 67 GLY N N 67 114.364 114.364 115.696 -1.332 18387 10311 1 13 . 1 1 67 67 GLY C C 67 172.461 172.461 172.666 -0.205 18387 10312 1 13 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.563 0.437 18387 10313 1 13 . 1 1 67 67 GLY H H 67 9.188 9.188 8.979 0.209 18387 10314 1 13 . 1 1 68 68 VAL N N 68 126.938 126.938 126.808 0.130 18387 10315 1 13 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.504 -0.368 18387 10316 1 13 . 1 1 68 68 VAL C C 68 173.822 173.822 174.292 -0.470 18387 10317 1 13 . 1 1 68 68 VAL CA C 68 61.498 61.498 60.462 1.036 18387 10318 1 13 . 1 1 68 68 VAL CB C 68 33.558 33.558 31.980 1.578 18387 10319 1 13 . 1 1 68 68 VAL H H 68 9.309 9.309 8.926 0.383 18387 10320 1 13 . 1 1 69 69 SER N N 69 118.813 118.813 120.862 -2.049 18387 10321 1 13 . 1 1 69 69 SER HA H 69 5.527 5.527 5.001 0.526 18387 10322 1 13 . 1 1 69 69 SER C C 69 175.753 175.753 172.448 3.305 18387 10323 1 13 . 1 1 69 69 SER CA C 69 54.407 54.407 55.848 -1.441 18387 10324 1 13 . 1 1 69 69 SER CB C 69 63.630 63.630 65.215 -1.585 18387 10325 1 13 . 1 1 69 69 SER H H 69 8.124 8.124 8.786 -0.662 18387 10326 1 13 . 1 1 70 70 THR N N 70 113.861 113.861 119.409 -5.548 18387 10327 1 13 . 1 1 70 70 THR HA H 70 4.381 4.381 4.291 0.090 18387 10328 1 13 . 1 1 70 70 THR C C 70 175.001 175.001 173.114 1.887 18387 10329 1 13 . 1 1 70 70 THR CA C 70 60.259 60.259 60.094 0.165 18387 10330 1 13 . 1 1 70 70 THR CB C 70 67.291 67.291 68.798 -1.507 18387 10331 1 13 . 1 1 70 70 THR H H 70 7.656 7.656 7.989 -0.333 18387 10332 1 13 . 1 1 71 71 ASP N N 71 125.133 125.133 122.142 2.991 18387 10333 1 13 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.607 -0.537 18387 10334 1 13 . 1 1 71 71 ASP C C 71 175.685 175.685 177.535 -1.850 18387 10335 1 13 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.909 2.703 18387 10336 1 13 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.538 -0.169 18387 10337 1 13 . 1 1 71 71 ASP H H 71 8.931 8.931 7.753 1.178 18387 10338 1 13 . 1 1 72 72 ARG N N 72 118.814 118.814 117.718 1.096 18387 10339 1 13 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.145 0.050 18387 10340 1 13 . 1 1 72 72 ARG C C 72 177.300 177.300 176.524 0.776 18387 10341 1 13 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.610 -0.801 18387 10342 1 13 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.674 0.437 18387 10343 1 13 . 1 1 72 72 ARG H H 72 8.057 8.057 8.562 -0.505 18387 10344 1 13 . 1 1 73 73 ARG N N 73 118.174 118.174 120.142 -1.968 18387 10345 1 13 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.529 0.225 18387 10346 1 13 . 1 1 73 73 ARG C C 73 176.503 176.503 175.852 0.651 18387 10347 1 13 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.419 -0.883 18387 10348 1 13 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.661 -1.633 18387 10349 1 13 . 1 1 73 73 ARG H H 73 8.639 8.639 7.528 1.111 18387 10350 1 13 . 1 1 74 74 GLU N N 74 127.609 127.609 127.760 -0.151 18387 10351 1 13 . 1 1 74 74 GLU HA H 74 4.079 4.079 3.999 0.080 18387 10352 1 13 . 1 1 74 74 GLU C C 74 178.107 178.107 177.779 0.328 18387 10353 1 13 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.760 -0.975 18387 10354 1 13 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.906 0.192 18387 10355 1 13 . 1 1 74 74 GLU H H 74 9.129 9.129 9.132 -0.003 18387 10356 1 13 . 1 1 75 75 GLU N N 75 117.874 117.874 118.106 -0.232 18387 10357 1 13 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.148 -0.048 18387 10358 1 13 . 1 1 75 75 GLU C C 75 178.993 178.993 178.468 0.525 18387 10359 1 13 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.654 0.473 18387 10360 1 13 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.891 0.400 18387 10361 1 13 . 1 1 75 75 GLU H H 75 9.745 9.745 8.818 0.927 18387 10362 1 13 . 1 1 76 76 ASP N N 76 119.182 119.182 120.610 -1.428 18387 10363 1 13 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.476 -0.110 18387 10364 1 13 . 1 1 76 76 ASP C C 76 178.107 178.107 178.249 -0.142 18387 10365 1 13 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.740 0.233 18387 10366 1 13 . 1 1 76 76 ASP CB C 76 40.520 40.520 39.990 0.530 18387 10367 1 13 . 1 1 76 76 ASP H H 76 7.004 7.004 8.491 -1.487 18387 10368 1 13 . 1 1 77 77 TRP N N 77 123.008 123.008 123.642 -0.634 18387 10369 1 13 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.319 -0.170 18387 10370 1 13 . 1 1 77 77 TRP C C 77 176.236 176.236 177.528 -1.292 18387 10371 1 13 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.728 -1.245 18387 10372 1 13 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.338 -0.803 18387 10373 1 13 . 1 1 77 77 TRP H H 77 7.112 7.112 8.512 -1.400 18387 10374 1 13 . 1 1 78 78 LYS N N 78 115.727 115.727 118.396 -2.669 18387 10375 1 13 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.387 -0.142 18387 10376 1 13 . 1 1 78 78 LYS C C 78 179.426 179.426 178.825 0.601 18387 10377 1 13 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.685 0.747 18387 10378 1 13 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.849 0.896 18387 10379 1 13 . 1 1 78 78 LYS H H 78 8.431 8.431 8.491 -0.060 18387 10380 1 13 . 1 1 79 79 LYS N N 79 118.321 118.321 119.408 -1.087 18387 10381 1 13 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.920 0.100 18387 10382 1 13 . 1 1 79 79 LYS C C 79 178.239 178.239 178.575 -0.336 18387 10383 1 13 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.522 -0.455 18387 10384 1 13 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.513 -0.050 18387 10385 1 13 . 1 1 79 79 LYS H H 79 7.690 7.690 8.270 -0.580 18387 10386 1 13 . 1 1 80 80 ALA N N 80 120.679 120.679 122.150 -1.471 18387 10387 1 13 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.062 0.093 18387 10388 1 13 . 1 1 80 80 ALA C C 80 178.811 178.811 179.845 -1.034 18387 10389 1 13 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.058 0.029 18387 10390 1 13 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.338 0.420 18387 10391 1 13 . 1 1 80 80 ALA H H 80 7.560 7.560 8.182 -0.622 18387 10392 1 13 . 1 1 81 81 ILE N N 81 118.019 118.019 119.721 -1.702 18387 10393 1 13 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.519 -0.117 18387 10394 1 13 . 1 1 81 81 ILE C C 81 178.113 178.113 178.036 0.077 18387 10395 1 13 . 1 1 81 81 ILE CA C 81 64.520 64.520 63.163 1.356 18387 10396 1 13 . 1 1 81 81 ILE CB C 81 38.204 38.204 36.068 2.136 18387 10397 1 13 . 1 1 81 81 ILE H H 81 7.514 7.514 8.472 -0.958 18387 10398 1 13 . 1 1 82 82 GLU N N 82 117.252 117.252 119.916 -2.664 18387 10399 1 13 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.782 0.312 18387 10400 1 13 . 1 1 82 82 GLU C C 82 179.558 179.558 179.615 -0.057 18387 10401 1 13 . 1 1 82 82 GLU CA C 82 58.580 58.580 59.148 -0.568 18387 10402 1 13 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.210 0.173 18387 10403 1 13 . 1 1 82 82 GLU H H 82 7.401 7.401 8.150 -0.749 18387 10404 1 13 . 1 1 83 83 GLU N N 83 119.340 119.340 119.000 0.340 18387 10405 1 13 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.123 -0.225 18387 10406 1 13 . 1 1 83 83 GLU C C 83 178.740 178.740 178.109 0.631 18387 10407 1 13 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.573 0.426 18387 10408 1 13 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.246 0.674 18387 10409 1 13 . 1 1 83 83 GLU H H 83 8.191 8.191 7.714 0.477 18387 10410 1 13 . 1 1 84 84 ASP N N 84 118.449 118.449 117.107 1.342 18387 10411 1 13 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.371 -0.097 18387 10412 1 13 . 1 1 84 84 ASP C C 84 175.597 175.597 175.408 0.189 18387 10413 1 13 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.599 0.448 18387 10414 1 13 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.927 -1.031 18387 10415 1 13 . 1 1 84 84 ASP H H 84 8.252 8.252 7.798 0.454 18387 10416 1 13 . 1 1 85 85 LYS N N 85 116.410 116.410 115.183 1.227 18387 10417 1 13 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.448 -0.275 18387 10418 1 13 . 1 1 85 85 LYS C C 85 176.856 176.856 175.372 1.484 18387 10419 1 13 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.705 -0.732 18387 10420 1 13 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.117 -0.249 18387 10421 1 13 . 1 1 85 85 LYS H H 85 7.890 7.890 7.477 0.413 18387 10422 1 13 . 1 1 86 86 SER N N 86 112.295 112.295 114.429 -2.134 18387 10423 1 13 . 1 1 86 86 SER HA H 86 3.139 3.139 3.921 -0.782 18387 10424 1 13 . 1 1 86 86 SER C C 86 175.805 175.805 172.592 3.213 18387 10425 1 13 . 1 1 86 86 SER CA C 86 53.637 53.637 56.592 -2.955 18387 10426 1 13 . 1 1 86 86 SER CB C 86 60.736 60.736 61.418 -0.682 18387 10427 1 13 . 1 1 86 86 SER H H 86 7.327 7.327 7.200 0.127 18387 10428 1 13 . 1 1 87 87 TYR N N 87 120.962 120.962 125.218 -4.256 18387 10429 1 13 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.213 0.092 18387 10430 1 13 . 1 1 87 87 TYR C C 87 177.064 177.064 174.443 2.621 18387 10431 1 13 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.579 -0.356 18387 10432 1 13 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.387 -1.034 18387 10433 1 13 . 1 1 87 87 TYR H H 87 6.933 6.933 7.546 -0.613 18387 10434 1 13 . 1 1 88 88 TRP N N 88 118.597 118.597 122.536 -3.939 18387 10435 1 13 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.443 0.408 18387 10436 1 13 . 1 1 88 88 TRP C C 88 175.456 175.456 174.373 1.083 18387 10437 1 13 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.940 1.296 18387 10438 1 13 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.257 -3.530 18387 10439 1 13 . 1 1 88 88 TRP H H 88 6.552 6.552 7.082 -0.530 18387 10440 1 13 . 1 1 89 89 ASN N N 89 118.067 118.067 120.938 -2.871 18387 10441 1 13 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.807 0.242 18387 10442 1 13 . 1 1 89 89 ASN C C 89 173.773 173.773 174.614 -0.841 18387 10443 1 13 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.152 1.304 18387 10444 1 13 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.601 1.596 18387 10445 1 13 . 1 1 89 89 ASN H H 89 7.864 7.864 8.569 -0.705 18387 10446 1 13 . 1 1 90 90 GLN N N 90 125.392 125.392 121.754 3.638 18387 10447 1 13 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.402 0.095 18387 10448 1 13 . 1 1 90 90 GLN C C 90 176.491 176.491 174.945 1.546 18387 10449 1 13 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.931 0.529 18387 10450 1 13 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.572 -2.345 18387 10451 1 13 . 1 1 90 90 GLN H H 90 7.904 7.904 8.260 -0.356 18387 10452 1 13 . 1 1 91 91 VAL N N 91 114.434 114.434 116.810 -2.376 18387 10453 1 13 . 1 1 91 91 VAL HA H 91 5.480 5.480 5.126 0.354 18387 10454 1 13 . 1 1 91 91 VAL C C 91 174.248 174.248 172.782 1.466 18387 10455 1 13 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.386 -0.380 18387 10456 1 13 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.579 1.059 18387 10457 1 13 . 1 1 91 91 VAL H H 91 9.585 9.585 9.170 0.415 18387 10458 1 13 . 1 1 92 92 LEU N N 92 126.910 126.910 124.495 2.415 18387 10459 1 13 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.447 -0.378 18387 10460 1 13 . 1 1 92 92 LEU C C 92 177.696 177.696 175.846 1.850 18387 10461 1 13 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.106 0.738 18387 10462 1 13 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.920 0.027 18387 10463 1 13 . 1 1 92 92 LEU H H 92 8.941 8.941 8.528 0.413 18387 10464 1 13 . 1 1 93 93 LEU N N 93 125.673 125.673 128.394 -2.721 18387 10465 1 13 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.080 0.320 18387 10466 1 13 . 1 1 93 93 LEU C C 93 177.291 177.291 176.239 1.052 18387 10467 1 13 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.300 -0.349 18387 10468 1 13 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.882 1.297 18387 10469 1 13 . 1 1 93 93 LEU H H 93 8.038 8.038 8.837 -0.799 18387 10470 1 13 . 1 1 94 94 GLN N N 94 122.206 122.206 122.427 -0.221 18387 10471 1 13 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.140 0.097 18387 10472 1 13 . 1 1 94 94 GLN C C 94 178.246 178.246 176.603 1.643 18387 10473 1 13 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.054 -0.279 18387 10474 1 13 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.572 -0.317 18387 10475 1 13 . 1 1 94 94 GLN H H 94 9.298 9.298 7.950 1.348 18387 10476 1 13 . 1 1 95 95 LYS N N 95 122.668 122.668 123.289 -0.621 18387 10477 1 13 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.942 0.024 18387 10478 1 13 . 1 1 95 95 LYS C C 95 178.787 178.787 177.730 1.057 18387 10479 1 13 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.962 1.110 18387 10480 1 13 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.792 0.673 18387 10481 1 13 . 1 1 95 95 LYS H H 95 8.645 8.645 8.835 -0.190 18387 10482 1 13 . 1 1 96 96 ASP N N 96 116.775 116.775 118.165 -1.390 18387 10483 1 13 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.404 0.176 18387 10484 1 13 . 1 1 96 96 ASP C C 96 176.220 176.220 178.482 -2.262 18387 10485 1 13 . 1 1 96 96 ASP CA C 96 56.346 56.346 57.100 -0.754 18387 10486 1 13 . 1 1 96 96 ASP CB C 96 40.557 40.557 39.651 0.906 18387 10487 1 13 . 1 1 96 96 ASP H H 96 8.606 8.606 8.305 0.301 18387 10488 1 13 . 1 1 97 97 ASP N N 97 118.213 118.213 120.780 -2.567 18387 10489 1 13 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.385 0.542 18387 10490 1 13 . 1 1 97 97 ASP C C 97 176.954 176.954 177.979 -1.025 18387 10491 1 13 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.617 -1.258 18387 10492 1 13 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.836 1.488 18387 10493 1 13 . 1 1 97 97 ASP H H 97 7.988 7.988 7.984 0.004 18387 10494 1 13 . 1 1 98 98 VAL N N 98 118.907 118.907 119.212 -0.305 18387 10495 1 13 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.384 0.032 18387 10496 1 13 . 1 1 98 98 VAL C C 98 176.470 176.470 177.694 -1.224 18387 10497 1 13 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.320 1.458 18387 10498 1 13 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.114 1.277 18387 10499 1 13 . 1 1 98 98 VAL H H 98 7.098 7.098 8.581 -1.483 18387 10500 1 13 . 1 1 99 99 LYS N N 99 117.909 117.909 118.931 -1.022 18387 10501 1 13 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.830 0.113 18387 10502 1 13 . 1 1 99 99 LYS C C 99 178.762 178.762 178.495 0.267 18387 10503 1 13 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.913 0.232 18387 10504 1 13 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.813 0.199 18387 10505 1 13 . 1 1 99 99 LYS H H 99 8.304 8.304 7.406 0.898 18387 10506 1 13 . 1 1 100 100 ASP N N 100 117.843 117.843 119.167 -1.324 18387 10507 1 13 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.406 0.072 18387 10508 1 13 . 1 1 100 100 ASP C C 100 179.694 179.694 178.493 1.201 18387 10509 1 13 . 1 1 100 100 ASP CA C 100 57.526 57.526 56.780 0.746 18387 10510 1 13 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.859 -0.031 18387 10511 1 13 . 1 1 100 100 ASP H H 100 8.024 8.024 7.692 0.332 18387 10512 1 13 . 1 1 101 101 VAL N N 101 122.202 122.202 119.889 2.313 18387 10513 1 13 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.539 0.456 18387 10514 1 13 . 1 1 101 101 VAL C C 101 178.533 178.533 178.100 0.433 18387 10515 1 13 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.367 0.635 18387 10516 1 13 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.134 0.903 18387 10517 1 13 . 1 1 101 101 VAL H H 101 8.205 8.205 7.447 0.758 18387 10518 1 13 . 1 1 102 102 LEU N N 102 118.798 118.798 119.281 -0.483 18387 10519 1 13 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.234 0.546 18387 10520 1 13 . 1 1 102 102 LEU C C 102 180.254 180.254 178.857 1.397 18387 10521 1 13 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.626 1.315 18387 10522 1 13 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.192 -0.753 18387 10523 1 13 . 1 1 102 102 LEU H H 102 8.422 8.422 7.773 0.649 18387 10524 1 13 . 1 1 103 103 GLU N N 103 116.915 116.915 119.410 -2.495 18387 10525 1 13 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.865 0.270 18387 10526 1 13 . 1 1 103 103 GLU C C 103 180.910 180.910 179.320 1.590 18387 10527 1 13 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.984 0.419 18387 10528 1 13 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.169 0.562 18387 10529 1 13 . 1 1 103 103 GLU H H 103 8.262 8.262 7.696 0.566 18387 10530 1 13 . 1 1 104 104 SER N N 104 117.866 117.866 116.341 1.525 18387 10531 1 13 . 1 1 104 104 SER HA H 104 4.216 4.216 4.173 0.043 18387 10532 1 13 . 1 1 104 104 SER C C 104 175.455 175.455 176.734 -1.279 18387 10533 1 13 . 1 1 104 104 SER CA C 104 62.019 62.019 61.570 0.449 18387 10534 1 13 . 1 1 104 104 SER CB C 104 62.891 62.891 63.426 -0.535 18387 10535 1 13 . 1 1 104 104 SER H H 104 8.544 8.544 8.495 0.049 18387 10536 1 13 . 1 1 105 105 TYR N N 105 117.278 117.278 117.856 -0.578 18387 10537 1 13 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.507 -0.235 18387 10538 1 13 . 1 1 105 105 TYR C C 105 174.750 174.750 175.232 -0.482 18387 10539 1 13 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.155 2.704 18387 10540 1 13 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.562 2.149 18387 10541 1 13 . 1 1 105 105 TYR H H 105 7.691 7.691 7.847 -0.156 18387 10542 1 13 . 1 1 106 106 CYS N N 106 116.897 116.897 118.965 -2.068 18387 10543 1 13 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.119 -0.224 18387 10544 1 13 . 1 1 106 106 CYS C C 106 174.056 174.056 173.494 0.562 18387 10545 1 13 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.789 -0.179 18387 10546 1 13 . 1 1 106 106 CYS CB C 106 25.032 25.032 26.035 -1.003 18387 10547 1 13 . 1 1 106 106 CYS H H 106 7.862 7.862 8.407 -0.545 18387 10548 1 13 . 1 1 107 107 ILE N N 107 118.885 118.885 123.309 -4.424 18387 10549 1 13 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.752 -0.413 18387 10550 1 13 . 1 1 107 107 ILE C C 107 176.793 176.793 175.480 1.313 18387 10551 1 13 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.779 1.966 18387 10552 1 13 . 1 1 107 107 ILE CB C 107 38.079 38.079 35.391 2.688 18387 10553 1 13 . 1 1 107 107 ILE H H 107 7.707 7.707 7.816 -0.109 18387 10554 1 13 . 1 1 108 108 VAL N N 108 123.983 123.983 127.020 -3.037 18387 10555 1 13 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.212 0.062 18387 10556 1 13 . 1 1 108 108 VAL C C 108 175.476 175.476 175.977 -0.501 18387 10557 1 13 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.678 -1.054 18387 10558 1 13 . 1 1 108 108 VAL CB C 108 33.008 33.008 33.035 -0.028 18387 10559 1 13 . 1 1 108 108 VAL H H 108 8.656 8.656 7.958 0.698 18387 10560 1 13 . 1 1 109 109 GLY N N 109 110.120 110.120 106.827 3.293 18387 10561 1 13 . 1 1 109 109 GLY C C 109 169.982 169.982 171.953 -1.971 18387 10562 1 13 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.236 -0.633 18387 10563 1 13 . 1 1 109 109 GLY H H 109 7.500 7.500 7.620 -0.120 18387 10564 1 13 . 1 1 110 110 PHE N N 110 115.276 115.276 116.483 -1.207 18387 10565 1 13 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.321 -0.547 18387 10566 1 13 . 1 1 110 110 PHE C C 110 174.361 174.361 173.694 0.667 18387 10567 1 13 . 1 1 110 110 PHE CA C 110 55.687 55.687 54.939 0.748 18387 10568 1 13 . 1 1 110 110 PHE CB C 110 41.951 41.951 39.832 2.119 18387 10569 1 13 . 1 1 110 110 PHE H H 110 8.203 8.203 7.724 0.479 18387 10570 1 13 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.083 0.276 18387 10571 1 13 . 1 1 111 111 PRO C C 111 175.691 175.691 176.128 -0.437 18387 10572 1 13 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.653 -0.496 18387 10573 1 13 . 1 1 111 111 PRO CB C 111 35.304 35.304 32.489 2.815 18387 10574 1 13 . 1 1 112 112 HIS N N 112 123.708 123.708 122.190 1.518 18387 10575 1 13 . 1 1 112 112 HIS HA H 112 4.963 4.963 5.021 -0.058 18387 10576 1 13 . 1 1 112 112 HIS C C 112 173.649 173.649 173.874 -0.225 18387 10577 1 13 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.766 1.308 18387 10578 1 13 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.120 0.077 18387 10579 1 13 . 1 1 112 112 HIS H H 112 8.952 8.952 9.060 -0.108 18387 10580 1 13 . 1 1 113 113 ILE N N 113 128.596 128.596 128.724 -0.128 18387 10581 1 13 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.839 0.858 18387 10582 1 13 . 1 1 113 113 ILE C C 113 176.130 176.130 174.491 1.639 18387 10583 1 13 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.718 0.277 18387 10584 1 13 . 1 1 113 113 ILE CB C 113 38.055 38.055 38.627 -0.572 18387 10585 1 13 . 1 1 113 113 ILE H H 113 8.808 8.808 8.697 0.111 18387 10586 1 13 . 1 1 114 114 ILE N N 114 119.668 119.668 122.235 -2.567 18387 10587 1 13 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.655 0.318 18387 10588 1 13 . 1 1 114 114 ILE C C 114 173.186 173.186 173.473 -0.287 18387 10589 1 13 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.730 -0.000 18387 10590 1 13 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.123 0.417 18387 10591 1 13 . 1 1 114 114 ILE H H 114 8.721 8.721 9.115 -0.394 18387 10592 1 13 . 1 1 115 115 LEU N N 115 122.770 122.770 122.790 -0.020 18387 10593 1 13 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.261 0.014 18387 10594 1 13 . 1 1 115 115 LEU C C 115 173.601 173.601 175.032 -1.431 18387 10595 1 13 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.064 0.718 18387 10596 1 13 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.539 1.595 18387 10597 1 13 . 1 1 115 115 LEU H H 115 8.665 8.665 8.826 -0.161 18387 10598 1 13 . 1 1 116 116 VAL N N 116 130.411 130.411 125.806 4.605 18387 10599 1 13 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.003 -0.145 18387 10600 1 13 . 1 1 116 116 VAL C C 116 174.565 174.565 175.196 -0.631 18387 10601 1 13 . 1 1 116 116 VAL CA C 116 60.804 60.804 59.869 0.935 18387 10602 1 13 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.178 -0.263 18387 10603 1 13 . 1 1 116 116 VAL H H 116 9.472 9.472 9.197 0.275 18387 10604 1 13 . 1 1 117 117 ASP N N 117 127.896 127.896 125.821 2.075 18387 10605 1 13 . 1 1 117 117 ASP HA H 117 4.392 4.392 5.015 -0.623 18387 10606 1 13 . 1 1 117 117 ASP C C 117 176.567 176.567 176.117 0.450 18387 10607 1 13 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.468 1.132 18387 10608 1 13 . 1 1 117 117 ASP CB C 117 40.584 40.584 41.136 -0.552 18387 10609 1 13 . 1 1 117 117 ASP H H 117 9.429 9.429 8.522 0.907 18387 10610 1 13 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.382 -0.188 18387 10611 1 13 . 1 1 118 118 PRO C C 118 177.534 177.534 178.530 -0.996 18387 10612 1 13 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.397 -0.232 18387 10613 1 13 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.892 0.921 18387 10614 1 13 . 1 1 119 119 GLU N N 119 114.015 114.015 116.759 -2.744 18387 10615 1 13 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.146 0.193 18387 10616 1 13 . 1 1 119 119 GLU C C 119 176.722 176.722 177.809 -1.087 18387 10617 1 13 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.595 -1.956 18387 10618 1 13 . 1 1 119 119 GLU CB C 119 30.577 30.577 30.046 0.531 18387 10619 1 13 . 1 1 119 119 GLU H H 119 7.733 7.733 9.236 -1.503 18387 10620 1 13 . 1 1 120 120 GLY N N 120 108.218 108.218 107.123 1.095 18387 10621 1 13 . 1 1 120 120 GLY C C 120 174.110 174.110 173.422 0.688 18387 10622 1 13 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.995 0.401 18387 10623 1 13 . 1 1 120 120 GLY H H 120 8.588 8.588 8.272 0.316 18387 10624 1 13 . 1 1 121 121 LYS N N 121 121.778 121.778 120.301 1.477 18387 10625 1 13 . 1 1 121 121 LYS HA H 121 4.859 4.859 4.897 -0.038 18387 10626 1 13 . 1 1 121 121 LYS C C 121 176.458 176.458 176.014 0.444 18387 10627 1 13 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.676 0.286 18387 10628 1 13 . 1 1 121 121 LYS CB C 121 33.452 33.452 34.545 -1.093 18387 10629 1 13 . 1 1 121 121 LYS H H 121 8.600 8.600 8.853 -0.253 18387 10630 1 13 . 1 1 122 122 ILE N N 122 122.058 122.058 125.561 -3.503 18387 10631 1 13 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.395 -0.123 18387 10632 1 13 . 1 1 122 122 ILE C C 122 177.084 177.084 177.080 0.004 18387 10633 1 13 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.021 0.798 18387 10634 1 13 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.651 1.996 18387 10635 1 13 . 1 1 122 122 ILE H H 122 9.006 9.006 8.842 0.164 18387 10636 1 13 . 1 1 123 123 VAL N N 123 120.561 120.561 125.739 -5.178 18387 10637 1 13 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.146 0.609 18387 10638 1 13 . 1 1 123 123 VAL C C 123 175.584 175.584 175.402 0.182 18387 10639 1 13 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.107 -1.956 18387 10640 1 13 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.046 1.355 18387 10641 1 13 . 1 1 123 123 VAL H H 123 9.054 9.054 8.326 0.728 18387 10642 1 13 . 1 1 124 124 ALA N N 124 121.102 121.102 121.420 -0.318 18387 10643 1 13 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.635 0.022 18387 10644 1 13 . 1 1 124 124 ALA C C 124 174.832 174.832 174.768 0.064 18387 10645 1 13 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.709 0.751 18387 10646 1 13 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.040 1.790 18387 10647 1 13 . 1 1 124 124 ALA H H 124 7.793 7.793 7.316 0.477 18387 10648 1 13 . 1 1 125 125 LYS N N 125 117.637 117.637 121.800 -4.163 18387 10649 1 13 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.463 0.570 18387 10650 1 13 . 1 1 125 125 LYS C C 125 173.417 173.417 175.546 -2.129 18387 10651 1 13 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.241 -0.100 18387 10652 1 13 . 1 1 125 125 LYS CB C 125 36.651 36.651 34.623 2.028 18387 10653 1 13 . 1 1 125 125 LYS H H 125 8.872 8.872 8.442 0.430 18387 10654 1 13 . 1 1 126 126 GLU N N 126 115.236 115.236 118.761 -3.525 18387 10655 1 13 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.833 0.165 18387 10656 1 13 . 1 1 126 126 GLU C C 126 175.998 175.998 175.953 0.045 18387 10657 1 13 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.138 -0.176 18387 10658 1 13 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.247 -0.812 18387 10659 1 13 . 1 1 126 126 GLU H H 126 7.941 7.941 8.310 -0.369 18387 10660 1 13 . 1 1 127 127 LEU N N 127 118.584 118.584 118.657 -0.073 18387 10661 1 13 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.366 0.016 18387 10662 1 13 . 1 1 127 127 LEU C C 127 176.766 176.766 176.822 -0.056 18387 10663 1 13 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.242 -0.633 18387 10664 1 13 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.744 1.219 18387 10665 1 13 . 1 1 127 127 LEU H H 127 7.300 7.300 7.637 -0.337 18387 10666 1 13 . 1 1 128 128 ARG N N 128 118.625 118.625 118.950 -0.325 18387 10667 1 13 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.651 -0.176 18387 10668 1 13 . 1 1 128 128 ARG C C 128 177.113 177.113 176.890 0.223 18387 10669 1 13 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.055 0.335 18387 10670 1 13 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.427 2.185 18387 10671 1 13 . 1 1 128 128 ARG H H 128 7.929 7.929 9.030 -1.101 18387 10672 1 13 . 1 1 129 129 GLY N N 129 114.010 114.010 113.931 0.079 18387 10673 1 13 . 1 1 129 129 GLY C C 129 175.931 175.931 174.126 1.805 18387 10674 1 13 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.167 -0.706 18387 10675 1 13 . 1 1 129 129 GLY H H 129 10.649 10.649 9.391 1.258 18387 10676 1 13 . 1 1 130 130 ASP N N 130 123.975 123.975 123.281 0.694 18387 10677 1 13 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.369 0.163 18387 10678 1 13 . 1 1 130 130 ASP C C 130 177.507 177.507 177.757 -0.250 18387 10679 1 13 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.309 1.063 18387 10680 1 13 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.670 0.233 18387 10681 1 13 . 1 1 130 130 ASP H H 130 8.540 8.540 8.004 0.536 18387 10682 1 13 . 1 1 131 131 ASP N N 131 116.806 116.806 121.592 -4.786 18387 10683 1 13 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.297 0.273 18387 10684 1 13 . 1 1 131 131 ASP C C 131 179.038 179.038 178.039 0.999 18387 10685 1 13 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.330 -0.347 18387 10686 1 13 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.652 0.282 18387 10687 1 13 . 1 1 131 131 ASP H H 131 7.907 7.907 7.901 0.006 18387 10688 1 13 . 1 1 132 132 LEU N N 132 123.869 123.869 117.401 6.468 18387 10689 1 13 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.072 -0.281 18387 10690 1 13 . 1 1 132 132 LEU C C 132 176.343 176.343 178.438 -2.095 18387 10691 1 13 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.101 1.683 18387 10692 1 13 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.929 0.839 18387 10693 1 13 . 1 1 132 132 LEU H H 132 7.542 7.542 7.565 -0.023 18387 10694 1 13 . 1 1 133 133 TYR N N 133 120.042 120.042 120.577 -0.535 18387 10695 1 13 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.011 -0.015 18387 10696 1 13 . 1 1 133 133 TYR C C 133 177.426 177.426 177.389 0.037 18387 10697 1 13 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.186 -0.053 18387 10698 1 13 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.674 -0.098 18387 10699 1 13 . 1 1 133 133 TYR H H 133 7.384 7.384 7.729 -0.345 18387 10700 1 13 . 1 1 134 134 ASN N N 134 114.936 114.936 117.606 -2.670 18387 10701 1 13 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.520 -0.117 18387 10702 1 13 . 1 1 134 134 ASN C C 134 178.703 178.703 177.959 0.744 18387 10703 1 13 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.970 -1.161 18387 10704 1 13 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.470 -0.262 18387 10705 1 13 . 1 1 134 134 ASN H H 134 8.399 8.399 8.351 0.048 18387 10706 1 13 . 1 1 135 135 THR N N 135 117.387 117.387 117.470 -0.083 18387 10707 1 13 . 1 1 135 135 THR HA H 135 3.920 3.920 4.131 -0.211 18387 10708 1 13 . 1 1 135 135 THR C C 135 175.323 175.323 176.378 -1.055 18387 10709 1 13 . 1 1 135 135 THR CA C 135 67.402 67.402 67.315 0.087 18387 10710 1 13 . 1 1 135 135 THR CB C 135 68.111 68.111 68.809 -0.698 18387 10711 1 13 . 1 1 135 135 THR H H 135 8.265 8.265 8.698 -0.433 18387 10712 1 13 . 1 1 136 136 VAL N N 136 121.207 121.207 121.108 0.099 18387 10713 1 13 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.661 -0.646 18387 10714 1 13 . 1 1 136 136 VAL C C 136 176.457 176.457 177.619 -1.162 18387 10715 1 13 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.286 1.986 18387 10716 1 13 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.758 0.183 18387 10717 1 13 . 1 1 136 136 VAL H H 136 7.595 7.595 7.548 0.047 18387 10718 1 13 . 1 1 137 137 GLU N N 137 118.266 118.266 119.993 -1.727 18387 10719 1 13 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.107 -1.425 18387 10720 1 13 . 1 1 137 137 GLU C C 137 177.482 177.482 178.720 -1.238 18387 10721 1 13 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.678 0.252 18387 10722 1 13 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.217 0.565 18387 10723 1 13 . 1 1 137 137 GLU H H 137 8.114 8.114 8.585 -0.471 18387 10724 1 13 . 1 1 138 138 LYS N N 138 116.431 116.431 119.441 -3.010 18387 10725 1 13 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.971 -0.203 18387 10726 1 13 . 1 1 138 138 LYS C C 138 179.193 179.193 178.866 0.327 18387 10727 1 13 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.401 -0.361 18387 10728 1 13 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.265 -0.107 18387 10729 1 13 . 1 1 138 138 LYS H H 138 7.133 7.133 7.781 -0.648 18387 10730 1 13 . 1 1 139 139 PHE N N 139 116.336 116.336 117.838 -1.502 18387 10731 1 13 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.374 -0.364 18387 10732 1 13 . 1 1 139 139 PHE C C 139 177.855 177.855 178.414 -0.559 18387 10733 1 13 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.730 0.654 18387 10734 1 13 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.487 -0.135 18387 10735 1 13 . 1 1 139 139 PHE H H 139 7.338 7.338 7.720 -0.382 18387 10736 1 13 . 1 1 140 140 VAL N N 140 116.491 116.491 115.856 0.635 18387 10737 1 13 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.584 -0.060 18387 10738 1 13 . 1 1 140 140 VAL C C 140 177.747 177.747 177.014 0.733 18387 10739 1 13 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.136 0.106 18387 10740 1 13 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.469 -0.079 18387 10741 1 13 . 1 1 140 140 VAL H H 140 8.332 8.332 8.481 -0.149 18387 10742 1 13 . 1 1 141 141 ASN N N 141 116.956 116.956 115.440 1.516 18387 10743 1 13 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.633 0.193 18387 10744 1 13 . 1 1 141 141 ASN C C 141 176.997 176.997 175.585 1.412 18387 10745 1 13 . 1 1 141 141 ASN CA C 141 53.677 53.677 52.865 0.812 18387 10746 1 13 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.121 -0.673 18387 10747 1 13 . 1 1 141 141 ASN H H 141 7.862 7.862 7.613 0.249 18387 10748 1 13 . 1 1 142 142 GLY N N 142 107.938 107.938 107.321 0.617 18387 10749 1 13 . 1 1 142 142 GLY C C 142 174.336 174.336 175.013 -0.677 18387 10750 1 13 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.667 0.318 18387 10751 1 13 . 1 1 142 142 GLY H H 142 7.466 7.466 7.446 0.020 18387 10752 1 13 . 1 1 143 143 ALA N N 143 123.441 123.441 120.081 3.360 18387 10753 1 13 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.061 0.280 18387 10754 1 13 . 1 1 143 143 ALA C C 143 178.212 178.212 177.546 0.666 18387 10755 1 13 . 1 1 143 143 ALA CA C 143 52.826 52.826 54.203 -1.377 18387 10756 1 13 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.962 0.282 18387 10757 1 13 . 1 1 143 143 ALA H H 143 7.950 7.950 7.836 0.114 18387 10758 1 13 . 1 1 144 144 LYS N N 144 120.149 120.149 113.438 6.711 18387 10759 1 13 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.438 -0.143 18387 10760 1 13 . 1 1 144 144 LYS C C 144 176.945 176.945 177.402 -0.457 18387 10761 1 13 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.592 -0.072 18387 10762 1 13 . 1 1 144 144 LYS CB C 144 33.030 33.030 34.432 -1.402 18387 10763 1 13 . 1 1 144 144 LYS H H 144 8.187 8.187 7.760 0.427 18387 10764 1 13 . 1 1 145 145 GLU N N 145 120.992 120.992 119.355 1.637 18387 10765 1 13 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.288 0.007 18387 10766 1 13 . 1 1 145 145 GLU C C 145 177.116 177.116 176.049 1.067 18387 10767 1 13 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.129 0.774 18387 10768 1 13 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.997 1.245 18387 10769 1 13 . 1 1 145 145 GLU H H 145 8.363 8.363 7.558 0.805 18387 10770 1 13 . 1 1 146 146 GLY N N 146 109.467 109.467 105.382 4.085 18387 10771 1 13 . 1 1 146 146 GLY C C 146 174.108 174.108 175.356 -1.248 18387 10772 1 13 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.785 0.617 18387 10773 1 13 . 1 1 146 146 GLY H H 146 8.371 8.371 7.476 0.895 18387 10774 1 13 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.462 0.147 18387 10775 1 13 . 1 1 151 151 HIS C C 151 174.258 174.258 173.373 0.885 18387 10776 1 13 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.539 -0.374 18387 10777 1 13 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.230 0.603 18387 10778 1 14 . 1 1 2 2 SER HA H 2 3.992 3.992 4.126 -0.134 18387 10779 1 14 . 1 1 2 2 SER CA C 2 57.555 57.555 60.195 -2.640 18387 10780 1 14 . 1 1 2 2 SER CB C 2 64.977 64.977 62.533 2.444 18387 10781 1 14 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.965 -0.526 18387 10782 1 14 . 1 1 3 3 LEU C C 3 176.631 176.631 175.475 1.156 18387 10783 1 14 . 1 1 3 3 LEU CA C 3 54.564 54.564 53.005 1.559 18387 10784 1 14 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.601 -0.877 18387 10785 1 14 . 1 1 4 4 ALA N N 4 125.483 125.483 120.101 5.382 18387 10786 1 14 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.671 -0.292 18387 10787 1 14 . 1 1 4 4 ALA C C 4 179.642 179.642 176.038 3.604 18387 10788 1 14 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.386 0.349 18387 10789 1 14 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.640 -1.888 18387 10790 1 14 . 1 1 4 4 ALA H H 4 8.483 8.483 8.186 0.297 18387 10791 1 14 . 1 1 5 5 THR HA H 5 3.845 3.845 4.500 -0.655 18387 10792 1 14 . 1 1 5 5 THR C C 5 175.487 175.487 175.620 -0.133 18387 10793 1 14 . 1 1 5 5 THR CA C 5 64.531 64.531 62.939 1.592 18387 10794 1 14 . 1 1 5 5 THR CB C 5 68.108 68.108 68.456 -0.348 18387 10795 1 14 . 1 1 6 6 GLY N N 6 114.298 114.298 115.933 -1.635 18387 10796 1 14 . 1 1 6 6 GLY C C 6 174.324 174.324 174.137 0.187 18387 10797 1 14 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.894 -0.059 18387 10798 1 14 . 1 1 6 6 GLY H H 6 9.511 9.511 8.965 0.546 18387 10799 1 14 . 1 1 7 7 SER N N 7 115.270 115.270 117.136 -1.866 18387 10800 1 14 . 1 1 7 7 SER HA H 7 4.500 4.500 4.541 -0.041 18387 10801 1 14 . 1 1 7 7 SER C C 7 173.315 173.315 174.846 -1.531 18387 10802 1 14 . 1 1 7 7 SER CA C 7 58.915 58.915 57.743 1.172 18387 10803 1 14 . 1 1 7 7 SER CB C 7 64.308 64.308 64.543 -0.235 18387 10804 1 14 . 1 1 7 7 SER H H 7 7.736 7.736 7.695 0.041 18387 10805 1 14 . 1 1 8 8 VAL N N 8 123.708 123.708 123.076 0.632 18387 10806 1 14 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.055 -0.223 18387 10807 1 14 . 1 1 8 8 VAL C C 8 176.673 176.673 176.382 0.291 18387 10808 1 14 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.381 0.292 18387 10809 1 14 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.464 -0.242 18387 10810 1 14 . 1 1 8 8 VAL H H 8 8.632 8.632 8.392 0.240 18387 10811 1 14 . 1 1 9 9 ALA N N 9 133.040 133.040 131.138 1.902 18387 10812 1 14 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.836 -0.573 18387 10813 1 14 . 1 1 9 9 ALA C C 9 175.404 175.404 175.480 -0.076 18387 10814 1 14 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.750 1.205 18387 10815 1 14 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.650 -0.620 18387 10816 1 14 . 1 1 9 9 ALA H H 9 8.448 8.448 8.540 -0.092 18387 10817 1 14 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.296 0.035 18387 10818 1 14 . 1 1 10 10 PRO C C 10 175.071 175.071 176.275 -1.204 18387 10819 1 14 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.831 -0.190 18387 10820 1 14 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.153 0.171 18387 10821 1 14 . 1 1 11 11 ALA N N 11 124.172 124.172 126.334 -2.162 18387 10822 1 14 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.296 -0.052 18387 10823 1 14 . 1 1 11 11 ALA C C 11 177.688 177.688 177.015 0.673 18387 10824 1 14 . 1 1 11 11 ALA CA C 11 53.621 53.621 52.183 1.438 18387 10825 1 14 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.391 -0.064 18387 10826 1 14 . 1 1 11 11 ALA H H 11 8.221 8.221 8.279 -0.058 18387 10827 1 14 . 1 1 12 12 ILE N N 12 117.815 117.815 124.981 -7.166 18387 10828 1 14 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.362 -0.033 18387 10829 1 14 . 1 1 12 12 ILE C C 12 175.013 175.013 175.365 -0.352 18387 10830 1 14 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.408 1.758 18387 10831 1 14 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.470 5.820 18387 10832 1 14 . 1 1 12 12 ILE H H 12 7.693 7.693 8.363 -0.670 18387 10833 1 14 . 1 1 13 13 THR N N 13 121.186 121.186 123.593 -2.407 18387 10834 1 14 . 1 1 13 13 THR HA H 13 4.840 4.840 5.087 -0.247 18387 10835 1 14 . 1 1 13 13 THR C C 13 172.625 172.625 173.553 -0.928 18387 10836 1 14 . 1 1 13 13 THR CA C 13 62.297 62.297 61.511 0.786 18387 10837 1 14 . 1 1 13 13 THR CB C 13 71.585 71.585 70.603 0.982 18387 10838 1 14 . 1 1 13 13 THR H H 13 8.363 8.363 8.861 -0.498 18387 10839 1 14 . 1 1 14 14 GLY N N 14 110.785 110.785 112.369 -1.584 18387 10840 1 14 . 1 1 14 14 GLY C C 14 170.040 170.040 172.075 -2.035 18387 10841 1 14 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.972 1.418 18387 10842 1 14 . 1 1 14 14 GLY H H 14 7.993 7.993 9.249 -1.256 18387 10843 1 14 . 1 1 15 15 ILE N N 15 119.088 119.088 120.677 -1.589 18387 10844 1 14 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.106 0.019 18387 10845 1 14 . 1 1 15 15 ILE C C 15 176.359 176.359 176.150 0.209 18387 10846 1 14 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.326 -1.712 18387 10847 1 14 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.539 0.100 18387 10848 1 14 . 1 1 15 15 ILE H H 15 7.973 7.973 8.643 -0.670 18387 10849 1 14 . 1 1 16 16 ASP N N 16 126.633 126.633 127.644 -1.011 18387 10850 1 14 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.261 0.588 18387 10851 1 14 . 1 1 16 16 ASP C C 16 179.190 179.190 177.513 1.677 18387 10852 1 14 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.068 -0.188 18387 10853 1 14 . 1 1 16 16 ASP CB C 16 42.275 42.275 41.648 0.627 18387 10854 1 14 . 1 1 16 16 ASP H H 16 9.335 9.335 8.984 0.351 18387 10855 1 14 . 1 1 17 17 LEU N N 17 116.648 116.648 118.172 -1.524 18387 10856 1 14 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.859 0.315 18387 10857 1 14 . 1 1 17 17 LEU C C 17 178.432 178.432 179.064 -0.632 18387 10858 1 14 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.665 0.316 18387 10859 1 14 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.590 1.396 18387 10860 1 14 . 1 1 17 17 LEU H H 17 8.071 8.071 8.654 -0.583 18387 10861 1 14 . 1 1 18 18 LYS N N 18 117.401 117.401 118.337 -0.936 18387 10862 1 14 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.219 0.290 18387 10863 1 14 . 1 1 18 18 LYS C C 18 176.793 176.793 177.712 -0.919 18387 10864 1 14 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.910 -2.475 18387 10865 1 14 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.035 0.028 18387 10866 1 14 . 1 1 18 18 LYS H H 18 8.207 8.207 8.045 0.162 18387 10867 1 14 . 1 1 19 19 GLY N N 19 108.061 108.061 106.493 1.568 18387 10868 1 14 . 1 1 19 19 GLY C C 19 174.649 174.649 173.594 1.055 18387 10869 1 14 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.526 1.071 18387 10870 1 14 . 1 1 19 19 GLY H H 19 8.099 8.099 8.803 -0.704 18387 10871 1 14 . 1 1 20 20 ASN N N 20 121.012 121.012 120.232 0.780 18387 10872 1 14 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.982 -0.077 18387 10873 1 14 . 1 1 20 20 ASN C C 20 174.827 174.827 174.670 0.157 18387 10874 1 14 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.483 -0.016 18387 10875 1 14 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.728 -1.052 18387 10876 1 14 . 1 1 20 20 ASN H H 20 8.945 8.945 9.115 -0.170 18387 10877 1 14 . 1 1 21 21 SER N N 21 117.285 117.285 118.191 -0.906 18387 10878 1 14 . 1 1 21 21 SER HA H 21 5.000 5.000 5.121 -0.121 18387 10879 1 14 . 1 1 21 21 SER C C 21 174.911 174.911 174.507 0.404 18387 10880 1 14 . 1 1 21 21 SER CA C 21 58.730 58.730 58.231 0.499 18387 10881 1 14 . 1 1 21 21 SER CB C 21 63.162 63.162 62.837 0.325 18387 10882 1 14 . 1 1 21 21 SER H H 21 8.740 8.740 8.718 0.022 18387 10883 1 14 . 1 1 22 22 VAL N N 22 128.665 128.665 126.868 1.797 18387 10884 1 14 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.432 -0.052 18387 10885 1 14 . 1 1 22 22 VAL C C 22 176.276 176.276 175.034 1.242 18387 10886 1 14 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.112 1.841 18387 10887 1 14 . 1 1 22 22 VAL CB C 22 35.582 35.582 35.227 0.355 18387 10888 1 14 . 1 1 22 22 VAL H H 22 9.125 9.125 9.105 0.020 18387 10889 1 14 . 1 1 23 23 SER N N 23 127.457 127.457 117.877 9.580 18387 10890 1 14 . 1 1 23 23 SER HA H 23 5.878 5.878 5.653 0.225 18387 10891 1 14 . 1 1 23 23 SER C C 23 174.436 174.436 176.262 -1.826 18387 10892 1 14 . 1 1 23 23 SER CA C 23 57.101 57.101 56.767 0.334 18387 10893 1 14 . 1 1 23 23 SER CB C 23 66.078 66.078 65.389 0.689 18387 10894 1 14 . 1 1 23 23 SER H H 23 8.971 8.971 9.286 -0.315 18387 10895 1 14 . 1 1 24 24 LEU N N 24 126.734 126.734 122.063 4.671 18387 10896 1 14 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.470 -0.003 18387 10897 1 14 . 1 1 24 24 LEU C C 24 179.852 179.852 178.129 1.723 18387 10898 1 14 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.333 0.870 18387 10899 1 14 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.047 0.931 18387 10900 1 14 . 1 1 24 24 LEU H H 24 8.450 8.450 8.422 0.028 18387 10901 1 14 . 1 1 25 25 ASN N N 25 115.642 115.642 117.120 -1.478 18387 10902 1 14 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.379 -0.137 18387 10903 1 14 . 1 1 25 25 ASN C C 25 176.246 176.246 176.526 -0.280 18387 10904 1 14 . 1 1 25 25 ASN CA C 25 55.370 55.370 56.208 -0.838 18387 10905 1 14 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.372 0.399 18387 10906 1 14 . 1 1 25 25 ASN H H 25 8.505 8.505 8.656 -0.151 18387 10907 1 14 . 1 1 26 26 ASP N N 26 119.722 119.722 120.044 -0.322 18387 10908 1 14 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.415 -0.210 18387 10909 1 14 . 1 1 26 26 ASP C C 26 176.708 176.708 176.413 0.295 18387 10910 1 14 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.008 0.517 18387 10911 1 14 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.312 -1.032 18387 10912 1 14 . 1 1 26 26 ASP H H 26 7.731 7.731 7.717 0.014 18387 10913 1 14 . 1 1 27 27 PHE N N 27 116.827 116.827 117.296 -0.469 18387 10914 1 14 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.720 -0.240 18387 10915 1 14 . 1 1 27 27 PHE C C 27 174.227 174.227 174.925 -0.698 18387 10916 1 14 . 1 1 27 27 PHE CA C 27 57.071 57.071 56.962 0.109 18387 10917 1 14 . 1 1 27 27 PHE CB C 27 39.719 39.719 40.100 -0.381 18387 10918 1 14 . 1 1 27 27 PHE H H 27 7.390 7.390 7.382 0.008 18387 10919 1 14 . 1 1 28 28 LYS N N 28 120.357 120.357 120.795 -0.438 18387 10920 1 14 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.237 0.150 18387 10921 1 14 . 1 1 28 28 LYS C C 28 177.845 177.845 177.662 0.183 18387 10922 1 14 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.432 0.570 18387 10923 1 14 . 1 1 28 28 LYS CB C 28 32.544 32.544 33.065 -0.521 18387 10924 1 14 . 1 1 28 28 LYS H H 28 6.883 6.883 7.315 -0.432 18387 10925 1 14 . 1 1 29 29 GLY N N 29 112.653 112.653 109.257 3.396 18387 10926 1 14 . 1 1 29 29 GLY C C 29 173.799 173.799 173.721 0.078 18387 10927 1 14 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.278 -0.290 18387 10928 1 14 . 1 1 29 29 GLY H H 29 8.930 8.930 8.619 0.311 18387 10929 1 14 . 1 1 30 30 LYS N N 30 120.516 120.516 121.070 -0.554 18387 10930 1 14 . 1 1 30 30 LYS HA H 30 4.635 4.635 5.086 -0.451 18387 10931 1 14 . 1 1 30 30 LYS C C 30 176.505 176.505 175.284 1.221 18387 10932 1 14 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.244 0.936 18387 10933 1 14 . 1 1 30 30 LYS CB C 30 34.857 34.857 34.860 -0.003 18387 10934 1 14 . 1 1 30 30 LYS H H 30 8.098 8.098 7.315 0.783 18387 10935 1 14 . 1 1 31 31 TYR N N 31 117.383 117.383 121.029 -3.646 18387 10936 1 14 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.595 0.059 18387 10937 1 14 . 1 1 31 31 TYR C C 31 175.551 175.551 175.870 -0.319 18387 10938 1 14 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.587 0.578 18387 10939 1 14 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.782 2.411 18387 10940 1 14 . 1 1 31 31 TYR H H 31 8.263 8.263 8.654 -0.391 18387 10941 1 14 . 1 1 32 32 VAL N N 32 120.900 120.900 122.853 -1.953 18387 10942 1 14 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.757 -0.318 18387 10943 1 14 . 1 1 32 32 VAL C C 32 175.975 175.975 174.772 1.203 18387 10944 1 14 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.081 -0.375 18387 10945 1 14 . 1 1 32 32 VAL CB C 32 35.507 35.507 31.999 3.508 18387 10946 1 14 . 1 1 32 32 VAL H H 32 9.244 9.244 8.934 0.310 18387 10947 1 14 . 1 1 33 33 LEU N N 33 130.058 130.058 130.227 -0.169 18387 10948 1 14 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.804 0.369 18387 10949 1 14 . 1 1 33 33 LEU C C 33 174.693 174.693 175.182 -0.489 18387 10950 1 14 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.086 0.262 18387 10951 1 14 . 1 1 33 33 LEU CB C 33 44.321 44.321 41.722 2.599 18387 10952 1 14 . 1 1 33 33 LEU H H 33 8.161 8.161 8.350 -0.189 18387 10953 1 14 . 1 1 34 34 VAL N N 34 129.232 129.232 128.845 0.387 18387 10954 1 14 . 1 1 34 34 VAL HA H 34 4.982 4.982 5.049 -0.067 18387 10955 1 14 . 1 1 34 34 VAL C C 34 174.285 174.285 174.997 -0.712 18387 10956 1 14 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.088 0.418 18387 10957 1 14 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.203 0.174 18387 10958 1 14 . 1 1 34 34 VAL H H 34 9.296 9.296 8.956 0.340 18387 10959 1 14 . 1 1 35 35 ASP N N 35 123.675 123.675 126.456 -2.781 18387 10960 1 14 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.020 0.329 18387 10961 1 14 . 1 1 35 35 ASP C C 35 174.258 174.258 175.083 -0.825 18387 10962 1 14 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.433 -1.379 18387 10963 1 14 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.651 -2.189 18387 10964 1 14 . 1 1 35 35 ASP H H 35 8.015 8.015 8.256 -0.241 18387 10965 1 14 . 1 1 36 36 PHE N N 36 126.959 126.959 122.465 4.494 18387 10966 1 14 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.801 0.134 18387 10967 1 14 . 1 1 36 36 PHE C C 36 175.432 175.432 175.668 -0.236 18387 10968 1 14 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.026 1.069 18387 10969 1 14 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.529 -0.499 18387 10970 1 14 . 1 1 36 36 PHE H H 36 9.171 9.171 9.475 -0.304 18387 10971 1 14 . 1 1 37 37 TRP N N 37 120.839 120.839 121.856 -1.017 18387 10972 1 14 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.410 0.347 18387 10973 1 14 . 1 1 37 37 TRP C C 37 172.412 172.412 173.506 -1.094 18387 10974 1 14 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.245 0.664 18387 10975 1 14 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.988 -0.308 18387 10976 1 14 . 1 1 37 37 TRP H H 37 9.280 9.280 8.835 0.445 18387 10977 1 14 . 1 1 38 38 PHE N N 38 109.215 109.215 112.097 -2.882 18387 10978 1 14 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.541 -0.608 18387 10979 1 14 . 1 1 38 38 PHE C C 38 176.141 176.141 174.773 1.368 18387 10980 1 14 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.623 0.388 18387 10981 1 14 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.647 -1.028 18387 10982 1 14 . 1 1 38 38 PHE H H 38 7.062 7.062 8.032 -0.970 18387 10983 1 14 . 1 1 39 39 ALA N N 39 125.193 125.193 124.839 0.354 18387 10984 1 14 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.321 -0.256 18387 10985 1 14 . 1 1 39 39 ALA C C 39 179.349 179.349 178.272 1.077 18387 10986 1 14 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.476 1.588 18387 10987 1 14 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.927 0.970 18387 10988 1 14 . 1 1 39 39 ALA H H 39 10.355 10.355 9.590 0.765 18387 10989 1 14 . 1 1 40 40 GLY N N 40 103.437 103.437 106.480 -3.043 18387 10990 1 14 . 1 1 40 40 GLY C C 40 172.732 172.732 174.479 -1.747 18387 10991 1 14 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.818 -0.882 18387 10992 1 14 . 1 1 40 40 GLY H H 40 8.583 8.583 8.139 0.444 18387 10993 1 14 . 1 1 41 41 CYS N N 41 124.859 124.859 121.081 3.778 18387 10994 1 14 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.376 0.028 18387 10995 1 14 . 1 1 41 41 CYS C C 41 176.620 176.620 174.954 1.666 18387 10996 1 14 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.768 0.607 18387 10997 1 14 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.935 0.441 18387 10998 1 14 . 1 1 41 41 CYS H H 41 6.946 6.946 6.836 0.110 18387 10999 1 14 . 1 1 42 42 SER HA H 42 4.040 4.040 4.126 -0.086 18387 11000 1 14 . 1 1 42 42 SER CA C 42 61.552 61.552 60.840 0.712 18387 11001 1 14 . 1 1 42 42 SER CB C 42 62.675 62.675 62.645 0.030 18387 11002 1 14 . 1 1 43 43 TRP N N 43 129.748 129.748 120.940 8.808 18387 11003 1 14 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.736 -0.187 18387 11004 1 14 . 1 1 43 43 TRP C C 43 180.400 180.400 177.944 2.456 18387 11005 1 14 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.794 1.455 18387 11006 1 14 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.309 0.283 18387 11007 1 14 . 1 1 44 44 CYS N N 44 124.462 124.462 118.296 6.166 18387 11008 1 14 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.288 -0.037 18387 11009 1 14 . 1 1 44 44 CYS C C 44 178.643 178.643 177.064 1.579 18387 11010 1 14 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.667 2.182 18387 11011 1 14 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.695 2.728 18387 11012 1 14 . 1 1 44 44 CYS H H 44 9.591 9.591 7.810 1.781 18387 11013 1 14 . 1 1 45 45 ARG N N 45 117.248 117.248 116.660 0.588 18387 11014 1 14 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.190 -0.014 18387 11015 1 14 . 1 1 45 45 ARG C C 45 180.302 180.302 176.933 3.369 18387 11016 1 14 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.044 -0.101 18387 11017 1 14 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.416 -1.785 18387 11018 1 14 . 1 1 45 45 ARG H H 45 7.955 7.955 7.635 0.320 18387 11019 1 14 . 1 1 46 46 LYS N N 46 120.318 120.318 118.414 1.904 18387 11020 1 14 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.342 -0.070 18387 11021 1 14 . 1 1 46 46 LYS C C 46 177.755 177.755 178.644 -0.889 18387 11022 1 14 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.987 0.782 18387 11023 1 14 . 1 1 46 46 LYS CB C 46 33.157 33.157 33.073 0.084 18387 11024 1 14 . 1 1 46 46 LYS H H 46 8.129 8.129 8.056 0.073 18387 11025 1 14 . 1 1 47 47 GLU N N 47 114.278 114.278 119.469 -5.191 18387 11026 1 14 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.541 0.350 18387 11027 1 14 . 1 1 47 47 GLU C C 47 178.701 178.701 179.070 -0.369 18387 11028 1 14 . 1 1 47 47 GLU CA C 47 56.554 56.554 59.097 -2.543 18387 11029 1 14 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.198 0.568 18387 11030 1 14 . 1 1 47 47 GLU H H 47 7.386 7.386 8.196 -0.810 18387 11031 1 14 . 1 1 48 48 THR N N 48 115.665 115.665 116.738 -1.073 18387 11032 1 14 . 1 1 48 48 THR HA H 48 4.048 4.048 4.197 -0.149 18387 11033 1 14 . 1 1 48 48 THR C C 48 172.392 172.392 174.127 -1.735 18387 11034 1 14 . 1 1 48 48 THR CA C 48 69.426 69.426 68.721 0.705 18387 11035 1 14 . 1 1 48 48 THR CB C 48 66.906 66.906 66.657 0.249 18387 11036 1 14 . 1 1 48 48 THR H H 48 7.810 7.810 7.720 0.090 18387 11037 1 14 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.199 0.090 18387 11038 1 14 . 1 1 49 49 PRO C C 49 179.828 179.828 178.489 1.339 18387 11039 1 14 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.352 0.247 18387 11040 1 14 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.202 -0.168 18387 11041 1 14 . 1 1 50 50 TYR N N 50 116.950 116.950 116.401 0.549 18387 11042 1 14 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.252 -0.114 18387 11043 1 14 . 1 1 50 50 TYR C C 50 179.488 179.488 178.842 0.646 18387 11044 1 14 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.894 -0.759 18387 11045 1 14 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.827 0.474 18387 11046 1 14 . 1 1 50 50 TYR H H 50 7.071 7.071 7.389 -0.318 18387 11047 1 14 . 1 1 51 51 LEU N N 51 123.989 123.989 120.428 3.561 18387 11048 1 14 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.942 -0.272 18387 11049 1 14 . 1 1 51 51 LEU C C 51 178.072 178.072 178.797 -0.725 18387 11050 1 14 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.904 0.772 18387 11051 1 14 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.480 1.137 18387 11052 1 14 . 1 1 51 51 LEU H H 51 8.243 8.243 8.596 -0.353 18387 11053 1 14 . 1 1 52 52 LEU N N 52 119.857 119.857 120.226 -0.369 18387 11054 1 14 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.137 0.190 18387 11055 1 14 . 1 1 52 52 LEU C C 52 178.704 178.704 178.544 0.160 18387 11056 1 14 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.640 -0.065 18387 11057 1 14 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.890 0.848 18387 11058 1 14 . 1 1 52 52 LEU H H 52 9.085 9.085 8.706 0.379 18387 11059 1 14 . 1 1 53 53 LYS N N 53 118.658 118.658 118.902 -0.244 18387 11060 1 14 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.982 0.127 18387 11061 1 14 . 1 1 53 53 LYS C C 53 179.786 179.786 178.933 0.853 18387 11062 1 14 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.981 -0.260 18387 11063 1 14 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.325 0.834 18387 11064 1 14 . 1 1 53 53 LYS H H 53 7.807 7.807 8.014 -0.207 18387 11065 1 14 . 1 1 54 54 THR N N 54 116.869 116.869 116.907 -0.038 18387 11066 1 14 . 1 1 54 54 THR HA H 54 3.965 3.965 4.372 -0.407 18387 11067 1 14 . 1 1 54 54 THR C C 54 175.328 175.328 176.629 -1.301 18387 11068 1 14 . 1 1 54 54 THR CA C 54 67.683 67.683 67.367 0.316 18387 11069 1 14 . 1 1 54 54 THR CB C 54 68.452 68.452 68.840 -0.388 18387 11070 1 14 . 1 1 54 54 THR H H 54 7.771 7.771 8.288 -0.517 18387 11071 1 14 . 1 1 55 55 TYR N N 55 122.202 122.202 122.364 -0.162 18387 11072 1 14 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.222 0.050 18387 11073 1 14 . 1 1 55 55 TYR C C 55 176.809 176.809 176.905 -0.096 18387 11074 1 14 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.690 1.047 18387 11075 1 14 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.496 0.784 18387 11076 1 14 . 1 1 55 55 TYR H H 55 9.145 9.145 8.494 0.651 18387 11077 1 14 . 1 1 56 56 ASN N N 56 113.858 113.858 117.133 -3.275 18387 11078 1 14 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.295 -0.032 18387 11079 1 14 . 1 1 56 56 ASN C C 56 177.427 177.427 177.259 0.168 18387 11080 1 14 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.964 -0.034 18387 11081 1 14 . 1 1 56 56 ASN CB C 56 37.954 37.954 37.944 0.010 18387 11082 1 14 . 1 1 56 56 ASN H H 56 8.850 8.850 8.328 0.522 18387 11083 1 14 . 1 1 57 57 ALA N N 57 118.829 118.829 121.311 -2.482 18387 11084 1 14 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.150 -0.086 18387 11085 1 14 . 1 1 57 57 ALA C C 57 180.445 180.445 178.253 2.192 18387 11086 1 14 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.828 0.523 18387 11087 1 14 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.681 0.513 18387 11088 1 14 . 1 1 57 57 ALA H H 57 7.436 7.436 7.596 -0.160 18387 11089 1 14 . 1 1 58 58 PHE N N 58 112.082 112.082 115.696 -3.614 18387 11090 1 14 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.578 0.343 18387 11091 1 14 . 1 1 58 58 PHE C C 58 176.999 176.999 177.505 -0.506 18387 11092 1 14 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.648 0.419 18387 11093 1 14 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.453 1.037 18387 11094 1 14 . 1 1 58 58 PHE H H 58 7.480 7.480 7.645 -0.165 18387 11095 1 14 . 1 1 59 59 LYS N N 59 120.666 120.666 121.233 -0.567 18387 11096 1 14 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.394 0.409 18387 11097 1 14 . 1 1 59 59 LYS C C 59 177.157 177.157 177.290 -0.133 18387 11098 1 14 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.028 0.053 18387 11099 1 14 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.609 -1.041 18387 11100 1 14 . 1 1 59 59 LYS H H 59 8.411 8.411 7.527 0.884 18387 11101 1 14 . 1 1 60 60 ASP N N 60 118.908 118.908 118.193 0.715 18387 11102 1 14 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.137 0.988 18387 11103 1 14 . 1 1 60 60 ASP C C 60 176.889 176.889 176.031 0.858 18387 11104 1 14 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.504 -0.855 18387 11105 1 14 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.857 -0.145 18387 11106 1 14 . 1 1 60 60 ASP H H 60 8.574 8.574 8.390 0.184 18387 11107 1 14 . 1 1 61 61 LYS N N 61 121.021 121.021 118.524 2.497 18387 11108 1 14 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.452 0.262 18387 11109 1 14 . 1 1 61 61 LYS C C 61 175.968 175.968 176.106 -0.138 18387 11110 1 14 . 1 1 61 61 LYS CA C 61 55.137 55.137 56.016 -0.879 18387 11111 1 14 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.137 -0.059 18387 11112 1 14 . 1 1 61 61 LYS H H 61 8.278 8.278 7.863 0.415 18387 11113 1 14 . 1 1 62 62 GLY C C 62 173.837 173.837 172.797 1.040 18387 11114 1 14 . 1 1 62 62 GLY CA C 62 47.050 47.050 44.727 2.322 18387 11115 1 14 . 1 1 63 63 PHE N N 63 120.476 120.476 119.944 0.532 18387 11116 1 14 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.355 0.678 18387 11117 1 14 . 1 1 63 63 PHE C C 63 173.613 173.613 172.971 0.642 18387 11118 1 14 . 1 1 63 63 PHE CA C 63 55.850 55.850 57.065 -1.215 18387 11119 1 14 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.498 0.177 18387 11120 1 14 . 1 1 63 63 PHE H H 63 7.413 7.413 7.577 -0.164 18387 11121 1 14 . 1 1 64 64 THR N N 64 119.903 119.903 120.296 -0.393 18387 11122 1 14 . 1 1 64 64 THR HA H 64 4.097 4.097 4.900 -0.803 18387 11123 1 14 . 1 1 64 64 THR C C 64 170.397 170.397 172.421 -2.024 18387 11124 1 14 . 1 1 64 64 THR CA C 64 60.261 60.261 59.442 0.819 18387 11125 1 14 . 1 1 64 64 THR CB C 64 69.507 69.507 71.505 -1.998 18387 11126 1 14 . 1 1 64 64 THR H H 64 7.665 7.665 8.128 -0.463 18387 11127 1 14 . 1 1 65 65 ILE N N 65 117.277 117.277 124.893 -7.616 18387 11128 1 14 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.218 0.258 18387 11129 1 14 . 1 1 65 65 ILE C C 65 173.056 173.056 173.817 -0.761 18387 11130 1 14 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.636 -0.928 18387 11131 1 14 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.648 1.197 18387 11132 1 14 . 1 1 65 65 ILE H H 65 7.321 7.321 8.913 -1.592 18387 11133 1 14 . 1 1 66 66 TYR N N 66 131.968 131.968 129.831 2.137 18387 11134 1 14 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.245 0.002 18387 11135 1 14 . 1 1 66 66 TYR C C 66 174.074 174.074 174.805 -0.731 18387 11136 1 14 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.523 -0.558 18387 11137 1 14 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.621 1.496 18387 11138 1 14 . 1 1 66 66 TYR H H 66 9.038 9.038 9.031 0.007 18387 11139 1 14 . 1 1 67 67 GLY N N 67 114.364 114.364 115.176 -0.812 18387 11140 1 14 . 1 1 67 67 GLY C C 67 172.461 172.461 172.362 0.099 18387 11141 1 14 . 1 1 67 67 GLY CA C 67 45.000 45.000 43.775 1.225 18387 11142 1 14 . 1 1 67 67 GLY H H 67 9.188 9.188 8.558 0.630 18387 11143 1 14 . 1 1 68 68 VAL N N 68 126.938 126.938 118.699 8.239 18387 11144 1 14 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.272 -1.136 18387 11145 1 14 . 1 1 68 68 VAL C C 68 173.822 173.822 174.569 -0.747 18387 11146 1 14 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.193 2.305 18387 11147 1 14 . 1 1 68 68 VAL CB C 68 33.558 33.558 33.177 0.381 18387 11148 1 14 . 1 1 68 68 VAL H H 68 9.309 9.309 9.012 0.297 18387 11149 1 14 . 1 1 69 69 SER N N 69 118.813 118.813 120.798 -1.985 18387 11150 1 14 . 1 1 69 69 SER HA H 69 5.527 5.527 4.663 0.864 18387 11151 1 14 . 1 1 69 69 SER C C 69 175.753 175.753 173.863 1.890 18387 11152 1 14 . 1 1 69 69 SER CA C 69 54.407 54.407 56.329 -1.922 18387 11153 1 14 . 1 1 69 69 SER CB C 69 63.630 63.630 64.117 -0.487 18387 11154 1 14 . 1 1 69 69 SER H H 69 8.124 8.124 8.164 -0.040 18387 11155 1 14 . 1 1 70 70 THR N N 70 113.861 113.861 120.642 -6.781 18387 11156 1 14 . 1 1 70 70 THR HA H 70 4.381 4.381 4.409 -0.028 18387 11157 1 14 . 1 1 70 70 THR C C 70 175.001 175.001 173.380 1.621 18387 11158 1 14 . 1 1 70 70 THR CA C 70 60.259 60.259 59.874 0.385 18387 11159 1 14 . 1 1 70 70 THR CB C 70 67.291 67.291 68.597 -1.306 18387 11160 1 14 . 1 1 70 70 THR H H 70 7.656 7.656 8.421 -0.765 18387 11161 1 14 . 1 1 71 71 ASP N N 71 125.133 125.133 122.606 2.527 18387 11162 1 14 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.608 -0.538 18387 11163 1 14 . 1 1 71 71 ASP C C 71 175.685 175.685 176.002 -0.317 18387 11164 1 14 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.444 3.168 18387 11165 1 14 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.016 0.353 18387 11166 1 14 . 1 1 71 71 ASP H H 71 8.931 8.931 7.324 1.607 18387 11167 1 14 . 1 1 72 72 ARG N N 72 118.814 118.814 118.188 0.626 18387 11168 1 14 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.250 -0.055 18387 11169 1 14 . 1 1 72 72 ARG C C 72 177.300 177.300 176.328 0.972 18387 11170 1 14 . 1 1 72 72 ARG CA C 72 56.809 56.809 55.826 0.983 18387 11171 1 14 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.842 0.269 18387 11172 1 14 . 1 1 72 72 ARG H H 72 8.057 8.057 8.338 -0.281 18387 11173 1 14 . 1 1 73 73 ARG N N 73 118.174 118.174 119.469 -1.295 18387 11174 1 14 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.585 0.169 18387 11175 1 14 . 1 1 73 73 ARG C C 73 176.503 176.503 176.171 0.332 18387 11176 1 14 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.182 -0.646 18387 11177 1 14 . 1 1 73 73 ARG CB C 73 31.028 31.028 30.675 0.353 18387 11178 1 14 . 1 1 73 73 ARG H H 73 8.639 8.639 7.786 0.853 18387 11179 1 14 . 1 1 74 74 GLU N N 74 127.609 127.609 126.996 0.613 18387 11180 1 14 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.137 -0.058 18387 11181 1 14 . 1 1 74 74 GLU C C 74 178.107 178.107 177.801 0.306 18387 11182 1 14 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.105 -0.320 18387 11183 1 14 . 1 1 74 74 GLU CB C 74 30.098 30.098 30.011 0.087 18387 11184 1 14 . 1 1 74 74 GLU H H 74 9.129 9.129 9.151 -0.022 18387 11185 1 14 . 1 1 75 75 GLU N N 75 117.874 117.874 118.971 -1.097 18387 11186 1 14 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.146 -0.046 18387 11187 1 14 . 1 1 75 75 GLU C C 75 178.993 178.993 178.601 0.392 18387 11188 1 14 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.374 0.753 18387 11189 1 14 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.558 0.734 18387 11190 1 14 . 1 1 75 75 GLU H H 75 9.745 9.745 8.756 0.989 18387 11191 1 14 . 1 1 76 76 ASP N N 76 119.182 119.182 120.135 -0.953 18387 11192 1 14 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.513 -0.147 18387 11193 1 14 . 1 1 76 76 ASP C C 76 178.107 178.107 178.143 -0.036 18387 11194 1 14 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.812 0.161 18387 11195 1 14 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.468 0.052 18387 11196 1 14 . 1 1 76 76 ASP H H 76 7.004 7.004 8.490 -1.486 18387 11197 1 14 . 1 1 77 77 TRP N N 77 123.008 123.008 123.577 -0.569 18387 11198 1 14 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.284 -0.135 18387 11199 1 14 . 1 1 77 77 TRP C C 77 176.236 176.236 177.987 -1.751 18387 11200 1 14 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.096 -0.613 18387 11201 1 14 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.094 -0.559 18387 11202 1 14 . 1 1 77 77 TRP H H 77 7.112 7.112 7.935 -0.823 18387 11203 1 14 . 1 1 78 78 LYS N N 78 115.727 115.727 118.319 -2.592 18387 11204 1 14 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.404 -0.159 18387 11205 1 14 . 1 1 78 78 LYS C C 78 179.426 179.426 178.775 0.651 18387 11206 1 14 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.400 1.032 18387 11207 1 14 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.820 0.925 18387 11208 1 14 . 1 1 78 78 LYS H H 78 8.431 8.431 8.414 0.017 18387 11209 1 14 . 1 1 79 79 LYS N N 79 118.321 118.321 119.620 -1.299 18387 11210 1 14 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.932 0.088 18387 11211 1 14 . 1 1 79 79 LYS C C 79 178.239 178.239 178.546 -0.307 18387 11212 1 14 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.415 -0.348 18387 11213 1 14 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.502 -0.039 18387 11214 1 14 . 1 1 79 79 LYS H H 79 7.690 7.690 7.884 -0.194 18387 11215 1 14 . 1 1 80 80 ALA N N 80 120.679 120.679 123.019 -2.340 18387 11216 1 14 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.431 -0.276 18387 11217 1 14 . 1 1 80 80 ALA C C 80 178.811 178.811 180.023 -1.212 18387 11218 1 14 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.966 0.121 18387 11219 1 14 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.600 0.158 18387 11220 1 14 . 1 1 80 80 ALA H H 80 7.560 7.560 8.490 -0.930 18387 11221 1 14 . 1 1 81 81 ILE N N 81 118.019 118.019 118.500 -0.481 18387 11222 1 14 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.715 -0.313 18387 11223 1 14 . 1 1 81 81 ILE C C 81 178.113 178.113 178.307 -0.194 18387 11224 1 14 . 1 1 81 81 ILE CA C 81 64.520 64.520 62.874 1.646 18387 11225 1 14 . 1 1 81 81 ILE CB C 81 38.204 38.204 36.402 1.802 18387 11226 1 14 . 1 1 81 81 ILE H H 81 7.514 7.514 8.124 -0.610 18387 11227 1 14 . 1 1 82 82 GLU N N 82 117.252 117.252 120.338 -3.086 18387 11228 1 14 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.887 0.207 18387 11229 1 14 . 1 1 82 82 GLU C C 82 179.558 179.558 178.262 1.296 18387 11230 1 14 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.513 0.067 18387 11231 1 14 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.028 0.355 18387 11232 1 14 . 1 1 82 82 GLU H H 82 7.401 7.401 7.625 -0.224 18387 11233 1 14 . 1 1 83 83 GLU N N 83 119.340 119.340 119.082 0.258 18387 11234 1 14 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.987 -0.089 18387 11235 1 14 . 1 1 83 83 GLU C C 83 178.740 178.740 179.379 -0.639 18387 11236 1 14 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.104 -0.105 18387 11237 1 14 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.676 0.244 18387 11238 1 14 . 1 1 83 83 GLU H H 83 8.191 8.191 8.137 0.054 18387 11239 1 14 . 1 1 84 84 ASP N N 84 118.449 118.449 116.782 1.667 18387 11240 1 14 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.444 -0.170 18387 11241 1 14 . 1 1 84 84 ASP C C 84 175.597 175.597 176.120 -0.523 18387 11242 1 14 . 1 1 84 84 ASP CA C 84 55.047 55.047 55.232 -0.185 18387 11243 1 14 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.977 -1.081 18387 11244 1 14 . 1 1 84 84 ASP H H 84 8.252 8.252 8.288 -0.036 18387 11245 1 14 . 1 1 85 85 LYS N N 85 116.410 116.410 115.330 1.080 18387 11246 1 14 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.428 -0.255 18387 11247 1 14 . 1 1 85 85 LYS C C 85 176.856 176.856 175.326 1.530 18387 11248 1 14 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.621 -0.648 18387 11249 1 14 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.223 -0.355 18387 11250 1 14 . 1 1 85 85 LYS H H 85 7.890 7.890 7.478 0.412 18387 11251 1 14 . 1 1 86 86 SER N N 86 112.295 112.295 113.947 -1.652 18387 11252 1 14 . 1 1 86 86 SER HA H 86 3.139 3.139 4.039 -0.900 18387 11253 1 14 . 1 1 86 86 SER C C 86 175.805 175.805 172.977 2.828 18387 11254 1 14 . 1 1 86 86 SER CA C 86 53.637 53.637 56.997 -3.360 18387 11255 1 14 . 1 1 86 86 SER CB C 86 60.736 60.736 61.359 -0.623 18387 11256 1 14 . 1 1 86 86 SER H H 86 7.327 7.327 7.264 0.063 18387 11257 1 14 . 1 1 87 87 TYR N N 87 120.962 120.962 125.816 -4.854 18387 11258 1 14 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.281 0.024 18387 11259 1 14 . 1 1 87 87 TYR C C 87 177.064 177.064 174.494 2.570 18387 11260 1 14 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.773 -0.550 18387 11261 1 14 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.011 -0.658 18387 11262 1 14 . 1 1 87 87 TYR H H 87 6.933 6.933 7.693 -0.760 18387 11263 1 14 . 1 1 88 88 TRP N N 88 118.597 118.597 122.817 -4.220 18387 11264 1 14 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.746 0.105 18387 11265 1 14 . 1 1 88 88 TRP C C 88 175.456 175.456 174.752 0.704 18387 11266 1 14 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.730 1.506 18387 11267 1 14 . 1 1 88 88 TRP CB C 88 25.727 25.727 30.101 -4.374 18387 11268 1 14 . 1 1 88 88 TRP H H 88 6.552 6.552 7.236 -0.684 18387 11269 1 14 . 1 1 89 89 ASN N N 89 118.067 118.067 120.009 -1.942 18387 11270 1 14 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.545 0.504 18387 11271 1 14 . 1 1 89 89 ASN C C 89 173.773 173.773 174.607 -0.834 18387 11272 1 14 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.103 2.353 18387 11273 1 14 . 1 1 89 89 ASN CB C 89 39.197 39.197 36.956 2.241 18387 11274 1 14 . 1 1 89 89 ASN H H 89 7.864 7.864 8.658 -0.794 18387 11275 1 14 . 1 1 90 90 GLN N N 90 125.392 125.392 121.720 3.672 18387 11276 1 14 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.467 0.030 18387 11277 1 14 . 1 1 90 90 GLN C C 90 176.491 176.491 175.421 1.070 18387 11278 1 14 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.774 0.686 18387 11279 1 14 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.662 -1.435 18387 11280 1 14 . 1 1 90 90 GLN H H 90 7.904 7.904 8.133 -0.229 18387 11281 1 14 . 1 1 91 91 VAL N N 91 114.434 114.434 115.752 -1.318 18387 11282 1 14 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.834 0.646 18387 11283 1 14 . 1 1 91 91 VAL C C 91 174.248 174.248 173.105 1.143 18387 11284 1 14 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.529 -0.523 18387 11285 1 14 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.249 1.389 18387 11286 1 14 . 1 1 91 91 VAL H H 91 9.585 9.585 9.040 0.545 18387 11287 1 14 . 1 1 92 92 LEU N N 92 126.910 126.910 124.884 2.026 18387 11288 1 14 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.125 -0.056 18387 11289 1 14 . 1 1 92 92 LEU C C 92 177.696 177.696 175.799 1.897 18387 11290 1 14 . 1 1 92 92 LEU CA C 92 52.844 52.844 53.022 -0.178 18387 11291 1 14 . 1 1 92 92 LEU CB C 92 42.947 42.947 41.942 1.005 18387 11292 1 14 . 1 1 92 92 LEU H H 92 8.941 8.941 8.590 0.351 18387 11293 1 14 . 1 1 93 93 LEU N N 93 125.673 125.673 127.857 -2.184 18387 11294 1 14 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.225 0.175 18387 11295 1 14 . 1 1 93 93 LEU C C 93 177.291 177.291 176.745 0.546 18387 11296 1 14 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.310 -0.359 18387 11297 1 14 . 1 1 93 93 LEU CB C 93 43.179 43.179 42.538 0.642 18387 11298 1 14 . 1 1 93 93 LEU H H 93 8.038 8.038 8.003 0.035 18387 11299 1 14 . 1 1 94 94 GLN N N 94 122.206 122.206 122.600 -0.394 18387 11300 1 14 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.160 0.077 18387 11301 1 14 . 1 1 94 94 GLN C C 94 178.246 178.246 176.336 1.910 18387 11302 1 14 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.517 -0.742 18387 11303 1 14 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.379 -0.124 18387 11304 1 14 . 1 1 94 94 GLN H H 94 9.298 9.298 8.862 0.436 18387 11305 1 14 . 1 1 95 95 LYS N N 95 122.668 122.668 124.077 -1.409 18387 11306 1 14 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.060 -0.094 18387 11307 1 14 . 1 1 95 95 LYS C C 95 178.787 178.787 178.299 0.488 18387 11308 1 14 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.578 1.494 18387 11309 1 14 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.008 0.458 18387 11310 1 14 . 1 1 95 95 LYS H H 95 8.645 8.645 8.838 -0.193 18387 11311 1 14 . 1 1 96 96 ASP N N 96 116.775 116.775 116.954 -0.179 18387 11312 1 14 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.600 -0.020 18387 11313 1 14 . 1 1 96 96 ASP C C 96 176.220 176.220 176.860 -0.640 18387 11314 1 14 . 1 1 96 96 ASP CA C 96 56.346 56.346 55.914 0.432 18387 11315 1 14 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.560 -0.003 18387 11316 1 14 . 1 1 96 96 ASP H H 96 8.606 8.606 8.448 0.158 18387 11317 1 14 . 1 1 97 97 ASP N N 97 118.213 118.213 120.479 -2.266 18387 11318 1 14 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.523 0.404 18387 11319 1 14 . 1 1 97 97 ASP C C 97 176.954 176.954 178.178 -1.224 18387 11320 1 14 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.408 -1.049 18387 11321 1 14 . 1 1 97 97 ASP CB C 97 42.324 42.324 41.699 0.625 18387 11322 1 14 . 1 1 97 97 ASP H H 97 7.988 7.988 7.464 0.524 18387 11323 1 14 . 1 1 98 98 VAL N N 98 118.907 118.907 121.048 -2.141 18387 11324 1 14 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.623 -0.207 18387 11325 1 14 . 1 1 98 98 VAL C C 98 176.470 176.470 177.497 -1.027 18387 11326 1 14 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.335 1.443 18387 11327 1 14 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.642 0.749 18387 11328 1 14 . 1 1 98 98 VAL H H 98 7.098 7.098 8.463 -1.365 18387 11329 1 14 . 1 1 99 99 LYS N N 99 117.909 117.909 118.979 -1.070 18387 11330 1 14 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.860 0.083 18387 11331 1 14 . 1 1 99 99 LYS C C 99 178.762 178.762 178.534 0.228 18387 11332 1 14 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.292 -0.147 18387 11333 1 14 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.744 0.268 18387 11334 1 14 . 1 1 99 99 LYS H H 99 8.304 8.304 7.682 0.622 18387 11335 1 14 . 1 1 100 100 ASP N N 100 117.843 117.843 119.069 -1.226 18387 11336 1 14 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.425 0.053 18387 11337 1 14 . 1 1 100 100 ASP C C 100 179.694 179.694 178.480 1.214 18387 11338 1 14 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.117 0.409 18387 11339 1 14 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.922 -0.094 18387 11340 1 14 . 1 1 100 100 ASP H H 100 8.024 8.024 7.622 0.402 18387 11341 1 14 . 1 1 101 101 VAL N N 101 122.202 122.202 120.968 1.234 18387 11342 1 14 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.516 0.479 18387 11343 1 14 . 1 1 101 101 VAL C C 101 178.533 178.533 178.255 0.278 18387 11344 1 14 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.313 0.689 18387 11345 1 14 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.687 0.350 18387 11346 1 14 . 1 1 101 101 VAL H H 101 8.205 8.205 7.573 0.632 18387 11347 1 14 . 1 1 102 102 LEU N N 102 118.798 118.798 119.528 -0.730 18387 11348 1 14 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.729 0.051 18387 11349 1 14 . 1 1 102 102 LEU C C 102 180.254 180.254 179.119 1.135 18387 11350 1 14 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.998 0.943 18387 11351 1 14 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.289 -0.850 18387 11352 1 14 . 1 1 102 102 LEU H H 102 8.422 8.422 8.512 -0.090 18387 11353 1 14 . 1 1 103 103 GLU N N 103 116.915 116.915 119.722 -2.807 18387 11354 1 14 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.053 0.082 18387 11355 1 14 . 1 1 103 103 GLU C C 103 180.910 180.910 179.470 1.440 18387 11356 1 14 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.824 0.579 18387 11357 1 14 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.171 0.561 18387 11358 1 14 . 1 1 103 103 GLU H H 103 8.262 8.262 7.828 0.434 18387 11359 1 14 . 1 1 104 104 SER N N 104 117.866 117.866 116.288 1.578 18387 11360 1 14 . 1 1 104 104 SER HA H 104 4.216 4.216 4.109 0.107 18387 11361 1 14 . 1 1 104 104 SER C C 104 175.455 175.455 176.306 -0.851 18387 11362 1 14 . 1 1 104 104 SER CA C 104 62.019 62.019 61.469 0.550 18387 11363 1 14 . 1 1 104 104 SER CB C 104 62.891 62.891 63.005 -0.114 18387 11364 1 14 . 1 1 104 104 SER H H 104 8.544 8.544 8.323 0.221 18387 11365 1 14 . 1 1 105 105 TYR N N 105 117.278 117.278 118.370 -1.092 18387 11366 1 14 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.521 -0.249 18387 11367 1 14 . 1 1 105 105 TYR C C 105 174.750 174.750 175.429 -0.679 18387 11368 1 14 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.877 0.982 18387 11369 1 14 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.802 1.909 18387 11370 1 14 . 1 1 105 105 TYR H H 105 7.691 7.691 7.502 0.189 18387 11371 1 14 . 1 1 106 106 CYS N N 106 116.897 116.897 118.167 -1.270 18387 11372 1 14 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.098 -0.203 18387 11373 1 14 . 1 1 106 106 CYS C C 106 174.056 174.056 173.071 0.985 18387 11374 1 14 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.116 -0.506 18387 11375 1 14 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.644 -0.612 18387 11376 1 14 . 1 1 106 106 CYS H H 106 7.862 7.862 8.328 -0.466 18387 11377 1 14 . 1 1 107 107 ILE N N 107 118.885 118.885 121.682 -2.797 18387 11378 1 14 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.166 -0.827 18387 11379 1 14 . 1 1 107 107 ILE C C 107 176.793 176.793 175.156 1.637 18387 11380 1 14 . 1 1 107 107 ILE CA C 107 62.745 62.745 58.819 3.926 18387 11381 1 14 . 1 1 107 107 ILE CB C 107 38.079 38.079 38.443 -0.364 18387 11382 1 14 . 1 1 107 107 ILE H H 107 7.707 7.707 7.605 0.102 18387 11383 1 14 . 1 1 108 108 VAL N N 108 123.983 123.983 121.969 2.014 18387 11384 1 14 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.407 -0.133 18387 11385 1 14 . 1 1 108 108 VAL C C 108 175.476 175.476 175.606 -0.130 18387 11386 1 14 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.580 0.044 18387 11387 1 14 . 1 1 108 108 VAL CB C 108 33.008 33.008 31.980 1.028 18387 11388 1 14 . 1 1 108 108 VAL H H 108 8.656 8.656 8.400 0.256 18387 11389 1 14 . 1 1 109 109 GLY N N 109 110.120 110.120 108.415 1.705 18387 11390 1 14 . 1 1 109 109 GLY C C 109 169.982 169.982 172.292 -2.310 18387 11391 1 14 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.554 -0.951 18387 11392 1 14 . 1 1 109 109 GLY H H 109 7.500 7.500 7.501 -0.001 18387 11393 1 14 . 1 1 110 110 PHE N N 110 115.276 115.276 119.939 -4.663 18387 11394 1 14 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.021 -0.247 18387 11395 1 14 . 1 1 110 110 PHE C C 110 174.361 174.361 174.563 -0.202 18387 11396 1 14 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.278 0.409 18387 11397 1 14 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.877 1.074 18387 11398 1 14 . 1 1 110 110 PHE H H 110 8.203 8.203 8.190 0.013 18387 11399 1 14 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.030 0.329 18387 11400 1 14 . 1 1 111 111 PRO C C 111 175.691 175.691 175.215 0.476 18387 11401 1 14 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.234 -0.077 18387 11402 1 14 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.651 1.653 18387 11403 1 14 . 1 1 112 112 HIS N N 112 123.708 123.708 117.758 5.950 18387 11404 1 14 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.905 0.058 18387 11405 1 14 . 1 1 112 112 HIS C C 112 173.649 173.649 173.148 0.501 18387 11406 1 14 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.888 1.187 18387 11407 1 14 . 1 1 112 112 HIS CB C 112 32.197 32.197 33.429 -1.232 18387 11408 1 14 . 1 1 112 112 HIS H H 112 8.952 8.952 8.372 0.580 18387 11409 1 14 . 1 1 113 113 ILE N N 113 128.596 128.596 124.587 4.009 18387 11410 1 14 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.047 0.650 18387 11411 1 14 . 1 1 113 113 ILE C C 113 176.130 176.130 174.060 2.070 18387 11412 1 14 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.859 1.136 18387 11413 1 14 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.392 -3.337 18387 11414 1 14 . 1 1 113 113 ILE H H 113 8.808 8.808 8.168 0.640 18387 11415 1 14 . 1 1 114 114 ILE N N 114 119.668 119.668 118.043 1.625 18387 11416 1 14 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.625 0.348 18387 11417 1 14 . 1 1 114 114 ILE C C 114 173.186 173.186 173.504 -0.318 18387 11418 1 14 . 1 1 114 114 ILE CA C 114 58.730 58.730 59.035 -0.305 18387 11419 1 14 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.024 0.516 18387 11420 1 14 . 1 1 114 114 ILE H H 114 8.721 8.721 8.919 -0.198 18387 11421 1 14 . 1 1 115 115 LEU N N 115 122.770 122.770 122.681 0.089 18387 11422 1 14 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.082 0.193 18387 11423 1 14 . 1 1 115 115 LEU C C 115 173.601 173.601 175.020 -1.419 18387 11424 1 14 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.447 0.335 18387 11425 1 14 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.104 1.030 18387 11426 1 14 . 1 1 115 115 LEU H H 115 8.665 8.665 8.812 -0.147 18387 11427 1 14 . 1 1 116 116 VAL N N 116 130.411 130.411 126.907 3.504 18387 11428 1 14 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.002 -0.144 18387 11429 1 14 . 1 1 116 116 VAL C C 116 174.565 174.565 175.264 -0.699 18387 11430 1 14 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.511 0.293 18387 11431 1 14 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.315 -0.400 18387 11432 1 14 . 1 1 116 116 VAL H H 116 9.472 9.472 9.187 0.285 18387 11433 1 14 . 1 1 117 117 ASP N N 117 127.896 127.896 128.023 -0.127 18387 11434 1 14 . 1 1 117 117 ASP HA H 117 4.392 4.392 3.988 0.404 18387 11435 1 14 . 1 1 117 117 ASP C C 117 176.567 176.567 175.658 0.909 18387 11436 1 14 . 1 1 117 117 ASP CA C 117 52.600 52.600 54.255 -1.655 18387 11437 1 14 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.057 0.527 18387 11438 1 14 . 1 1 117 117 ASP H H 117 9.429 9.429 8.760 0.669 18387 11439 1 14 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.360 -0.166 18387 11440 1 14 . 1 1 118 118 PRO C C 118 177.534 177.534 176.360 1.174 18387 11441 1 14 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.717 0.448 18387 11442 1 14 . 1 1 118 118 PRO CB C 118 32.813 32.813 32.090 0.723 18387 11443 1 14 . 1 1 119 119 GLU N N 119 114.015 114.015 115.531 -1.516 18387 11444 1 14 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.292 0.047 18387 11445 1 14 . 1 1 119 119 GLU C C 119 176.722 176.722 177.030 -0.308 18387 11446 1 14 . 1 1 119 119 GLU CA C 119 55.639 55.639 56.743 -1.105 18387 11447 1 14 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.864 0.713 18387 11448 1 14 . 1 1 119 119 GLU H H 119 7.733 7.733 8.114 -0.381 18387 11449 1 14 . 1 1 120 120 GLY N N 120 108.218 108.218 106.471 1.747 18387 11450 1 14 . 1 1 120 120 GLY C C 120 174.110 174.110 172.805 1.305 18387 11451 1 14 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.672 0.724 18387 11452 1 14 . 1 1 120 120 GLY H H 120 8.588 8.588 7.960 0.628 18387 11453 1 14 . 1 1 121 121 LYS N N 121 121.778 121.778 119.448 2.330 18387 11454 1 14 . 1 1 121 121 LYS HA H 121 4.859 4.859 4.881 -0.022 18387 11455 1 14 . 1 1 121 121 LYS C C 121 176.458 176.458 175.429 1.029 18387 11456 1 14 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.532 0.430 18387 11457 1 14 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.713 -2.261 18387 11458 1 14 . 1 1 121 121 LYS H H 121 8.600 8.600 7.533 1.067 18387 11459 1 14 . 1 1 122 122 ILE N N 122 122.058 122.058 124.276 -2.218 18387 11460 1 14 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.246 0.026 18387 11461 1 14 . 1 1 122 122 ILE C C 122 177.084 177.084 176.184 0.900 18387 11462 1 14 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.602 0.217 18387 11463 1 14 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.827 1.821 18387 11464 1 14 . 1 1 122 122 ILE H H 122 9.006 9.006 9.171 -0.165 18387 11465 1 14 . 1 1 123 123 VAL N N 123 120.561 120.561 130.030 -9.469 18387 11466 1 14 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.047 0.708 18387 11467 1 14 . 1 1 123 123 VAL C C 123 175.584 175.584 174.648 0.936 18387 11468 1 14 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.486 -1.335 18387 11469 1 14 . 1 1 123 123 VAL CB C 123 33.401 33.401 33.025 0.376 18387 11470 1 14 . 1 1 123 123 VAL H H 123 9.054 9.054 8.309 0.745 18387 11471 1 14 . 1 1 124 124 ALA N N 124 121.102 121.102 120.534 0.568 18387 11472 1 14 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.634 0.023 18387 11473 1 14 . 1 1 124 124 ALA C C 124 174.832 174.832 174.648 0.184 18387 11474 1 14 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.683 0.777 18387 11475 1 14 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.372 1.458 18387 11476 1 14 . 1 1 124 124 ALA H H 124 7.793 7.793 7.572 0.221 18387 11477 1 14 . 1 1 125 125 LYS N N 125 117.637 117.637 119.542 -1.905 18387 11478 1 14 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.538 0.495 18387 11479 1 14 . 1 1 125 125 LYS C C 125 173.417 173.417 175.456 -2.039 18387 11480 1 14 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.224 -0.083 18387 11481 1 14 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.369 1.282 18387 11482 1 14 . 1 1 125 125 LYS H H 125 8.872 8.872 8.214 0.658 18387 11483 1 14 . 1 1 126 126 GLU N N 126 115.236 115.236 114.088 1.148 18387 11484 1 14 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.920 0.078 18387 11485 1 14 . 1 1 126 126 GLU C C 126 175.998 175.998 175.939 0.059 18387 11486 1 14 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.773 -0.811 18387 11487 1 14 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.566 -1.131 18387 11488 1 14 . 1 1 126 126 GLU H H 126 7.941 7.941 8.490 -0.549 18387 11489 1 14 . 1 1 127 127 LEU N N 127 118.584 118.584 120.211 -1.627 18387 11490 1 14 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.031 0.351 18387 11491 1 14 . 1 1 127 127 LEU C C 127 176.766 176.766 176.073 0.693 18387 11492 1 14 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.883 -1.274 18387 11493 1 14 . 1 1 127 127 LEU CB C 127 43.963 43.963 41.775 2.188 18387 11494 1 14 . 1 1 127 127 LEU H H 127 7.300 7.300 7.810 -0.510 18387 11495 1 14 . 1 1 128 128 ARG N N 128 118.625 118.625 121.316 -2.691 18387 11496 1 14 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.422 0.053 18387 11497 1 14 . 1 1 128 128 ARG C C 128 177.113 177.113 176.896 0.217 18387 11498 1 14 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.942 -0.552 18387 11499 1 14 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.372 1.240 18387 11500 1 14 . 1 1 128 128 ARG H H 128 7.929 7.929 8.209 -0.280 18387 11501 1 14 . 1 1 129 129 GLY N N 129 114.010 114.010 109.510 4.500 18387 11502 1 14 . 1 1 129 129 GLY C C 129 175.931 175.931 174.977 0.954 18387 11503 1 14 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.235 -0.774 18387 11504 1 14 . 1 1 129 129 GLY H H 129 10.649 10.649 8.362 2.287 18387 11505 1 14 . 1 1 130 130 ASP N N 130 123.975 123.975 122.305 1.670 18387 11506 1 14 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.348 0.184 18387 11507 1 14 . 1 1 130 130 ASP C C 130 177.507 177.507 177.284 0.223 18387 11508 1 14 . 1 1 130 130 ASP CA C 130 57.372 57.372 55.900 1.472 18387 11509 1 14 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.695 0.208 18387 11510 1 14 . 1 1 130 130 ASP H H 130 8.540 8.540 8.256 0.284 18387 11511 1 14 . 1 1 131 131 ASP N N 131 116.806 116.806 121.140 -4.334 18387 11512 1 14 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.389 0.181 18387 11513 1 14 . 1 1 131 131 ASP C C 131 179.038 179.038 178.311 0.727 18387 11514 1 14 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.787 0.196 18387 11515 1 14 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.781 0.153 18387 11516 1 14 . 1 1 131 131 ASP H H 131 7.907 7.907 7.680 0.227 18387 11517 1 14 . 1 1 132 132 LEU N N 132 123.869 123.869 120.153 3.716 18387 11518 1 14 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.836 -0.045 18387 11519 1 14 . 1 1 132 132 LEU C C 132 176.343 176.343 178.572 -2.229 18387 11520 1 14 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.278 1.506 18387 11521 1 14 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.351 0.417 18387 11522 1 14 . 1 1 132 132 LEU H H 132 7.542 7.542 7.529 0.013 18387 11523 1 14 . 1 1 133 133 TYR N N 133 120.042 120.042 119.014 1.028 18387 11524 1 14 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.160 -0.164 18387 11525 1 14 . 1 1 133 133 TYR C C 133 177.426 177.426 177.725 -0.299 18387 11526 1 14 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.906 0.227 18387 11527 1 14 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.481 0.095 18387 11528 1 14 . 1 1 133 133 TYR H H 133 7.384 7.384 7.700 -0.316 18387 11529 1 14 . 1 1 134 134 ASN N N 134 114.936 114.936 116.652 -1.716 18387 11530 1 14 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.608 -0.205 18387 11531 1 14 . 1 1 134 134 ASN C C 134 178.703 178.703 178.251 0.452 18387 11532 1 14 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.244 -0.435 18387 11533 1 14 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.130 0.078 18387 11534 1 14 . 1 1 134 134 ASN H H 134 8.399 8.399 8.463 -0.064 18387 11535 1 14 . 1 1 135 135 THR N N 135 117.387 117.387 118.150 -0.763 18387 11536 1 14 . 1 1 135 135 THR HA H 135 3.920 3.920 4.064 -0.144 18387 11537 1 14 . 1 1 135 135 THR C C 135 175.323 175.323 175.825 -0.502 18387 11538 1 14 . 1 1 135 135 THR CA C 135 67.402 67.402 66.845 0.557 18387 11539 1 14 . 1 1 135 135 THR CB C 135 68.111 68.111 68.811 -0.700 18387 11540 1 14 . 1 1 135 135 THR H H 135 8.265 8.265 8.347 -0.082 18387 11541 1 14 . 1 1 136 136 VAL N N 136 121.207 121.207 121.899 -0.692 18387 11542 1 14 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.167 -0.152 18387 11543 1 14 . 1 1 136 136 VAL C C 136 176.457 176.457 177.306 -0.849 18387 11544 1 14 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.616 1.656 18387 11545 1 14 . 1 1 136 136 VAL CB C 136 30.941 30.941 29.883 1.058 18387 11546 1 14 . 1 1 136 136 VAL H H 136 7.595 7.595 7.328 0.267 18387 11547 1 14 . 1 1 137 137 GLU N N 137 118.266 118.266 118.198 0.068 18387 11548 1 14 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.835 -1.153 18387 11549 1 14 . 1 1 137 137 GLU C C 137 177.482 177.482 178.525 -1.043 18387 11550 1 14 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.075 0.855 18387 11551 1 14 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.216 0.566 18387 11552 1 14 . 1 1 137 137 GLU H H 137 8.114 8.114 7.651 0.463 18387 11553 1 14 . 1 1 138 138 LYS N N 138 116.431 116.431 119.832 -3.401 18387 11554 1 14 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.974 -0.206 18387 11555 1 14 . 1 1 138 138 LYS C C 138 179.193 179.193 178.903 0.290 18387 11556 1 14 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.591 -0.551 18387 11557 1 14 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.620 -0.462 18387 11558 1 14 . 1 1 138 138 LYS H H 138 7.133 7.133 7.732 -0.599 18387 11559 1 14 . 1 1 139 139 PHE N N 139 116.336 116.336 117.101 -0.765 18387 11560 1 14 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.257 -0.247 18387 11561 1 14 . 1 1 139 139 PHE C C 139 177.855 177.855 177.449 0.406 18387 11562 1 14 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.207 1.177 18387 11563 1 14 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.786 -0.434 18387 11564 1 14 . 1 1 139 139 PHE H H 139 7.338 7.338 8.346 -1.008 18387 11565 1 14 . 1 1 140 140 VAL N N 140 116.491 116.491 117.334 -0.843 18387 11566 1 14 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.436 0.088 18387 11567 1 14 . 1 1 140 140 VAL C C 140 177.747 177.747 176.678 1.069 18387 11568 1 14 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.794 0.448 18387 11569 1 14 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.014 0.376 18387 11570 1 14 . 1 1 140 140 VAL H H 140 8.332 8.332 7.672 0.660 18387 11571 1 14 . 1 1 141 141 ASN N N 141 116.956 116.956 114.603 2.353 18387 11572 1 14 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.565 0.261 18387 11573 1 14 . 1 1 141 141 ASN C C 141 176.997 176.997 175.954 1.043 18387 11574 1 14 . 1 1 141 141 ASN CA C 141 53.677 53.677 53.744 -0.067 18387 11575 1 14 . 1 1 141 141 ASN CB C 141 38.448 38.448 40.190 -1.742 18387 11576 1 14 . 1 1 141 141 ASN H H 141 7.862 7.862 7.475 0.387 18387 11577 1 14 . 1 1 142 142 GLY N N 142 107.938 107.938 106.816 1.122 18387 11578 1 14 . 1 1 142 142 GLY C C 142 174.336 174.336 174.482 -0.146 18387 11579 1 14 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.555 0.430 18387 11580 1 14 . 1 1 142 142 GLY H H 142 7.466 7.466 7.144 0.322 18387 11581 1 14 . 1 1 143 143 ALA N N 143 123.441 123.441 117.957 5.484 18387 11582 1 14 . 1 1 143 143 ALA HA H 143 4.341 4.341 3.927 0.414 18387 11583 1 14 . 1 1 143 143 ALA C C 143 178.212 178.212 176.037 2.175 18387 11584 1 14 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.977 -0.151 18387 11585 1 14 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.159 1.085 18387 11586 1 14 . 1 1 143 143 ALA H H 143 7.950 7.950 8.063 -0.113 18387 11587 1 14 . 1 1 144 144 LYS N N 144 120.149 120.149 118.066 2.083 18387 11588 1 14 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.484 -0.189 18387 11589 1 14 . 1 1 144 144 LYS C C 144 176.945 176.945 174.316 2.629 18387 11590 1 14 . 1 1 144 144 LYS CA C 144 56.519 56.519 55.266 1.253 18387 11591 1 14 . 1 1 144 144 LYS CB C 144 33.030 33.030 35.050 -2.020 18387 11592 1 14 . 1 1 144 144 LYS H H 144 8.187 8.187 7.418 0.769 18387 11593 1 14 . 1 1 145 145 GLU N N 145 120.992 120.992 122.670 -1.678 18387 11594 1 14 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.623 -0.328 18387 11595 1 14 . 1 1 145 145 GLU C C 145 177.116 177.116 176.386 0.730 18387 11596 1 14 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.985 0.918 18387 11597 1 14 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.486 -0.244 18387 11598 1 14 . 1 1 145 145 GLU H H 145 8.363 8.363 8.514 -0.151 18387 11599 1 14 . 1 1 146 146 GLY N N 146 109.467 109.467 114.699 -5.232 18387 11600 1 14 . 1 1 146 146 GLY C C 146 174.108 174.108 173.444 0.664 18387 11601 1 14 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.687 -0.285 18387 11602 1 14 . 1 1 146 146 GLY H H 146 8.371 8.371 8.748 -0.377 18387 11603 1 14 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.916 -0.307 18387 11604 1 14 . 1 1 151 151 HIS C C 151 174.258 174.258 174.535 -0.277 18387 11605 1 14 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.482 0.683 18387 11606 1 14 . 1 1 151 151 HIS CB C 151 30.833 30.833 29.077 1.756 18387 11607 1 15 . 1 1 2 2 SER HA H 2 3.992 3.992 4.838 -0.846 18387 11608 1 15 . 1 1 2 2 SER CA C 2 57.555 57.555 57.449 0.106 18387 11609 1 15 . 1 1 2 2 SER CB C 2 64.977 64.977 64.132 0.845 18387 11610 1 15 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.341 0.098 18387 11611 1 15 . 1 1 3 3 LEU C C 3 176.631 176.631 176.856 -0.225 18387 11612 1 15 . 1 1 3 3 LEU CA C 3 54.564 54.564 56.312 -1.748 18387 11613 1 15 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.451 0.273 18387 11614 1 15 . 1 1 4 4 ALA N N 4 125.483 125.483 117.660 7.823 18387 11615 1 15 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.411 -0.032 18387 11616 1 15 . 1 1 4 4 ALA C C 4 179.642 179.642 176.024 3.618 18387 11617 1 15 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.428 0.307 18387 11618 1 15 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.157 -0.405 18387 11619 1 15 . 1 1 4 4 ALA H H 4 8.483 8.483 7.838 0.645 18387 11620 1 15 . 1 1 5 5 THR HA H 5 3.845 3.845 4.577 -0.732 18387 11621 1 15 . 1 1 5 5 THR C C 5 175.487 175.487 175.759 -0.272 18387 11622 1 15 . 1 1 5 5 THR CA C 5 64.531 64.531 62.354 2.177 18387 11623 1 15 . 1 1 5 5 THR CB C 5 68.108 68.108 68.401 -0.293 18387 11624 1 15 . 1 1 6 6 GLY N N 6 114.298 114.298 116.193 -1.895 18387 11625 1 15 . 1 1 6 6 GLY C C 6 174.324 174.324 174.358 -0.034 18387 11626 1 15 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.783 0.052 18387 11627 1 15 . 1 1 6 6 GLY H H 6 9.511 9.511 9.026 0.485 18387 11628 1 15 . 1 1 7 7 SER N N 7 115.270 115.270 118.094 -2.824 18387 11629 1 15 . 1 1 7 7 SER HA H 7 4.500 4.500 4.555 -0.055 18387 11630 1 15 . 1 1 7 7 SER C C 7 173.315 173.315 174.160 -0.845 18387 11631 1 15 . 1 1 7 7 SER CA C 7 58.915 58.915 58.539 0.376 18387 11632 1 15 . 1 1 7 7 SER CB C 7 64.308 64.308 64.031 0.277 18387 11633 1 15 . 1 1 7 7 SER H H 7 7.736 7.736 7.829 -0.093 18387 11634 1 15 . 1 1 8 8 VAL N N 8 123.708 123.708 124.976 -1.268 18387 11635 1 15 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.021 -0.189 18387 11636 1 15 . 1 1 8 8 VAL C C 8 176.673 176.673 175.532 1.141 18387 11637 1 15 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.699 1.974 18387 11638 1 15 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.795 -0.573 18387 11639 1 15 . 1 1 8 8 VAL H H 8 8.632 8.632 8.423 0.209 18387 11640 1 15 . 1 1 9 9 ALA N N 9 133.040 133.040 132.101 0.939 18387 11641 1 15 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.571 -0.308 18387 11642 1 15 . 1 1 9 9 ALA C C 9 175.404 175.404 175.240 0.164 18387 11643 1 15 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.189 0.766 18387 11644 1 15 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.606 -0.576 18387 11645 1 15 . 1 1 9 9 ALA H H 9 8.448 8.448 8.793 -0.345 18387 11646 1 15 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.352 -0.021 18387 11647 1 15 . 1 1 10 10 PRO C C 10 175.071 175.071 175.941 -0.870 18387 11648 1 15 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.617 0.023 18387 11649 1 15 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.397 -0.073 18387 11650 1 15 . 1 1 11 11 ALA N N 11 124.172 124.172 123.818 0.354 18387 11651 1 15 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.421 -0.177 18387 11652 1 15 . 1 1 11 11 ALA C C 11 177.688 177.688 177.103 0.585 18387 11653 1 15 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.502 2.119 18387 11654 1 15 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.938 0.389 18387 11655 1 15 . 1 1 11 11 ALA H H 11 8.221 8.221 8.271 -0.050 18387 11656 1 15 . 1 1 12 12 ILE N N 12 117.815 117.815 124.570 -6.755 18387 11657 1 15 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.263 0.065 18387 11658 1 15 . 1 1 12 12 ILE C C 12 175.013 175.013 175.841 -0.828 18387 11659 1 15 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.422 0.744 18387 11660 1 15 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.401 5.889 18387 11661 1 15 . 1 1 12 12 ILE H H 12 7.693 7.693 8.181 -0.488 18387 11662 1 15 . 1 1 13 13 THR N N 13 121.186 121.186 121.490 -0.304 18387 11663 1 15 . 1 1 13 13 THR HA H 13 4.840 4.840 5.172 -0.332 18387 11664 1 15 . 1 1 13 13 THR C C 13 172.625 172.625 173.651 -1.026 18387 11665 1 15 . 1 1 13 13 THR CA C 13 62.297 62.297 60.773 1.524 18387 11666 1 15 . 1 1 13 13 THR CB C 13 71.585 71.585 70.965 0.620 18387 11667 1 15 . 1 1 13 13 THR H H 13 8.363 8.363 8.465 -0.102 18387 11668 1 15 . 1 1 14 14 GLY N N 14 110.785 110.785 113.096 -2.311 18387 11669 1 15 . 1 1 14 14 GLY C C 14 170.040 170.040 171.908 -1.868 18387 11670 1 15 . 1 1 14 14 GLY CA C 14 44.390 44.390 45.041 -0.651 18387 11671 1 15 . 1 1 14 14 GLY H H 14 7.993 7.993 8.974 -0.981 18387 11672 1 15 . 1 1 15 15 ILE N N 15 119.088 119.088 121.021 -1.933 18387 11673 1 15 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.918 0.207 18387 11674 1 15 . 1 1 15 15 ILE C C 15 176.359 176.359 176.277 0.082 18387 11675 1 15 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.989 -2.375 18387 11676 1 15 . 1 1 15 15 ILE CB C 15 38.639 38.639 37.705 0.934 18387 11677 1 15 . 1 1 15 15 ILE H H 15 7.973 7.973 8.498 -0.525 18387 11678 1 15 . 1 1 16 16 ASP N N 16 126.633 126.633 127.987 -1.354 18387 11679 1 15 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.345 0.504 18387 11680 1 15 . 1 1 16 16 ASP C C 16 179.190 179.190 177.537 1.653 18387 11681 1 15 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.572 -0.692 18387 11682 1 15 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.814 -0.539 18387 11683 1 15 . 1 1 16 16 ASP H H 16 9.335 9.335 8.898 0.437 18387 11684 1 15 . 1 1 17 17 LEU N N 17 116.648 116.648 118.173 -1.525 18387 11685 1 15 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.958 0.216 18387 11686 1 15 . 1 1 17 17 LEU C C 17 178.432 178.432 179.105 -0.673 18387 11687 1 15 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.535 0.446 18387 11688 1 15 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.639 1.347 18387 11689 1 15 . 1 1 17 17 LEU H H 17 8.071 8.071 8.646 -0.575 18387 11690 1 15 . 1 1 18 18 LYS N N 18 117.401 117.401 117.898 -0.497 18387 11691 1 15 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.222 0.287 18387 11692 1 15 . 1 1 18 18 LYS C C 18 176.793 176.793 177.670 -0.877 18387 11693 1 15 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.800 -2.365 18387 11694 1 15 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.247 -0.184 18387 11695 1 15 . 1 1 18 18 LYS H H 18 8.207 8.207 8.501 -0.294 18387 11696 1 15 . 1 1 19 19 GLY N N 19 108.061 108.061 105.815 2.246 18387 11697 1 15 . 1 1 19 19 GLY C C 19 174.649 174.649 173.973 0.676 18387 11698 1 15 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.560 1.037 18387 11699 1 15 . 1 1 19 19 GLY H H 19 8.099 8.099 8.511 -0.412 18387 11700 1 15 . 1 1 20 20 ASN N N 20 121.012 121.012 119.906 1.106 18387 11701 1 15 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.030 -0.125 18387 11702 1 15 . 1 1 20 20 ASN C C 20 174.827 174.827 174.825 0.002 18387 11703 1 15 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.521 -0.054 18387 11704 1 15 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.920 -1.244 18387 11705 1 15 . 1 1 20 20 ASN H H 20 8.945 8.945 9.240 -0.295 18387 11706 1 15 . 1 1 21 21 SER N N 21 117.285 117.285 116.903 0.382 18387 11707 1 15 . 1 1 21 21 SER HA H 21 5.000 5.000 5.002 -0.002 18387 11708 1 15 . 1 1 21 21 SER C C 21 174.911 174.911 174.598 0.313 18387 11709 1 15 . 1 1 21 21 SER CA C 21 58.730 58.730 58.328 0.402 18387 11710 1 15 . 1 1 21 21 SER CB C 21 63.162 63.162 62.696 0.466 18387 11711 1 15 . 1 1 21 21 SER H H 21 8.740 8.740 8.653 0.087 18387 11712 1 15 . 1 1 22 22 VAL N N 22 128.665 128.665 127.991 0.674 18387 11713 1 15 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.408 -0.028 18387 11714 1 15 . 1 1 22 22 VAL C C 22 176.276 176.276 175.688 0.588 18387 11715 1 15 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.297 0.655 18387 11716 1 15 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.532 2.050 18387 11717 1 15 . 1 1 22 22 VAL H H 22 9.125 9.125 8.818 0.307 18387 11718 1 15 . 1 1 23 23 SER N N 23 127.457 127.457 121.038 6.419 18387 11719 1 15 . 1 1 23 23 SER HA H 23 5.878 5.878 5.399 0.479 18387 11720 1 15 . 1 1 23 23 SER C C 23 174.436 174.436 175.389 -0.953 18387 11721 1 15 . 1 1 23 23 SER CA C 23 57.101 57.101 57.051 0.050 18387 11722 1 15 . 1 1 23 23 SER CB C 23 66.078 66.078 65.552 0.526 18387 11723 1 15 . 1 1 23 23 SER H H 23 8.971 8.971 9.586 -0.615 18387 11724 1 15 . 1 1 24 24 LEU N N 24 126.734 126.734 124.088 2.646 18387 11725 1 15 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.903 -0.436 18387 11726 1 15 . 1 1 24 24 LEU C C 24 179.852 179.852 177.728 2.124 18387 11727 1 15 . 1 1 24 24 LEU CA C 24 58.203 58.203 56.943 1.260 18387 11728 1 15 . 1 1 24 24 LEU CB C 24 41.978 41.978 42.200 -0.222 18387 11729 1 15 . 1 1 24 24 LEU H H 24 8.450 8.450 9.124 -0.674 18387 11730 1 15 . 1 1 25 25 ASN N N 25 115.642 115.642 116.892 -1.250 18387 11731 1 15 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.467 -0.225 18387 11732 1 15 . 1 1 25 25 ASN C C 25 176.246 176.246 176.545 -0.299 18387 11733 1 15 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.995 -0.625 18387 11734 1 15 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.448 0.323 18387 11735 1 15 . 1 1 25 25 ASN H H 25 8.505 8.505 8.771 -0.266 18387 11736 1 15 . 1 1 26 26 ASP N N 26 119.722 119.722 119.359 0.363 18387 11737 1 15 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.498 -0.293 18387 11738 1 15 . 1 1 26 26 ASP C C 26 176.708 176.708 176.367 0.341 18387 11739 1 15 . 1 1 26 26 ASP CA C 26 56.525 56.525 55.904 0.621 18387 11740 1 15 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.154 -0.874 18387 11741 1 15 . 1 1 26 26 ASP H H 26 7.731 7.731 7.825 -0.094 18387 11742 1 15 . 1 1 27 27 PHE N N 27 116.827 116.827 117.220 -0.393 18387 11743 1 15 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.582 -0.102 18387 11744 1 15 . 1 1 27 27 PHE C C 27 174.227 174.227 174.624 -0.397 18387 11745 1 15 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.093 -0.021 18387 11746 1 15 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.434 0.285 18387 11747 1 15 . 1 1 27 27 PHE H H 27 7.390 7.390 7.510 -0.120 18387 11748 1 15 . 1 1 28 28 LYS N N 28 120.357 120.357 122.064 -1.707 18387 11749 1 15 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.293 0.094 18387 11750 1 15 . 1 1 28 28 LYS C C 28 177.845 177.845 176.693 1.152 18387 11751 1 15 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.621 0.381 18387 11752 1 15 . 1 1 28 28 LYS CB C 28 32.544 32.544 31.753 0.791 18387 11753 1 15 . 1 1 28 28 LYS H H 28 6.883 6.883 7.397 -0.514 18387 11754 1 15 . 1 1 29 29 GLY N N 29 112.653 112.653 111.640 1.013 18387 11755 1 15 . 1 1 29 29 GLY C C 29 173.799 173.799 173.837 -0.038 18387 11756 1 15 . 1 1 29 29 GLY CA C 29 44.988 44.988 44.719 0.269 18387 11757 1 15 . 1 1 29 29 GLY H H 29 8.930 8.930 8.227 0.703 18387 11758 1 15 . 1 1 30 30 LYS N N 30 120.516 120.516 120.052 0.464 18387 11759 1 15 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.622 0.013 18387 11760 1 15 . 1 1 30 30 LYS C C 30 176.505 176.505 175.225 1.280 18387 11761 1 15 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.583 0.597 18387 11762 1 15 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.796 -0.939 18387 11763 1 15 . 1 1 30 30 LYS H H 30 8.098 8.098 7.614 0.484 18387 11764 1 15 . 1 1 31 31 TYR N N 31 117.383 117.383 119.707 -2.324 18387 11765 1 15 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.789 -0.135 18387 11766 1 15 . 1 1 31 31 TYR C C 31 175.551 175.551 175.742 -0.191 18387 11767 1 15 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.952 1.214 18387 11768 1 15 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.653 2.541 18387 11769 1 15 . 1 1 31 31 TYR H H 31 8.263 8.263 8.999 -0.736 18387 11770 1 15 . 1 1 32 32 VAL N N 32 120.900 120.900 125.461 -4.561 18387 11771 1 15 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.570 -0.131 18387 11772 1 15 . 1 1 32 32 VAL C C 32 175.975 175.975 175.052 0.923 18387 11773 1 15 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.370 -1.664 18387 11774 1 15 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.420 3.087 18387 11775 1 15 . 1 1 32 32 VAL H H 32 9.244 9.244 9.101 0.143 18387 11776 1 15 . 1 1 33 33 LEU N N 33 130.058 130.058 130.492 -0.434 18387 11777 1 15 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.950 0.223 18387 11778 1 15 . 1 1 33 33 LEU C C 33 174.693 174.693 175.179 -0.486 18387 11779 1 15 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.360 -0.012 18387 11780 1 15 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.326 1.995 18387 11781 1 15 . 1 1 33 33 LEU H H 33 8.161 8.161 8.505 -0.344 18387 11782 1 15 . 1 1 34 34 VAL N N 34 129.232 129.232 128.946 0.286 18387 11783 1 15 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.477 0.505 18387 11784 1 15 . 1 1 34 34 VAL C C 34 174.285 174.285 174.589 -0.304 18387 11785 1 15 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.282 0.224 18387 11786 1 15 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.169 0.209 18387 11787 1 15 . 1 1 34 34 VAL H H 34 9.296 9.296 8.908 0.388 18387 11788 1 15 . 1 1 35 35 ASP N N 35 123.675 123.675 128.740 -5.065 18387 11789 1 15 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.908 0.441 18387 11790 1 15 . 1 1 35 35 ASP C C 35 174.258 174.258 175.285 -1.027 18387 11791 1 15 . 1 1 35 35 ASP CA C 35 51.054 51.054 53.749 -2.695 18387 11792 1 15 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.319 -1.857 18387 11793 1 15 . 1 1 35 35 ASP H H 35 8.015 8.015 8.108 -0.093 18387 11794 1 15 . 1 1 36 36 PHE N N 36 126.959 126.959 124.903 2.056 18387 11795 1 15 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.043 0.892 18387 11796 1 15 . 1 1 36 36 PHE C C 36 175.432 175.432 175.448 -0.016 18387 11797 1 15 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.151 -0.056 18387 11798 1 15 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.740 0.290 18387 11799 1 15 . 1 1 36 36 PHE H H 36 9.171 9.171 9.200 -0.029 18387 11800 1 15 . 1 1 37 37 TRP N N 37 120.839 120.839 122.967 -2.128 18387 11801 1 15 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.106 0.651 18387 11802 1 15 . 1 1 37 37 TRP C C 37 172.412 172.412 172.917 -0.505 18387 11803 1 15 . 1 1 37 37 TRP CA C 37 55.909 55.909 56.342 -0.433 18387 11804 1 15 . 1 1 37 37 TRP CB C 37 32.680 32.680 31.891 0.789 18387 11805 1 15 . 1 1 37 37 TRP H H 37 9.280 9.280 9.429 -0.149 18387 11806 1 15 . 1 1 38 38 PHE N N 38 109.215 109.215 112.379 -3.164 18387 11807 1 15 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.369 -0.436 18387 11808 1 15 . 1 1 38 38 PHE C C 38 176.141 176.141 174.265 1.876 18387 11809 1 15 . 1 1 38 38 PHE CA C 38 57.011 57.011 55.926 1.085 18387 11810 1 15 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.747 -1.128 18387 11811 1 15 . 1 1 38 38 PHE H H 38 7.062 7.062 7.622 -0.560 18387 11812 1 15 . 1 1 39 39 ALA N N 39 125.193 125.193 123.754 1.439 18387 11813 1 15 . 1 1 39 39 ALA HA H 39 4.065 4.065 3.965 0.100 18387 11814 1 15 . 1 1 39 39 ALA C C 39 179.349 179.349 179.045 0.304 18387 11815 1 15 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.144 1.920 18387 11816 1 15 . 1 1 39 39 ALA CB C 39 19.897 19.897 19.021 0.875 18387 11817 1 15 . 1 1 39 39 ALA H H 39 10.355 10.355 8.757 1.598 18387 11818 1 15 . 1 1 40 40 GLY N N 40 103.437 103.437 105.818 -2.381 18387 11819 1 15 . 1 1 40 40 GLY C C 40 172.732 172.732 172.875 -0.143 18387 11820 1 15 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.702 0.234 18387 11821 1 15 . 1 1 40 40 GLY H H 40 8.583 8.583 9.037 -0.454 18387 11822 1 15 . 1 1 41 41 CYS N N 41 124.859 124.859 118.930 5.929 18387 11823 1 15 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.640 -0.236 18387 11824 1 15 . 1 1 41 41 CYS C C 41 176.620 176.620 174.879 1.741 18387 11825 1 15 . 1 1 41 41 CYS CA C 41 58.375 58.375 56.809 1.566 18387 11826 1 15 . 1 1 41 41 CYS CB C 41 28.376 28.376 29.670 -1.294 18387 11827 1 15 . 1 1 41 41 CYS H H 41 6.946 6.946 7.506 -0.560 18387 11828 1 15 . 1 1 42 42 SER HA H 42 4.040 4.040 4.423 -0.383 18387 11829 1 15 . 1 1 42 42 SER CA C 42 61.552 61.552 59.455 2.097 18387 11830 1 15 . 1 1 42 42 SER CB C 42 62.675 62.675 62.807 -0.132 18387 11831 1 15 . 1 1 43 43 TRP N N 43 129.748 129.748 122.513 7.235 18387 11832 1 15 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.626 -0.077 18387 11833 1 15 . 1 1 43 43 TRP C C 43 180.400 180.400 178.625 1.775 18387 11834 1 15 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.398 0.851 18387 11835 1 15 . 1 1 43 43 TRP CB C 43 29.592 29.592 30.148 -0.556 18387 11836 1 15 . 1 1 44 44 CYS N N 44 124.462 124.462 117.315 7.147 18387 11837 1 15 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.704 -0.453 18387 11838 1 15 . 1 1 44 44 CYS C C 44 178.643 178.643 176.618 2.025 18387 11839 1 15 . 1 1 44 44 CYS CA C 44 64.849 64.849 61.017 3.832 18387 11840 1 15 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.843 1.579 18387 11841 1 15 . 1 1 44 44 CYS H H 44 9.591 9.591 8.132 1.459 18387 11842 1 15 . 1 1 45 45 ARG N N 45 117.248 117.248 120.241 -2.993 18387 11843 1 15 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.266 -0.090 18387 11844 1 15 . 1 1 45 45 ARG C C 45 180.302 180.302 177.396 2.906 18387 11845 1 15 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.515 -0.572 18387 11846 1 15 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.788 -2.157 18387 11847 1 15 . 1 1 45 45 ARG H H 45 7.955 7.955 7.854 0.101 18387 11848 1 15 . 1 1 46 46 LYS N N 46 120.318 120.318 118.960 1.358 18387 11849 1 15 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.305 -0.033 18387 11850 1 15 . 1 1 46 46 LYS C C 46 177.755 177.755 178.466 -0.711 18387 11851 1 15 . 1 1 46 46 LYS CA C 46 58.769 58.769 58.895 -0.126 18387 11852 1 15 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.867 0.290 18387 11853 1 15 . 1 1 46 46 LYS H H 46 8.129 8.129 8.030 0.099 18387 11854 1 15 . 1 1 47 47 GLU N N 47 114.278 114.278 118.254 -3.976 18387 11855 1 15 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.635 0.256 18387 11856 1 15 . 1 1 47 47 GLU C C 47 178.701 178.701 178.468 0.233 18387 11857 1 15 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.335 -1.781 18387 11858 1 15 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.299 0.467 18387 11859 1 15 . 1 1 47 47 GLU H H 47 7.386 7.386 7.961 -0.575 18387 11860 1 15 . 1 1 48 48 THR N N 48 115.665 115.665 117.681 -2.016 18387 11861 1 15 . 1 1 48 48 THR HA H 48 4.048 4.048 4.104 -0.056 18387 11862 1 15 . 1 1 48 48 THR C C 48 172.392 172.392 174.038 -1.646 18387 11863 1 15 . 1 1 48 48 THR CA C 48 69.426 69.426 69.094 0.332 18387 11864 1 15 . 1 1 48 48 THR CB C 48 66.906 66.906 66.748 0.158 18387 11865 1 15 . 1 1 48 48 THR H H 48 7.810 7.810 7.683 0.127 18387 11866 1 15 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.216 0.073 18387 11867 1 15 . 1 1 49 49 PRO C C 49 179.828 179.828 178.634 1.194 18387 11868 1 15 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.370 0.229 18387 11869 1 15 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.215 -0.181 18387 11870 1 15 . 1 1 50 50 TYR N N 50 116.950 116.950 116.450 0.500 18387 11871 1 15 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.300 -0.162 18387 11872 1 15 . 1 1 50 50 TYR C C 50 179.488 179.488 178.655 0.833 18387 11873 1 15 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.839 -0.704 18387 11874 1 15 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.821 0.480 18387 11875 1 15 . 1 1 50 50 TYR H H 50 7.071 7.071 7.288 -0.217 18387 11876 1 15 . 1 1 51 51 LEU N N 51 123.989 123.989 120.141 3.848 18387 11877 1 15 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.845 -0.175 18387 11878 1 15 . 1 1 51 51 LEU C C 51 178.072 178.072 178.865 -0.793 18387 11879 1 15 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.835 0.841 18387 11880 1 15 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.312 1.305 18387 11881 1 15 . 1 1 51 51 LEU H H 51 8.243 8.243 8.849 -0.606 18387 11882 1 15 . 1 1 52 52 LEU N N 52 119.857 119.857 120.630 -0.773 18387 11883 1 15 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.226 0.101 18387 11884 1 15 . 1 1 52 52 LEU C C 52 178.704 178.704 178.229 0.475 18387 11885 1 15 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.514 0.061 18387 11886 1 15 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.721 1.017 18387 11887 1 15 . 1 1 52 52 LEU H H 52 9.085 9.085 8.563 0.522 18387 11888 1 15 . 1 1 53 53 LYS N N 53 118.658 118.658 119.006 -0.348 18387 11889 1 15 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.954 0.155 18387 11890 1 15 . 1 1 53 53 LYS C C 53 179.786 179.786 178.995 0.791 18387 11891 1 15 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.076 -0.355 18387 11892 1 15 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.294 0.865 18387 11893 1 15 . 1 1 53 53 LYS H H 53 7.807 7.807 8.226 -0.419 18387 11894 1 15 . 1 1 54 54 THR N N 54 116.869 116.869 116.695 0.174 18387 11895 1 15 . 1 1 54 54 THR HA H 54 3.965 3.965 4.380 -0.415 18387 11896 1 15 . 1 1 54 54 THR C C 54 175.328 175.328 176.732 -1.404 18387 11897 1 15 . 1 1 54 54 THR CA C 54 67.683 67.683 67.085 0.598 18387 11898 1 15 . 1 1 54 54 THR CB C 54 68.452 68.452 69.142 -0.690 18387 11899 1 15 . 1 1 54 54 THR H H 54 7.771 7.771 8.174 -0.403 18387 11900 1 15 . 1 1 55 55 TYR N N 55 122.202 122.202 122.323 -0.121 18387 11901 1 15 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.272 0.000 18387 11902 1 15 . 1 1 55 55 TYR C C 55 176.809 176.809 177.385 -0.576 18387 11903 1 15 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.738 0.999 18387 11904 1 15 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.582 0.698 18387 11905 1 15 . 1 1 55 55 TYR H H 55 9.145 9.145 8.743 0.402 18387 11906 1 15 . 1 1 56 56 ASN N N 56 113.858 113.858 117.585 -3.727 18387 11907 1 15 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.312 -0.049 18387 11908 1 15 . 1 1 56 56 ASN C C 56 177.427 177.427 177.044 0.383 18387 11909 1 15 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.169 -0.239 18387 11910 1 15 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.211 -0.257 18387 11911 1 15 . 1 1 56 56 ASN H H 56 8.850 8.850 8.668 0.182 18387 11912 1 15 . 1 1 57 57 ALA N N 57 118.829 118.829 119.627 -0.798 18387 11913 1 15 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.044 0.020 18387 11914 1 15 . 1 1 57 57 ALA C C 57 180.445 180.445 177.651 2.794 18387 11915 1 15 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.882 0.469 18387 11916 1 15 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.560 0.634 18387 11917 1 15 . 1 1 57 57 ALA H H 57 7.436 7.436 7.645 -0.209 18387 11918 1 15 . 1 1 58 58 PHE N N 58 112.082 112.082 113.839 -1.757 18387 11919 1 15 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.661 0.260 18387 11920 1 15 . 1 1 58 58 PHE C C 58 176.999 176.999 175.370 1.629 18387 11921 1 15 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.285 0.782 18387 11922 1 15 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.496 0.994 18387 11923 1 15 . 1 1 58 58 PHE H H 58 7.480 7.480 7.552 -0.072 18387 11924 1 15 . 1 1 59 59 LYS N N 59 120.666 120.666 120.860 -0.194 18387 11925 1 15 . 1 1 59 59 LYS HA H 59 4.803 4.803 3.853 0.950 18387 11926 1 15 . 1 1 59 59 LYS C C 59 177.157 177.157 177.488 -0.331 18387 11927 1 15 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.525 -0.444 18387 11928 1 15 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.782 -1.214 18387 11929 1 15 . 1 1 59 59 LYS H H 59 8.411 8.411 7.643 0.768 18387 11930 1 15 . 1 1 60 60 ASP N N 60 118.908 118.908 117.992 0.916 18387 11931 1 15 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.535 0.590 18387 11932 1 15 . 1 1 60 60 ASP C C 60 176.889 176.889 177.078 -0.189 18387 11933 1 15 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.619 -0.970 18387 11934 1 15 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.198 0.514 18387 11935 1 15 . 1 1 60 60 ASP H H 60 8.574 8.574 8.567 0.007 18387 11936 1 15 . 1 1 61 61 LYS N N 61 121.021 121.021 120.227 0.794 18387 11937 1 15 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.488 0.226 18387 11938 1 15 . 1 1 61 61 LYS C C 61 175.968 175.968 178.227 -2.259 18387 11939 1 15 . 1 1 61 61 LYS CA C 61 55.137 55.137 56.318 -1.181 18387 11940 1 15 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.272 -0.194 18387 11941 1 15 . 1 1 61 61 LYS H H 61 8.278 8.278 7.676 0.602 18387 11942 1 15 . 1 1 62 62 GLY C C 62 173.837 173.837 173.290 0.547 18387 11943 1 15 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.010 2.040 18387 11944 1 15 . 1 1 63 63 PHE N N 63 120.476 120.476 121.706 -1.230 18387 11945 1 15 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.680 0.353 18387 11946 1 15 . 1 1 63 63 PHE C C 63 173.613 173.613 173.182 0.431 18387 11947 1 15 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.760 -0.910 18387 11948 1 15 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.023 -0.348 18387 11949 1 15 . 1 1 63 63 PHE H H 63 7.413 7.413 8.266 -0.853 18387 11950 1 15 . 1 1 64 64 THR N N 64 119.903 119.903 119.611 0.292 18387 11951 1 15 . 1 1 64 64 THR HA H 64 4.097 4.097 4.613 -0.516 18387 11952 1 15 . 1 1 64 64 THR C C 64 170.397 170.397 172.030 -1.633 18387 11953 1 15 . 1 1 64 64 THR CA C 64 60.261 60.261 61.146 -0.885 18387 11954 1 15 . 1 1 64 64 THR CB C 64 69.507 69.507 72.559 -3.053 18387 11955 1 15 . 1 1 64 64 THR H H 64 7.665 7.665 8.190 -0.525 18387 11956 1 15 . 1 1 65 65 ILE N N 65 117.277 117.277 125.455 -8.178 18387 11957 1 15 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.131 0.345 18387 11958 1 15 . 1 1 65 65 ILE C C 65 173.056 173.056 174.092 -1.036 18387 11959 1 15 . 1 1 65 65 ILE CA C 65 59.708 59.708 61.195 -1.487 18387 11960 1 15 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.848 0.997 18387 11961 1 15 . 1 1 65 65 ILE H H 65 7.321 7.321 8.771 -1.450 18387 11962 1 15 . 1 1 66 66 TYR N N 66 131.968 131.968 129.210 2.758 18387 11963 1 15 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.086 0.161 18387 11964 1 15 . 1 1 66 66 TYR C C 66 174.074 174.074 174.907 -0.833 18387 11965 1 15 . 1 1 66 66 TYR CA C 66 54.965 54.965 54.832 0.133 18387 11966 1 15 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.844 1.273 18387 11967 1 15 . 1 1 66 66 TYR H H 66 9.038 9.038 9.106 -0.068 18387 11968 1 15 . 1 1 67 67 GLY N N 67 114.364 114.364 115.657 -1.293 18387 11969 1 15 . 1 1 67 67 GLY C C 67 172.461 172.461 172.579 -0.118 18387 11970 1 15 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.571 0.429 18387 11971 1 15 . 1 1 67 67 GLY H H 67 9.188 9.188 9.274 -0.086 18387 11972 1 15 . 1 1 68 68 VAL N N 68 126.938 126.938 127.604 -0.666 18387 11973 1 15 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.001 0.135 18387 11974 1 15 . 1 1 68 68 VAL C C 68 173.822 173.822 174.329 -0.507 18387 11975 1 15 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.796 -0.298 18387 11976 1 15 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.185 1.373 18387 11977 1 15 . 1 1 68 68 VAL H H 68 9.309 9.309 8.994 0.315 18387 11978 1 15 . 1 1 69 69 SER N N 69 118.813 118.813 122.631 -3.818 18387 11979 1 15 . 1 1 69 69 SER HA H 69 5.527 5.527 5.440 0.087 18387 11980 1 15 . 1 1 69 69 SER C C 69 175.753 175.753 173.276 2.477 18387 11981 1 15 . 1 1 69 69 SER CA C 69 54.407 54.407 55.607 -1.200 18387 11982 1 15 . 1 1 69 69 SER CB C 69 63.630 63.630 64.761 -1.131 18387 11983 1 15 . 1 1 69 69 SER H H 69 8.124 8.124 8.763 -0.639 18387 11984 1 15 . 1 1 70 70 THR N N 70 113.861 113.861 122.234 -8.373 18387 11985 1 15 . 1 1 70 70 THR HA H 70 4.381 4.381 4.435 -0.054 18387 11986 1 15 . 1 1 70 70 THR C C 70 175.001 175.001 173.604 1.397 18387 11987 1 15 . 1 1 70 70 THR CA C 70 60.259 60.259 60.224 0.035 18387 11988 1 15 . 1 1 70 70 THR CB C 70 67.291 67.291 68.783 -1.492 18387 11989 1 15 . 1 1 70 70 THR H H 70 7.656 7.656 8.092 -0.436 18387 11990 1 15 . 1 1 71 71 ASP N N 71 125.133 125.133 121.948 3.185 18387 11991 1 15 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.388 -0.318 18387 11992 1 15 . 1 1 71 71 ASP C C 71 175.685 175.685 176.810 -1.125 18387 11993 1 15 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.140 2.472 18387 11994 1 15 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.276 0.093 18387 11995 1 15 . 1 1 71 71 ASP H H 71 8.931 8.931 7.216 1.715 18387 11996 1 15 . 1 1 72 72 ARG N N 72 118.814 118.814 119.751 -0.937 18387 11997 1 15 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.168 0.027 18387 11998 1 15 . 1 1 72 72 ARG C C 72 177.300 177.300 176.254 1.046 18387 11999 1 15 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.721 -0.912 18387 12000 1 15 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.534 0.577 18387 12001 1 15 . 1 1 72 72 ARG H H 72 8.057 8.057 8.493 -0.436 18387 12002 1 15 . 1 1 73 73 ARG N N 73 118.174 118.174 119.173 -0.999 18387 12003 1 15 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.545 0.209 18387 12004 1 15 . 1 1 73 73 ARG C C 73 176.503 176.503 175.708 0.795 18387 12005 1 15 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.550 -0.014 18387 12006 1 15 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.184 -1.156 18387 12007 1 15 . 1 1 73 73 ARG H H 73 8.639 8.639 7.668 0.971 18387 12008 1 15 . 1 1 74 74 GLU N N 74 127.609 127.609 126.093 1.516 18387 12009 1 15 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.160 -0.081 18387 12010 1 15 . 1 1 74 74 GLU C C 74 178.107 178.107 177.556 0.551 18387 12011 1 15 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.283 -0.498 18387 12012 1 15 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.815 0.283 18387 12013 1 15 . 1 1 74 74 GLU H H 74 9.129 9.129 9.065 0.064 18387 12014 1 15 . 1 1 75 75 GLU N N 75 117.874 117.874 117.963 -0.089 18387 12015 1 15 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.045 0.055 18387 12016 1 15 . 1 1 75 75 GLU C C 75 178.993 178.993 178.849 0.144 18387 12017 1 15 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.342 -0.215 18387 12018 1 15 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.857 0.434 18387 12019 1 15 . 1 1 75 75 GLU H H 75 9.745 9.745 8.713 1.032 18387 12020 1 15 . 1 1 76 76 ASP N N 76 119.182 119.182 119.612 -0.430 18387 12021 1 15 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.476 -0.110 18387 12022 1 15 . 1 1 76 76 ASP C C 76 178.107 178.107 177.733 0.374 18387 12023 1 15 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.198 -0.225 18387 12024 1 15 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.537 -0.017 18387 12025 1 15 . 1 1 76 76 ASP H H 76 7.004 7.004 8.358 -1.354 18387 12026 1 15 . 1 1 77 77 TRP N N 77 123.008 123.008 122.671 0.337 18387 12027 1 15 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.066 0.083 18387 12028 1 15 . 1 1 77 77 TRP C C 77 176.236 176.236 178.142 -1.906 18387 12029 1 15 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.451 -0.968 18387 12030 1 15 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.245 -0.710 18387 12031 1 15 . 1 1 77 77 TRP H H 77 7.112 7.112 7.980 -0.868 18387 12032 1 15 . 1 1 78 78 LYS N N 78 115.727 115.727 118.133 -2.406 18387 12033 1 15 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.532 -0.287 18387 12034 1 15 . 1 1 78 78 LYS C C 78 179.426 179.426 178.892 0.534 18387 12035 1 15 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.301 1.131 18387 12036 1 15 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.761 0.984 18387 12037 1 15 . 1 1 78 78 LYS H H 78 8.431 8.431 8.542 -0.111 18387 12038 1 15 . 1 1 79 79 LYS N N 79 118.321 118.321 119.929 -1.608 18387 12039 1 15 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.927 0.093 18387 12040 1 15 . 1 1 79 79 LYS C C 79 178.239 178.239 178.691 -0.452 18387 12041 1 15 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.399 -0.332 18387 12042 1 15 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.496 -0.033 18387 12043 1 15 . 1 1 79 79 LYS H H 79 7.690 7.690 7.942 -0.252 18387 12044 1 15 . 1 1 80 80 ALA N N 80 120.679 120.679 121.839 -1.160 18387 12045 1 15 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.300 -0.145 18387 12046 1 15 . 1 1 80 80 ALA C C 80 178.811 178.811 179.549 -0.738 18387 12047 1 15 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.242 -0.155 18387 12048 1 15 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.474 0.284 18387 12049 1 15 . 1 1 80 80 ALA H H 80 7.560 7.560 8.422 -0.862 18387 12050 1 15 . 1 1 81 81 ILE N N 81 118.019 118.019 118.868 -0.849 18387 12051 1 15 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.802 -0.400 18387 12052 1 15 . 1 1 81 81 ILE C C 81 178.113 178.113 178.387 -0.274 18387 12053 1 15 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.737 -0.217 18387 12054 1 15 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.535 0.669 18387 12055 1 15 . 1 1 81 81 ILE H H 81 7.514 7.514 7.670 -0.156 18387 12056 1 15 . 1 1 82 82 GLU N N 82 117.252 117.252 120.638 -3.386 18387 12057 1 15 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.914 0.180 18387 12058 1 15 . 1 1 82 82 GLU C C 82 179.558 179.558 178.552 1.006 18387 12059 1 15 . 1 1 82 82 GLU CA C 82 58.580 58.580 59.661 -1.081 18387 12060 1 15 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.411 -0.028 18387 12061 1 15 . 1 1 82 82 GLU H H 82 7.401 7.401 8.008 -0.608 18387 12062 1 15 . 1 1 83 83 GLU N N 83 119.340 119.340 119.301 0.039 18387 12063 1 15 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.000 -0.102 18387 12064 1 15 . 1 1 83 83 GLU C C 83 178.740 178.740 178.948 -0.208 18387 12065 1 15 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.377 -0.377 18387 12066 1 15 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.868 0.052 18387 12067 1 15 . 1 1 83 83 GLU H H 83 8.191 8.191 7.788 0.403 18387 12068 1 15 . 1 1 84 84 ASP N N 84 118.449 118.449 115.538 2.911 18387 12069 1 15 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.450 -0.176 18387 12070 1 15 . 1 1 84 84 ASP C C 84 175.597 175.597 176.872 -1.275 18387 12071 1 15 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.252 0.795 18387 12072 1 15 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.839 -0.943 18387 12073 1 15 . 1 1 84 84 ASP H H 84 8.252 8.252 8.255 -0.003 18387 12074 1 15 . 1 1 85 85 LYS N N 85 116.410 116.410 114.747 1.663 18387 12075 1 15 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.218 -0.045 18387 12076 1 15 . 1 1 85 85 LYS C C 85 176.856 176.856 175.426 1.430 18387 12077 1 15 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.078 -0.105 18387 12078 1 15 . 1 1 85 85 LYS CB C 85 28.868 28.868 28.928 -0.060 18387 12079 1 15 . 1 1 85 85 LYS H H 85 7.890 7.890 7.911 -0.021 18387 12080 1 15 . 1 1 86 86 SER N N 86 112.295 112.295 115.776 -3.481 18387 12081 1 15 . 1 1 86 86 SER HA H 86 3.139 3.139 3.651 -0.512 18387 12082 1 15 . 1 1 86 86 SER C C 86 175.805 175.805 173.087 2.718 18387 12083 1 15 . 1 1 86 86 SER CA C 86 53.637 53.637 57.851 -4.214 18387 12084 1 15 . 1 1 86 86 SER CB C 86 60.736 60.736 61.267 -0.531 18387 12085 1 15 . 1 1 86 86 SER H H 86 7.327 7.327 8.424 -1.097 18387 12086 1 15 . 1 1 87 87 TYR N N 87 120.962 120.962 127.491 -6.529 18387 12087 1 15 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.342 -0.037 18387 12088 1 15 . 1 1 87 87 TYR C C 87 177.064 177.064 174.319 2.745 18387 12089 1 15 . 1 1 87 87 TYR CA C 87 57.223 57.223 56.557 0.666 18387 12090 1 15 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.015 -0.662 18387 12091 1 15 . 1 1 87 87 TYR H H 87 6.933 6.933 7.733 -0.800 18387 12092 1 15 . 1 1 88 88 TRP N N 88 118.597 118.597 120.713 -2.116 18387 12093 1 15 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.569 0.282 18387 12094 1 15 . 1 1 88 88 TRP C C 88 175.456 175.456 174.175 1.281 18387 12095 1 15 . 1 1 88 88 TRP CA C 88 56.236 56.236 55.145 1.091 18387 12096 1 15 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.120 -3.393 18387 12097 1 15 . 1 1 88 88 TRP H H 88 6.552 6.552 7.015 -0.463 18387 12098 1 15 . 1 1 89 89 ASN N N 89 118.067 118.067 120.978 -2.911 18387 12099 1 15 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.906 0.143 18387 12100 1 15 . 1 1 89 89 ASN C C 89 173.773 173.773 174.932 -1.159 18387 12101 1 15 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.542 1.914 18387 12102 1 15 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.440 0.757 18387 12103 1 15 . 1 1 89 89 ASN H H 89 7.864 7.864 8.781 -0.917 18387 12104 1 15 . 1 1 90 90 GLN N N 90 125.392 125.392 122.390 3.002 18387 12105 1 15 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.392 0.105 18387 12106 1 15 . 1 1 90 90 GLN C C 90 176.491 176.491 174.935 1.556 18387 12107 1 15 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.743 0.717 18387 12108 1 15 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.316 -2.089 18387 12109 1 15 . 1 1 90 90 GLN H H 90 7.904 7.904 8.379 -0.475 18387 12110 1 15 . 1 1 91 91 VAL N N 91 114.434 114.434 116.098 -1.664 18387 12111 1 15 . 1 1 91 91 VAL HA H 91 5.480 5.480 5.018 0.462 18387 12112 1 15 . 1 1 91 91 VAL C C 91 174.248 174.248 172.988 1.260 18387 12113 1 15 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.630 -0.624 18387 12114 1 15 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.255 1.383 18387 12115 1 15 . 1 1 91 91 VAL H H 91 9.585 9.585 9.219 0.366 18387 12116 1 15 . 1 1 92 92 LEU N N 92 126.910 126.910 125.754 1.156 18387 12117 1 15 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.580 -0.511 18387 12118 1 15 . 1 1 92 92 LEU C C 92 177.696 177.696 175.759 1.937 18387 12119 1 15 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.548 0.296 18387 12120 1 15 . 1 1 92 92 LEU CB C 92 42.947 42.947 42.406 0.541 18387 12121 1 15 . 1 1 92 92 LEU H H 92 8.941 8.941 8.803 0.138 18387 12122 1 15 . 1 1 93 93 LEU N N 93 125.673 125.673 128.436 -2.763 18387 12123 1 15 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.348 0.052 18387 12124 1 15 . 1 1 93 93 LEU C C 93 177.291 177.291 177.109 0.182 18387 12125 1 15 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.581 -0.630 18387 12126 1 15 . 1 1 93 93 LEU CB C 93 43.179 43.179 42.372 0.807 18387 12127 1 15 . 1 1 93 93 LEU H H 93 8.038 8.038 8.649 -0.611 18387 12128 1 15 . 1 1 94 94 GLN N N 94 122.206 122.206 120.319 1.887 18387 12129 1 15 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.458 -0.221 18387 12130 1 15 . 1 1 94 94 GLN C C 94 178.246 178.246 176.731 1.515 18387 12131 1 15 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.059 0.716 18387 12132 1 15 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.798 -0.543 18387 12133 1 15 . 1 1 94 94 GLN H H 94 9.298 9.298 8.789 0.509 18387 12134 1 15 . 1 1 95 95 LYS N N 95 122.668 122.668 119.080 3.588 18387 12135 1 15 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.105 -0.139 18387 12136 1 15 . 1 1 95 95 LYS C C 95 178.787 178.787 176.464 2.323 18387 12137 1 15 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.715 1.357 18387 12138 1 15 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.744 0.721 18387 12139 1 15 . 1 1 95 95 LYS H H 95 8.645 8.645 8.780 -0.135 18387 12140 1 15 . 1 1 96 96 ASP N N 96 116.775 116.775 119.328 -2.553 18387 12141 1 15 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.554 0.026 18387 12142 1 15 . 1 1 96 96 ASP C C 96 176.220 176.220 178.279 -2.059 18387 12143 1 15 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.916 -0.570 18387 12144 1 15 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.779 -0.223 18387 12145 1 15 . 1 1 96 96 ASP H H 96 8.606 8.606 8.156 0.450 18387 12146 1 15 . 1 1 97 97 ASP N N 97 118.213 118.213 120.082 -1.869 18387 12147 1 15 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.506 0.421 18387 12148 1 15 . 1 1 97 97 ASP C C 97 176.954 176.954 178.028 -1.074 18387 12149 1 15 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.025 -0.666 18387 12150 1 15 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.583 1.741 18387 12151 1 15 . 1 1 97 97 ASP H H 97 7.988 7.988 8.131 -0.143 18387 12152 1 15 . 1 1 98 98 VAL N N 98 118.907 118.907 120.684 -1.777 18387 12153 1 15 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.604 -0.188 18387 12154 1 15 . 1 1 98 98 VAL C C 98 176.470 176.470 177.564 -1.094 18387 12155 1 15 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.587 1.191 18387 12156 1 15 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.513 0.878 18387 12157 1 15 . 1 1 98 98 VAL H H 98 7.098 7.098 7.742 -0.644 18387 12158 1 15 . 1 1 99 99 LYS N N 99 117.909 117.909 119.105 -1.196 18387 12159 1 15 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.902 0.041 18387 12160 1 15 . 1 1 99 99 LYS C C 99 178.762 178.762 178.690 0.072 18387 12161 1 15 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.275 0.870 18387 12162 1 15 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.181 0.831 18387 12163 1 15 . 1 1 99 99 LYS H H 99 8.304 8.304 7.490 0.814 18387 12164 1 15 . 1 1 100 100 ASP N N 100 117.843 117.843 119.742 -1.899 18387 12165 1 15 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.423 0.055 18387 12166 1 15 . 1 1 100 100 ASP C C 100 179.694 179.694 178.607 1.087 18387 12167 1 15 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.106 0.420 18387 12168 1 15 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.661 0.167 18387 12169 1 15 . 1 1 100 100 ASP H H 100 8.024 8.024 7.734 0.290 18387 12170 1 15 . 1 1 101 101 VAL N N 101 122.202 122.202 120.709 1.493 18387 12171 1 15 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.915 0.080 18387 12172 1 15 . 1 1 101 101 VAL C C 101 178.533 178.533 178.822 -0.289 18387 12173 1 15 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.392 0.609 18387 12174 1 15 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.881 0.156 18387 12175 1 15 . 1 1 101 101 VAL H H 101 8.205 8.205 7.819 0.386 18387 12176 1 15 . 1 1 102 102 LEU N N 102 118.798 118.798 118.079 0.719 18387 12177 1 15 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.859 -0.079 18387 12178 1 15 . 1 1 102 102 LEU C C 102 180.254 180.254 178.780 1.474 18387 12179 1 15 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.715 1.226 18387 12180 1 15 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.454 -1.015 18387 12181 1 15 . 1 1 102 102 LEU H H 102 8.422 8.422 8.383 0.039 18387 12182 1 15 . 1 1 103 103 GLU N N 103 116.915 116.915 119.929 -3.014 18387 12183 1 15 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.974 0.161 18387 12184 1 15 . 1 1 103 103 GLU C C 103 180.910 180.910 179.311 1.599 18387 12185 1 15 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.205 0.199 18387 12186 1 15 . 1 1 103 103 GLU CB C 103 29.731 29.731 30.075 -0.344 18387 12187 1 15 . 1 1 103 103 GLU H H 103 8.262 8.262 7.738 0.524 18387 12188 1 15 . 1 1 104 104 SER N N 104 117.866 117.866 116.515 1.351 18387 12189 1 15 . 1 1 104 104 SER HA H 104 4.216 4.216 4.110 0.106 18387 12190 1 15 . 1 1 104 104 SER C C 104 175.455 175.455 176.875 -1.420 18387 12191 1 15 . 1 1 104 104 SER CA C 104 62.019 62.019 61.743 0.276 18387 12192 1 15 . 1 1 104 104 SER CB C 104 62.891 62.891 63.174 -0.283 18387 12193 1 15 . 1 1 104 104 SER H H 104 8.544 8.544 8.756 -0.212 18387 12194 1 15 . 1 1 105 105 TYR N N 105 117.278 117.278 119.807 -2.529 18387 12195 1 15 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.503 -0.231 18387 12196 1 15 . 1 1 105 105 TYR C C 105 174.750 174.750 175.058 -0.308 18387 12197 1 15 . 1 1 105 105 TYR CA C 105 59.859 59.859 59.253 0.606 18387 12198 1 15 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.503 2.208 18387 12199 1 15 . 1 1 105 105 TYR H H 105 7.691 7.691 7.839 -0.148 18387 12200 1 15 . 1 1 106 106 CYS N N 106 116.897 116.897 116.058 0.839 18387 12201 1 15 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.051 -0.156 18387 12202 1 15 . 1 1 106 106 CYS C C 106 174.056 174.056 173.714 0.342 18387 12203 1 15 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.011 -0.401 18387 12204 1 15 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.733 0.299 18387 12205 1 15 . 1 1 106 106 CYS H H 106 7.862 7.862 8.330 -0.468 18387 12206 1 15 . 1 1 107 107 ILE N N 107 118.885 118.885 122.328 -3.443 18387 12207 1 15 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.549 -0.210 18387 12208 1 15 . 1 1 107 107 ILE C C 107 176.793 176.793 175.560 1.233 18387 12209 1 15 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.109 1.636 18387 12210 1 15 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.345 0.734 18387 12211 1 15 . 1 1 107 107 ILE H H 107 7.707 7.707 7.615 0.092 18387 12212 1 15 . 1 1 108 108 VAL N N 108 123.983 123.983 127.002 -3.019 18387 12213 1 15 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.087 0.187 18387 12214 1 15 . 1 1 108 108 VAL C C 108 175.476 175.476 176.097 -0.621 18387 12215 1 15 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.209 -0.585 18387 12216 1 15 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.596 0.412 18387 12217 1 15 . 1 1 108 108 VAL H H 108 8.656 8.656 8.165 0.491 18387 12218 1 15 . 1 1 109 109 GLY N N 109 110.120 110.120 107.588 2.532 18387 12219 1 15 . 1 1 109 109 GLY C C 109 169.982 169.982 171.914 -1.932 18387 12220 1 15 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.088 -0.485 18387 12221 1 15 . 1 1 109 109 GLY H H 109 7.500 7.500 7.224 0.276 18387 12222 1 15 . 1 1 110 110 PHE N N 110 115.276 115.276 118.100 -2.824 18387 12223 1 15 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.195 -0.421 18387 12224 1 15 . 1 1 110 110 PHE C C 110 174.361 174.361 174.356 0.005 18387 12225 1 15 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.243 0.444 18387 12226 1 15 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.080 0.871 18387 12227 1 15 . 1 1 110 110 PHE H H 110 8.203 8.203 8.216 -0.013 18387 12228 1 15 . 1 1 111 111 PRO HA H 111 5.359 5.359 4.996 0.363 18387 12229 1 15 . 1 1 111 111 PRO C C 111 175.691 175.691 175.608 0.083 18387 12230 1 15 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.073 0.084 18387 12231 1 15 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.239 2.065 18387 12232 1 15 . 1 1 112 112 HIS N N 112 123.708 123.708 121.854 1.854 18387 12233 1 15 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.998 -0.035 18387 12234 1 15 . 1 1 112 112 HIS C C 112 173.649 173.649 173.893 -0.244 18387 12235 1 15 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.045 2.029 18387 12236 1 15 . 1 1 112 112 HIS CB C 112 32.197 32.197 31.537 0.660 18387 12237 1 15 . 1 1 112 112 HIS H H 112 8.952 8.952 8.391 0.561 18387 12238 1 15 . 1 1 113 113 ILE N N 113 128.596 128.596 127.647 0.949 18387 12239 1 15 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.992 0.705 18387 12240 1 15 . 1 1 113 113 ILE C C 113 176.130 176.130 174.351 1.779 18387 12241 1 15 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.930 1.065 18387 12242 1 15 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.031 -2.976 18387 12243 1 15 . 1 1 113 113 ILE H H 113 8.808 8.808 8.042 0.766 18387 12244 1 15 . 1 1 114 114 ILE N N 114 119.668 119.668 120.314 -0.646 18387 12245 1 15 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.936 0.037 18387 12246 1 15 . 1 1 114 114 ILE C C 114 173.186 173.186 173.470 -0.284 18387 12247 1 15 . 1 1 114 114 ILE CA C 114 58.730 58.730 59.107 -0.377 18387 12248 1 15 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.200 0.341 18387 12249 1 15 . 1 1 114 114 ILE H H 114 8.721 8.721 8.727 -0.006 18387 12250 1 15 . 1 1 115 115 LEU N N 115 122.770 122.770 126.038 -3.268 18387 12251 1 15 . 1 1 115 115 LEU HA H 115 5.275 5.275 4.791 0.484 18387 12252 1 15 . 1 1 115 115 LEU C C 115 173.601 173.601 174.890 -1.289 18387 12253 1 15 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.479 0.303 18387 12254 1 15 . 1 1 115 115 LEU CB C 115 46.134 46.134 43.675 2.459 18387 12255 1 15 . 1 1 115 115 LEU H H 115 8.665 8.665 8.948 -0.283 18387 12256 1 15 . 1 1 116 116 VAL N N 116 130.411 130.411 126.926 3.485 18387 12257 1 15 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.027 -0.169 18387 12258 1 15 . 1 1 116 116 VAL C C 116 174.565 174.565 176.136 -1.571 18387 12259 1 15 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.195 0.609 18387 12260 1 15 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.191 0.724 18387 12261 1 15 . 1 1 116 116 VAL H H 116 9.472 9.472 9.161 0.311 18387 12262 1 15 . 1 1 117 117 ASP N N 117 127.896 127.896 126.752 1.144 18387 12263 1 15 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.887 -0.495 18387 12264 1 15 . 1 1 117 117 ASP C C 117 176.567 176.567 175.967 0.600 18387 12265 1 15 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.148 0.452 18387 12266 1 15 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.821 -0.236 18387 12267 1 15 . 1 1 117 117 ASP H H 117 9.429 9.429 8.874 0.555 18387 12268 1 15 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.411 -0.217 18387 12269 1 15 . 1 1 118 118 PRO C C 118 177.534 177.534 177.382 0.152 18387 12270 1 15 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.951 0.214 18387 12271 1 15 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.760 1.053 18387 12272 1 15 . 1 1 119 119 GLU N N 119 114.015 114.015 115.231 -1.216 18387 12273 1 15 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.260 0.079 18387 12274 1 15 . 1 1 119 119 GLU C C 119 176.722 176.722 177.160 -0.438 18387 12275 1 15 . 1 1 119 119 GLU CA C 119 55.639 55.639 56.190 -0.551 18387 12276 1 15 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.960 0.617 18387 12277 1 15 . 1 1 119 119 GLU H H 119 7.733 7.733 8.672 -0.939 18387 12278 1 15 . 1 1 120 120 GLY N N 120 108.218 108.218 108.344 -0.126 18387 12279 1 15 . 1 1 120 120 GLY C C 120 174.110 174.110 173.590 0.520 18387 12280 1 15 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.503 -0.107 18387 12281 1 15 . 1 1 120 120 GLY H H 120 8.588 8.588 8.182 0.406 18387 12282 1 15 . 1 1 121 121 LYS N N 121 121.778 121.778 119.341 2.437 18387 12283 1 15 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.051 -0.192 18387 12284 1 15 . 1 1 121 121 LYS C C 121 176.458 176.458 175.882 0.576 18387 12285 1 15 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.168 0.794 18387 12286 1 15 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.166 -1.714 18387 12287 1 15 . 1 1 121 121 LYS H H 121 8.600 8.600 8.792 -0.192 18387 12288 1 15 . 1 1 122 122 ILE N N 122 122.058 122.058 124.701 -2.643 18387 12289 1 15 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.110 0.162 18387 12290 1 15 . 1 1 122 122 ILE C C 122 177.084 177.084 176.813 0.271 18387 12291 1 15 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.476 0.343 18387 12292 1 15 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.533 2.115 18387 12293 1 15 . 1 1 122 122 ILE H H 122 9.006 9.006 9.031 -0.025 18387 12294 1 15 . 1 1 123 123 VAL N N 123 120.561 120.561 129.873 -9.312 18387 12295 1 15 . 1 1 123 123 VAL HA H 123 4.755 4.755 3.884 0.871 18387 12296 1 15 . 1 1 123 123 VAL C C 123 175.584 175.584 175.856 -0.272 18387 12297 1 15 . 1 1 123 123 VAL CA C 123 61.151 61.151 64.986 -3.835 18387 12298 1 15 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.249 1.152 18387 12299 1 15 . 1 1 123 123 VAL H H 123 9.054 9.054 8.892 0.162 18387 12300 1 15 . 1 1 124 124 ALA N N 124 121.102 121.102 118.960 2.142 18387 12301 1 15 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.773 -0.116 18387 12302 1 15 . 1 1 124 124 ALA C C 124 174.832 174.832 174.886 -0.054 18387 12303 1 15 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.522 0.938 18387 12304 1 15 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.357 1.473 18387 12305 1 15 . 1 1 124 124 ALA H H 124 7.793 7.793 7.421 0.372 18387 12306 1 15 . 1 1 125 125 LYS N N 125 117.637 117.637 117.988 -0.351 18387 12307 1 15 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.559 0.474 18387 12308 1 15 . 1 1 125 125 LYS C C 125 173.417 173.417 175.584 -2.167 18387 12309 1 15 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.508 -0.367 18387 12310 1 15 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.148 1.503 18387 12311 1 15 . 1 1 125 125 LYS H H 125 8.872 8.872 8.187 0.685 18387 12312 1 15 . 1 1 126 126 GLU N N 126 115.236 115.236 115.147 0.089 18387 12313 1 15 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.999 -0.001 18387 12314 1 15 . 1 1 126 126 GLU C C 126 175.998 175.998 176.017 -0.019 18387 12315 1 15 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.351 -0.389 18387 12316 1 15 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.341 -0.906 18387 12317 1 15 . 1 1 126 126 GLU H H 126 7.941 7.941 8.849 -0.908 18387 12318 1 15 . 1 1 127 127 LEU N N 127 118.584 118.584 118.724 -0.140 18387 12319 1 15 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.101 0.281 18387 12320 1 15 . 1 1 127 127 LEU C C 127 176.766 176.766 176.561 0.205 18387 12321 1 15 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.626 -1.017 18387 12322 1 15 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.286 1.677 18387 12323 1 15 . 1 1 127 127 LEU H H 127 7.300 7.300 7.891 -0.591 18387 12324 1 15 . 1 1 128 128 ARG N N 128 118.625 118.625 120.818 -2.193 18387 12325 1 15 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.484 -0.009 18387 12326 1 15 . 1 1 128 128 ARG C C 128 177.113 177.113 176.728 0.385 18387 12327 1 15 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.474 -1.084 18387 12328 1 15 . 1 1 128 128 ARG CB C 128 34.612 34.612 33.131 1.481 18387 12329 1 15 . 1 1 128 128 ARG H H 128 7.929 7.929 8.346 -0.417 18387 12330 1 15 . 1 1 129 129 GLY N N 129 114.010 114.010 111.915 2.095 18387 12331 1 15 . 1 1 129 129 GLY C C 129 175.931 175.931 175.371 0.560 18387 12332 1 15 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.537 -1.076 18387 12333 1 15 . 1 1 129 129 GLY H H 129 10.649 10.649 8.610 2.039 18387 12334 1 15 . 1 1 130 130 ASP N N 130 123.975 123.975 122.588 1.387 18387 12335 1 15 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.583 -0.051 18387 12336 1 15 . 1 1 130 130 ASP C C 130 177.507 177.507 177.352 0.155 18387 12337 1 15 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.355 1.017 18387 12338 1 15 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.888 0.015 18387 12339 1 15 . 1 1 130 130 ASP H H 130 8.540 8.540 8.418 0.122 18387 12340 1 15 . 1 1 131 131 ASP N N 131 116.806 116.806 121.418 -4.612 18387 12341 1 15 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.427 0.143 18387 12342 1 15 . 1 1 131 131 ASP C C 131 179.038 179.038 178.214 0.824 18387 12343 1 15 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.117 -0.134 18387 12344 1 15 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.851 0.083 18387 12345 1 15 . 1 1 131 131 ASP H H 131 7.907 7.907 8.069 -0.162 18387 12346 1 15 . 1 1 132 132 LEU N N 132 123.869 123.869 119.988 3.881 18387 12347 1 15 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.822 -0.031 18387 12348 1 15 . 1 1 132 132 LEU C C 132 176.343 176.343 178.327 -1.984 18387 12349 1 15 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.180 1.604 18387 12350 1 15 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.679 0.089 18387 12351 1 15 . 1 1 132 132 LEU H H 132 7.542 7.542 7.556 -0.014 18387 12352 1 15 . 1 1 133 133 TYR N N 133 120.042 120.042 119.420 0.622 18387 12353 1 15 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.094 -0.098 18387 12354 1 15 . 1 1 133 133 TYR C C 133 177.426 177.426 177.347 0.079 18387 12355 1 15 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.080 0.054 18387 12356 1 15 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.775 -0.199 18387 12357 1 15 . 1 1 133 133 TYR H H 133 7.384 7.384 7.835 -0.451 18387 12358 1 15 . 1 1 134 134 ASN N N 134 114.936 114.936 115.796 -0.860 18387 12359 1 15 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.476 -0.073 18387 12360 1 15 . 1 1 134 134 ASN C C 134 178.703 178.703 177.832 0.871 18387 12361 1 15 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.371 -0.562 18387 12362 1 15 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.228 -0.020 18387 12363 1 15 . 1 1 134 134 ASN H H 134 8.399 8.399 8.888 -0.489 18387 12364 1 15 . 1 1 135 135 THR N N 135 117.387 117.387 117.120 0.267 18387 12365 1 15 . 1 1 135 135 THR HA H 135 3.920 3.920 3.995 -0.075 18387 12366 1 15 . 1 1 135 135 THR C C 135 175.323 175.323 175.961 -0.638 18387 12367 1 15 . 1 1 135 135 THR CA C 135 67.402 67.402 66.866 0.536 18387 12368 1 15 . 1 1 135 135 THR CB C 135 68.111 68.111 68.705 -0.594 18387 12369 1 15 . 1 1 135 135 THR H H 135 8.265 8.265 8.138 0.127 18387 12370 1 15 . 1 1 136 136 VAL N N 136 121.207 121.207 121.257 -0.050 18387 12371 1 15 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.155 -0.140 18387 12372 1 15 . 1 1 136 136 VAL C C 136 176.457 176.457 177.054 -0.597 18387 12373 1 15 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.584 1.688 18387 12374 1 15 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.369 0.573 18387 12375 1 15 . 1 1 136 136 VAL H H 136 7.595 7.595 7.273 0.322 18387 12376 1 15 . 1 1 137 137 GLU N N 137 118.266 118.266 119.170 -0.904 18387 12377 1 15 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.876 -1.194 18387 12378 1 15 . 1 1 137 137 GLU C C 137 177.482 177.482 178.635 -1.153 18387 12379 1 15 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.436 0.494 18387 12380 1 15 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.348 0.434 18387 12381 1 15 . 1 1 137 137 GLU H H 137 8.114 8.114 7.325 0.789 18387 12382 1 15 . 1 1 138 138 LYS N N 138 116.431 116.431 119.605 -3.174 18387 12383 1 15 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.952 -0.184 18387 12384 1 15 . 1 1 138 138 LYS C C 138 179.193 179.193 178.726 0.467 18387 12385 1 15 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.608 -0.568 18387 12386 1 15 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.253 -0.095 18387 12387 1 15 . 1 1 138 138 LYS H H 138 7.133 7.133 8.215 -1.082 18387 12388 1 15 . 1 1 139 139 PHE N N 139 116.336 116.336 117.884 -1.548 18387 12389 1 15 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.251 -0.241 18387 12390 1 15 . 1 1 139 139 PHE C C 139 177.855 177.855 176.721 1.134 18387 12391 1 15 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.081 1.302 18387 12392 1 15 . 1 1 139 139 PHE CB C 139 39.352 39.352 40.090 -0.737 18387 12393 1 15 . 1 1 139 139 PHE H H 139 7.338 7.338 7.676 -0.338 18387 12394 1 15 . 1 1 140 140 VAL N N 140 116.491 116.491 116.491 0.000 18387 12395 1 15 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.670 -0.146 18387 12396 1 15 . 1 1 140 140 VAL C C 140 177.747 177.747 176.927 0.820 18387 12397 1 15 . 1 1 140 140 VAL CA C 140 65.242 65.242 63.839 1.403 18387 12398 1 15 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.906 -0.516 18387 12399 1 15 . 1 1 140 140 VAL H H 140 8.332 8.332 8.044 0.288 18387 12400 1 15 . 1 1 141 141 ASN N N 141 116.956 116.956 117.904 -0.948 18387 12401 1 15 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.429 0.397 18387 12402 1 15 . 1 1 141 141 ASN C C 141 176.997 176.997 176.338 0.659 18387 12403 1 15 . 1 1 141 141 ASN CA C 141 53.677 53.677 55.643 -1.966 18387 12404 1 15 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.173 -0.725 18387 12405 1 15 . 1 1 141 141 ASN H H 141 7.862 7.862 8.130 -0.268 18387 12406 1 15 . 1 1 142 142 GLY N N 142 107.938 107.938 105.590 2.348 18387 12407 1 15 . 1 1 142 142 GLY C C 142 174.336 174.336 174.680 -0.344 18387 12408 1 15 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.729 1.256 18387 12409 1 15 . 1 1 142 142 GLY H H 142 7.466 7.466 8.257 -0.791 18387 12410 1 15 . 1 1 143 143 ALA N N 143 123.441 123.441 123.547 -0.106 18387 12411 1 15 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.095 0.246 18387 12412 1 15 . 1 1 143 143 ALA C C 143 178.212 178.212 177.093 1.119 18387 12413 1 15 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.211 -0.385 18387 12414 1 15 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.080 0.164 18387 12415 1 15 . 1 1 143 143 ALA H H 143 7.950 7.950 7.931 0.019 18387 12416 1 15 . 1 1 144 144 LYS N N 144 120.149 120.149 115.147 5.002 18387 12417 1 15 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.252 0.043 18387 12418 1 15 . 1 1 144 144 LYS C C 144 176.945 176.945 177.504 -0.559 18387 12419 1 15 . 1 1 144 144 LYS CA C 144 56.519 56.519 57.154 -0.634 18387 12420 1 15 . 1 1 144 144 LYS CB C 144 33.030 33.030 31.148 1.882 18387 12421 1 15 . 1 1 144 144 LYS H H 144 8.187 8.187 8.154 0.033 18387 12422 1 15 . 1 1 145 145 GLU N N 145 120.992 120.992 118.968 2.024 18387 12423 1 15 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.258 0.037 18387 12424 1 15 . 1 1 145 145 GLU C C 145 177.116 177.116 177.060 0.056 18387 12425 1 15 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.387 0.516 18387 12426 1 15 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.221 0.021 18387 12427 1 15 . 1 1 145 145 GLU H H 145 8.363 8.363 8.518 -0.155 18387 12428 1 15 . 1 1 146 146 GLY N N 146 109.467 109.467 111.032 -1.565 18387 12429 1 15 . 1 1 146 146 GLY C C 146 174.108 174.108 174.464 -0.356 18387 12430 1 15 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.669 0.732 18387 12431 1 15 . 1 1 146 146 GLY H H 146 8.371 8.371 8.033 0.338 18387 12432 1 15 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.952 -0.343 18387 12433 1 15 . 1 1 151 151 HIS C C 151 174.258 174.258 174.591 -0.333 18387 12434 1 15 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.980 0.185 18387 12435 1 15 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.986 -0.153 18387 12436 1 16 . 1 1 2 2 SER HA H 2 3.992 3.992 4.045 -0.053 18387 12437 1 16 . 1 1 2 2 SER CA C 2 57.555 57.555 60.805 -3.250 18387 12438 1 16 . 1 1 2 2 SER CB C 2 64.977 64.977 62.174 2.803 18387 12439 1 16 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.292 0.147 18387 12440 1 16 . 1 1 3 3 LEU C C 3 176.631 176.631 176.460 0.171 18387 12441 1 16 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.298 0.266 18387 12442 1 16 . 1 1 3 3 LEU CB C 3 42.724 42.724 40.036 2.688 18387 12443 1 16 . 1 1 4 4 ALA N N 4 125.483 125.483 127.406 -1.923 18387 12444 1 16 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.652 -0.273 18387 12445 1 16 . 1 1 4 4 ALA C C 4 179.642 179.642 177.422 2.220 18387 12446 1 16 . 1 1 4 4 ALA CA C 4 51.735 51.735 50.834 0.901 18387 12447 1 16 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.777 -1.025 18387 12448 1 16 . 1 1 4 4 ALA H H 4 8.483 8.483 8.248 0.235 18387 12449 1 16 . 1 1 5 5 THR HA H 5 3.845 3.845 4.411 -0.566 18387 12450 1 16 . 1 1 5 5 THR C C 5 175.487 175.487 176.412 -0.925 18387 12451 1 16 . 1 1 5 5 THR CA C 5 64.531 64.531 64.830 -0.299 18387 12452 1 16 . 1 1 5 5 THR CB C 5 68.108 68.108 68.259 -0.151 18387 12453 1 16 . 1 1 6 6 GLY N N 6 114.298 114.298 116.164 -1.866 18387 12454 1 16 . 1 1 6 6 GLY C C 6 174.324 174.324 174.342 -0.018 18387 12455 1 16 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.787 0.048 18387 12456 1 16 . 1 1 6 6 GLY H H 6 9.511 9.511 9.050 0.461 18387 12457 1 16 . 1 1 7 7 SER N N 7 115.270 115.270 118.469 -3.199 18387 12458 1 16 . 1 1 7 7 SER HA H 7 4.500 4.500 4.515 -0.015 18387 12459 1 16 . 1 1 7 7 SER C C 7 173.315 173.315 173.829 -0.514 18387 12460 1 16 . 1 1 7 7 SER CA C 7 58.915 58.915 58.797 0.118 18387 12461 1 16 . 1 1 7 7 SER CB C 7 64.308 64.308 64.195 0.113 18387 12462 1 16 . 1 1 7 7 SER H H 7 7.736 7.736 7.724 0.012 18387 12463 1 16 . 1 1 8 8 VAL N N 8 123.708 123.708 125.680 -1.972 18387 12464 1 16 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.201 -0.369 18387 12465 1 16 . 1 1 8 8 VAL C C 8 176.673 176.673 176.326 0.347 18387 12466 1 16 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.649 1.024 18387 12467 1 16 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.145 0.077 18387 12468 1 16 . 1 1 8 8 VAL H H 8 8.632 8.632 8.449 0.183 18387 12469 1 16 . 1 1 9 9 ALA N N 9 133.040 133.040 132.241 0.799 18387 12470 1 16 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.620 -0.357 18387 12471 1 16 . 1 1 9 9 ALA C C 9 175.404 175.404 176.053 -0.649 18387 12472 1 16 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.155 0.800 18387 12473 1 16 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.572 -0.541 18387 12474 1 16 . 1 1 9 9 ALA H H 9 8.448 8.448 8.765 -0.317 18387 12475 1 16 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.345 -0.014 18387 12476 1 16 . 1 1 10 10 PRO C C 10 175.071 175.071 175.970 -0.899 18387 12477 1 16 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.279 0.362 18387 12478 1 16 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.212 0.112 18387 12479 1 16 . 1 1 11 11 ALA N N 11 124.172 124.172 123.401 0.771 18387 12480 1 16 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.492 -0.248 18387 12481 1 16 . 1 1 11 11 ALA C C 11 177.688 177.688 177.773 -0.085 18387 12482 1 16 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.403 2.218 18387 12483 1 16 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.753 0.574 18387 12484 1 16 . 1 1 11 11 ALA H H 11 8.221 8.221 8.334 -0.113 18387 12485 1 16 . 1 1 12 12 ILE N N 12 117.815 117.815 127.331 -9.516 18387 12486 1 16 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.296 0.032 18387 12487 1 16 . 1 1 12 12 ILE C C 12 175.013 175.013 176.007 -0.994 18387 12488 1 16 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.940 0.227 18387 12489 1 16 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.635 5.655 18387 12490 1 16 . 1 1 12 12 ILE H H 12 7.693 7.693 8.213 -0.520 18387 12491 1 16 . 1 1 13 13 THR N N 13 121.186 121.186 123.514 -2.328 18387 12492 1 16 . 1 1 13 13 THR HA H 13 4.840 4.840 4.984 -0.144 18387 12493 1 16 . 1 1 13 13 THR C C 13 172.625 172.625 173.774 -1.149 18387 12494 1 16 . 1 1 13 13 THR CA C 13 62.297 62.297 61.477 0.820 18387 12495 1 16 . 1 1 13 13 THR CB C 13 71.585 71.585 69.340 2.245 18387 12496 1 16 . 1 1 13 13 THR H H 13 8.363 8.363 9.768 -1.405 18387 12497 1 16 . 1 1 14 14 GLY N N 14 110.785 110.785 111.961 -1.176 18387 12498 1 16 . 1 1 14 14 GLY C C 14 170.040 170.040 172.138 -2.098 18387 12499 1 16 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.898 1.492 18387 12500 1 16 . 1 1 14 14 GLY H H 14 7.993 7.993 9.196 -1.203 18387 12501 1 16 . 1 1 15 15 ILE N N 15 119.088 119.088 121.013 -1.925 18387 12502 1 16 . 1 1 15 15 ILE HA H 15 5.125 5.125 5.153 -0.028 18387 12503 1 16 . 1 1 15 15 ILE C C 15 176.359 176.359 176.017 0.342 18387 12504 1 16 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.396 -1.782 18387 12505 1 16 . 1 1 15 15 ILE CB C 15 38.639 38.639 39.085 -0.446 18387 12506 1 16 . 1 1 15 15 ILE H H 15 7.973 7.973 8.981 -1.008 18387 12507 1 16 . 1 1 16 16 ASP N N 16 126.633 126.633 127.800 -1.167 18387 12508 1 16 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.161 0.688 18387 12509 1 16 . 1 1 16 16 ASP C C 16 179.190 179.190 177.584 1.606 18387 12510 1 16 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.268 -0.388 18387 12511 1 16 . 1 1 16 16 ASP CB C 16 42.275 42.275 41.600 0.675 18387 12512 1 16 . 1 1 16 16 ASP H H 16 9.335 9.335 8.959 0.376 18387 12513 1 16 . 1 1 17 17 LEU N N 17 116.648 116.648 118.082 -1.434 18387 12514 1 16 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.290 -0.116 18387 12515 1 16 . 1 1 17 17 LEU C C 17 178.432 178.432 178.857 -0.425 18387 12516 1 16 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.975 0.006 18387 12517 1 16 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.334 1.652 18387 12518 1 16 . 1 1 17 17 LEU H H 17 8.071 8.071 8.833 -0.762 18387 12519 1 16 . 1 1 18 18 LYS N N 18 117.401 117.401 119.310 -1.909 18387 12520 1 16 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.273 0.236 18387 12521 1 16 . 1 1 18 18 LYS C C 18 176.793 176.793 177.584 -0.791 18387 12522 1 16 . 1 1 18 18 LYS CA C 18 55.435 55.435 58.015 -2.580 18387 12523 1 16 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.346 -0.283 18387 12524 1 16 . 1 1 18 18 LYS H H 18 8.207 8.207 8.318 -0.111 18387 12525 1 16 . 1 1 19 19 GLY N N 19 108.061 108.061 106.900 1.161 18387 12526 1 16 . 1 1 19 19 GLY C C 19 174.649 174.649 173.628 1.021 18387 12527 1 16 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.551 1.046 18387 12528 1 16 . 1 1 19 19 GLY H H 19 8.099 8.099 8.720 -0.621 18387 12529 1 16 . 1 1 20 20 ASN N N 20 121.012 121.012 120.120 0.892 18387 12530 1 16 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.984 -0.079 18387 12531 1 16 . 1 1 20 20 ASN C C 20 174.827 174.827 174.676 0.151 18387 12532 1 16 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.422 0.045 18387 12533 1 16 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.813 -1.137 18387 12534 1 16 . 1 1 20 20 ASN H H 20 8.945 8.945 9.108 -0.163 18387 12535 1 16 . 1 1 21 21 SER N N 21 117.285 117.285 118.072 -0.787 18387 12536 1 16 . 1 1 21 21 SER HA H 21 5.000 5.000 4.926 0.074 18387 12537 1 16 . 1 1 21 21 SER C C 21 174.911 174.911 174.600 0.311 18387 12538 1 16 . 1 1 21 21 SER CA C 21 58.730 58.730 58.417 0.312 18387 12539 1 16 . 1 1 21 21 SER CB C 21 63.162 63.162 62.827 0.335 18387 12540 1 16 . 1 1 21 21 SER H H 21 8.740 8.740 8.729 0.011 18387 12541 1 16 . 1 1 22 22 VAL N N 22 128.665 128.665 126.823 1.842 18387 12542 1 16 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.277 0.103 18387 12543 1 16 . 1 1 22 22 VAL C C 22 176.276 176.276 175.122 1.154 18387 12544 1 16 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.526 1.427 18387 12545 1 16 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.758 0.824 18387 12546 1 16 . 1 1 22 22 VAL H H 22 9.125 9.125 9.064 0.061 18387 12547 1 16 . 1 1 23 23 SER N N 23 127.457 127.457 119.719 7.738 18387 12548 1 16 . 1 1 23 23 SER HA H 23 5.878 5.878 5.515 0.363 18387 12549 1 16 . 1 1 23 23 SER C C 23 174.436 174.436 175.767 -1.331 18387 12550 1 16 . 1 1 23 23 SER CA C 23 57.101 57.101 56.393 0.708 18387 12551 1 16 . 1 1 23 23 SER CB C 23 66.078 66.078 64.825 1.253 18387 12552 1 16 . 1 1 23 23 SER H H 23 8.971 8.971 8.608 0.363 18387 12553 1 16 . 1 1 24 24 LEU N N 24 126.734 126.734 117.564 9.170 18387 12554 1 16 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.756 -0.289 18387 12555 1 16 . 1 1 24 24 LEU C C 24 179.852 179.852 177.890 1.962 18387 12556 1 16 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.192 1.011 18387 12557 1 16 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.531 0.447 18387 12558 1 16 . 1 1 24 24 LEU H H 24 8.450 8.450 8.038 0.412 18387 12559 1 16 . 1 1 25 25 ASN N N 25 115.642 115.642 119.044 -3.402 18387 12560 1 16 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.437 -0.195 18387 12561 1 16 . 1 1 25 25 ASN C C 25 176.246 176.246 176.907 -0.661 18387 12562 1 16 . 1 1 25 25 ASN CA C 25 55.370 55.370 56.061 -0.691 18387 12563 1 16 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.956 0.815 18387 12564 1 16 . 1 1 25 25 ASN H H 25 8.505 8.505 8.617 -0.112 18387 12565 1 16 . 1 1 26 26 ASP N N 26 119.722 119.722 120.243 -0.521 18387 12566 1 16 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.270 -0.065 18387 12567 1 16 . 1 1 26 26 ASP C C 26 176.708 176.708 176.556 0.152 18387 12568 1 16 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.746 -0.221 18387 12569 1 16 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.136 -0.856 18387 12570 1 16 . 1 1 26 26 ASP H H 26 7.731 7.731 8.070 -0.339 18387 12571 1 16 . 1 1 27 27 PHE N N 27 116.827 116.827 115.530 1.297 18387 12572 1 16 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.700 -0.220 18387 12573 1 16 . 1 1 27 27 PHE C C 27 174.227 174.227 175.583 -1.356 18387 12574 1 16 . 1 1 27 27 PHE CA C 27 57.071 57.071 56.788 0.283 18387 12575 1 16 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.369 0.350 18387 12576 1 16 . 1 1 27 27 PHE H H 27 7.390 7.390 7.310 0.080 18387 12577 1 16 . 1 1 28 28 LYS N N 28 120.357 120.357 120.973 -0.616 18387 12578 1 16 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.076 0.311 18387 12579 1 16 . 1 1 28 28 LYS C C 28 177.845 177.845 177.417 0.428 18387 12580 1 16 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.793 0.209 18387 12581 1 16 . 1 1 28 28 LYS CB C 28 32.544 32.544 33.053 -0.509 18387 12582 1 16 . 1 1 28 28 LYS H H 28 6.883 6.883 7.602 -0.719 18387 12583 1 16 . 1 1 29 29 GLY N N 29 112.653 112.653 107.681 4.972 18387 12584 1 16 . 1 1 29 29 GLY C C 29 173.799 173.799 173.548 0.251 18387 12585 1 16 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.419 -0.430 18387 12586 1 16 . 1 1 29 29 GLY H H 29 8.930 8.930 8.537 0.393 18387 12587 1 16 . 1 1 30 30 LYS N N 30 120.516 120.516 117.434 3.082 18387 12588 1 16 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.403 0.232 18387 12589 1 16 . 1 1 30 30 LYS C C 30 176.505 176.505 174.554 1.951 18387 12590 1 16 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.310 0.870 18387 12591 1 16 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.728 -0.872 18387 12592 1 16 . 1 1 30 30 LYS H H 30 8.098 8.098 7.293 0.805 18387 12593 1 16 . 1 1 31 31 TYR N N 31 117.383 117.383 119.931 -2.548 18387 12594 1 16 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.879 -0.225 18387 12595 1 16 . 1 1 31 31 TYR C C 31 175.551 175.551 175.916 -0.365 18387 12596 1 16 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.635 1.530 18387 12597 1 16 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.124 3.069 18387 12598 1 16 . 1 1 31 31 TYR H H 31 8.263 8.263 8.359 -0.096 18387 12599 1 16 . 1 1 32 32 VAL N N 32 120.900 120.900 125.692 -4.792 18387 12600 1 16 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.393 0.046 18387 12601 1 16 . 1 1 32 32 VAL C C 32 175.975 175.975 174.864 1.111 18387 12602 1 16 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.575 -1.869 18387 12603 1 16 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.567 2.940 18387 12604 1 16 . 1 1 32 32 VAL H H 32 9.244 9.244 8.646 0.598 18387 12605 1 16 . 1 1 33 33 LEU N N 33 130.058 130.058 130.228 -0.170 18387 12606 1 16 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.912 0.261 18387 12607 1 16 . 1 1 33 33 LEU C C 33 174.693 174.693 175.026 -0.333 18387 12608 1 16 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.638 -0.290 18387 12609 1 16 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.576 0.745 18387 12610 1 16 . 1 1 33 33 LEU H H 33 8.161 8.161 8.734 -0.573 18387 12611 1 16 . 1 1 34 34 VAL N N 34 129.232 129.232 129.153 0.079 18387 12612 1 16 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.556 0.426 18387 12613 1 16 . 1 1 34 34 VAL C C 34 174.285 174.285 174.548 -0.263 18387 12614 1 16 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.983 0.523 18387 12615 1 16 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.007 0.371 18387 12616 1 16 . 1 1 34 34 VAL H H 34 9.296 9.296 9.107 0.189 18387 12617 1 16 . 1 1 35 35 ASP N N 35 123.675 123.675 129.077 -5.402 18387 12618 1 16 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.924 0.425 18387 12619 1 16 . 1 1 35 35 ASP C C 35 174.258 174.258 175.387 -1.129 18387 12620 1 16 . 1 1 35 35 ASP CA C 35 51.054 51.054 54.144 -3.090 18387 12621 1 16 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.671 -1.209 18387 12622 1 16 . 1 1 35 35 ASP H H 35 8.015 8.015 8.245 -0.230 18387 12623 1 16 . 1 1 36 36 PHE N N 36 126.959 126.959 124.847 2.112 18387 12624 1 16 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.604 0.331 18387 12625 1 16 . 1 1 36 36 PHE C C 36 175.432 175.432 175.601 -0.169 18387 12626 1 16 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.806 0.289 18387 12627 1 16 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.174 -0.144 18387 12628 1 16 . 1 1 36 36 PHE H H 36 9.171 9.171 9.388 -0.217 18387 12629 1 16 . 1 1 37 37 TRP N N 37 120.839 120.839 122.144 -1.305 18387 12630 1 16 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.277 0.480 18387 12631 1 16 . 1 1 37 37 TRP C C 37 172.412 172.412 173.253 -0.841 18387 12632 1 16 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.903 0.007 18387 12633 1 16 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.746 -0.066 18387 12634 1 16 . 1 1 37 37 TRP H H 37 9.280 9.280 9.414 -0.134 18387 12635 1 16 . 1 1 38 38 PHE N N 38 109.215 109.215 111.978 -2.763 18387 12636 1 16 . 1 1 38 38 PHE HA H 38 3.933 3.933 3.952 -0.019 18387 12637 1 16 . 1 1 38 38 PHE C C 38 176.141 176.141 174.299 1.842 18387 12638 1 16 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.941 0.070 18387 12639 1 16 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.033 -0.414 18387 12640 1 16 . 1 1 38 38 PHE H H 38 7.062 7.062 8.116 -1.054 18387 12641 1 16 . 1 1 39 39 ALA N N 39 125.193 125.193 123.748 1.445 18387 12642 1 16 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.402 -0.337 18387 12643 1 16 . 1 1 39 39 ALA C C 39 179.349 179.349 179.043 0.306 18387 12644 1 16 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.664 1.400 18387 12645 1 16 . 1 1 39 39 ALA CB C 39 19.897 19.897 19.032 0.865 18387 12646 1 16 . 1 1 39 39 ALA H H 39 10.355 10.355 9.388 0.967 18387 12647 1 16 . 1 1 40 40 GLY N N 40 103.437 103.437 106.096 -2.659 18387 12648 1 16 . 1 1 40 40 GLY C C 40 172.732 172.732 174.740 -2.008 18387 12649 1 16 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.503 -0.567 18387 12650 1 16 . 1 1 40 40 GLY H H 40 8.583 8.583 8.733 -0.150 18387 12651 1 16 . 1 1 41 41 CYS N N 41 124.859 124.859 119.823 5.036 18387 12652 1 16 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.522 -0.118 18387 12653 1 16 . 1 1 41 41 CYS C C 41 176.620 176.620 175.152 1.468 18387 12654 1 16 . 1 1 41 41 CYS CA C 41 58.375 58.375 58.170 0.205 18387 12655 1 16 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.472 -0.096 18387 12656 1 16 . 1 1 41 41 CYS H H 41 6.946 6.946 7.358 -0.412 18387 12657 1 16 . 1 1 42 42 SER HA H 42 4.040 4.040 4.469 -0.429 18387 12658 1 16 . 1 1 42 42 SER CA C 42 61.552 61.552 61.048 0.503 18387 12659 1 16 . 1 1 42 42 SER CB C 42 62.675 62.675 63.412 -0.737 18387 12660 1 16 . 1 1 43 43 TRP N N 43 129.748 129.748 123.983 5.765 18387 12661 1 16 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.456 0.093 18387 12662 1 16 . 1 1 43 43 TRP C C 43 180.400 180.400 178.147 2.253 18387 12663 1 16 . 1 1 43 43 TRP CA C 43 60.249 60.249 60.515 -0.266 18387 12664 1 16 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.564 0.028 18387 12665 1 16 . 1 1 44 44 CYS N N 44 124.462 124.462 117.449 7.013 18387 12666 1 16 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.064 0.187 18387 12667 1 16 . 1 1 44 44 CYS C C 44 178.643 178.643 177.048 1.595 18387 12668 1 16 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.733 2.116 18387 12669 1 16 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.029 3.393 18387 12670 1 16 . 1 1 44 44 CYS H H 44 9.591 9.591 8.498 1.093 18387 12671 1 16 . 1 1 45 45 ARG N N 45 117.248 117.248 117.375 -0.127 18387 12672 1 16 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.419 -0.243 18387 12673 1 16 . 1 1 45 45 ARG C C 45 180.302 180.302 177.485 2.817 18387 12674 1 16 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.729 -0.786 18387 12675 1 16 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.607 -1.976 18387 12676 1 16 . 1 1 45 45 ARG H H 45 7.955 7.955 7.377 0.578 18387 12677 1 16 . 1 1 46 46 LYS N N 46 120.318 120.318 116.677 3.641 18387 12678 1 16 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.139 0.133 18387 12679 1 16 . 1 1 46 46 LYS C C 46 177.755 177.755 177.078 0.677 18387 12680 1 16 . 1 1 46 46 LYS CA C 46 58.769 58.769 56.830 1.939 18387 12681 1 16 . 1 1 46 46 LYS CB C 46 33.157 33.157 31.865 1.292 18387 12682 1 16 . 1 1 46 46 LYS H H 46 8.129 8.129 7.490 0.639 18387 12683 1 16 . 1 1 47 47 GLU N N 47 114.278 114.278 117.859 -3.581 18387 12684 1 16 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.419 0.472 18387 12685 1 16 . 1 1 47 47 GLU C C 47 178.701 178.701 177.953 0.748 18387 12686 1 16 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.768 -1.214 18387 12687 1 16 . 1 1 47 47 GLU CB C 47 29.766 29.766 30.322 -0.556 18387 12688 1 16 . 1 1 47 47 GLU H H 47 7.386 7.386 7.348 0.038 18387 12689 1 16 . 1 1 48 48 THR N N 48 115.665 115.665 117.621 -1.956 18387 12690 1 16 . 1 1 48 48 THR HA H 48 4.048 4.048 4.068 -0.020 18387 12691 1 16 . 1 1 48 48 THR C C 48 172.392 172.392 173.967 -1.575 18387 12692 1 16 . 1 1 48 48 THR CA C 48 69.426 69.426 68.863 0.563 18387 12693 1 16 . 1 1 48 48 THR CB C 48 66.906 66.906 67.009 -0.103 18387 12694 1 16 . 1 1 48 48 THR H H 48 7.810 7.810 7.648 0.162 18387 12695 1 16 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.061 0.228 18387 12696 1 16 . 1 1 49 49 PRO C C 49 179.828 179.828 178.692 1.136 18387 12697 1 16 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.139 0.460 18387 12698 1 16 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.799 0.235 18387 12699 1 16 . 1 1 50 50 TYR N N 50 116.950 116.950 117.131 -0.181 18387 12700 1 16 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.229 -0.091 18387 12701 1 16 . 1 1 50 50 TYR C C 50 179.488 179.488 178.733 0.755 18387 12702 1 16 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.038 0.097 18387 12703 1 16 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.791 0.510 18387 12704 1 16 . 1 1 50 50 TYR H H 50 7.071 7.071 7.191 -0.120 18387 12705 1 16 . 1 1 51 51 LEU N N 51 123.989 123.989 122.068 1.921 18387 12706 1 16 . 1 1 51 51 LEU HA H 51 3.670 3.670 4.021 -0.351 18387 12707 1 16 . 1 1 51 51 LEU C C 51 178.072 178.072 179.177 -1.105 18387 12708 1 16 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.517 1.159 18387 12709 1 16 . 1 1 51 51 LEU CB C 51 42.617 42.617 40.881 1.736 18387 12710 1 16 . 1 1 51 51 LEU H H 51 8.243 8.243 8.619 -0.376 18387 12711 1 16 . 1 1 52 52 LEU N N 52 119.857 119.857 120.018 -0.161 18387 12712 1 16 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.320 0.007 18387 12713 1 16 . 1 1 52 52 LEU C C 52 178.704 178.704 178.529 0.175 18387 12714 1 16 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.538 0.037 18387 12715 1 16 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.748 0.990 18387 12716 1 16 . 1 1 52 52 LEU H H 52 9.085 9.085 8.781 0.304 18387 12717 1 16 . 1 1 53 53 LYS N N 53 118.658 118.658 119.565 -0.907 18387 12718 1 16 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.428 -0.319 18387 12719 1 16 . 1 1 53 53 LYS C C 53 179.786 179.786 179.207 0.579 18387 12720 1 16 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.592 0.129 18387 12721 1 16 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.111 1.048 18387 12722 1 16 . 1 1 53 53 LYS H H 53 7.807 7.807 7.772 0.035 18387 12723 1 16 . 1 1 54 54 THR N N 54 116.869 116.869 115.968 0.901 18387 12724 1 16 . 1 1 54 54 THR HA H 54 3.965 3.965 4.488 -0.523 18387 12725 1 16 . 1 1 54 54 THR C C 54 175.328 175.328 176.389 -1.061 18387 12726 1 16 . 1 1 54 54 THR CA C 54 67.683 67.683 67.561 0.122 18387 12727 1 16 . 1 1 54 54 THR CB C 54 68.452 68.452 68.965 -0.513 18387 12728 1 16 . 1 1 54 54 THR H H 54 7.771 7.771 8.457 -0.686 18387 12729 1 16 . 1 1 55 55 TYR N N 55 122.202 122.202 122.373 -0.171 18387 12730 1 16 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.169 0.103 18387 12731 1 16 . 1 1 55 55 TYR C C 55 176.809 176.809 177.121 -0.312 18387 12732 1 16 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.789 0.948 18387 12733 1 16 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.625 0.655 18387 12734 1 16 . 1 1 55 55 TYR H H 55 9.145 9.145 8.225 0.920 18387 12735 1 16 . 1 1 56 56 ASN N N 56 113.858 113.858 116.332 -2.474 18387 12736 1 16 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.286 -0.023 18387 12737 1 16 . 1 1 56 56 ASN C C 56 177.427 177.427 176.723 0.704 18387 12738 1 16 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.918 0.012 18387 12739 1 16 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.443 -0.489 18387 12740 1 16 . 1 1 56 56 ASN H H 56 8.850 8.850 8.653 0.197 18387 12741 1 16 . 1 1 57 57 ALA N N 57 118.829 118.829 120.667 -1.838 18387 12742 1 16 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.241 -0.177 18387 12743 1 16 . 1 1 57 57 ALA C C 57 180.445 180.445 177.810 2.635 18387 12744 1 16 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.882 0.469 18387 12745 1 16 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.345 -0.151 18387 12746 1 16 . 1 1 57 57 ALA H H 57 7.436 7.436 8.430 -0.994 18387 12747 1 16 . 1 1 58 58 PHE N N 58 112.082 112.082 115.957 -3.875 18387 12748 1 16 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.508 0.413 18387 12749 1 16 . 1 1 58 58 PHE C C 58 176.999 176.999 177.387 -0.388 18387 12750 1 16 . 1 1 58 58 PHE CA C 58 58.067 58.067 58.988 -0.921 18387 12751 1 16 . 1 1 58 58 PHE CB C 58 40.490 40.490 40.258 0.232 18387 12752 1 16 . 1 1 58 58 PHE H H 58 7.480 7.480 7.642 -0.162 18387 12753 1 16 . 1 1 59 59 LYS N N 59 120.666 120.666 120.730 -0.064 18387 12754 1 16 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.425 0.378 18387 12755 1 16 . 1 1 59 59 LYS C C 59 177.157 177.157 177.032 0.125 18387 12756 1 16 . 1 1 59 59 LYS CA C 59 59.081 59.081 58.989 0.092 18387 12757 1 16 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.777 -1.210 18387 12758 1 16 . 1 1 59 59 LYS H H 59 8.411 8.411 8.091 0.320 18387 12759 1 16 . 1 1 60 60 ASP N N 60 118.908 118.908 118.133 0.775 18387 12760 1 16 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.843 0.282 18387 12761 1 16 . 1 1 60 60 ASP C C 60 176.889 176.889 176.055 0.834 18387 12762 1 16 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.065 -0.416 18387 12763 1 16 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.347 0.365 18387 12764 1 16 . 1 1 60 60 ASP H H 60 8.574 8.574 8.259 0.315 18387 12765 1 16 . 1 1 61 61 LYS N N 61 121.021 121.021 119.514 1.507 18387 12766 1 16 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.692 0.022 18387 12767 1 16 . 1 1 61 61 LYS C C 61 175.968 175.968 176.672 -0.704 18387 12768 1 16 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.703 -0.566 18387 12769 1 16 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.045 0.033 18387 12770 1 16 . 1 1 61 61 LYS H H 61 8.278 8.278 8.041 0.237 18387 12771 1 16 . 1 1 62 62 GLY C C 62 173.837 173.837 173.349 0.488 18387 12772 1 16 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.179 1.871 18387 12773 1 16 . 1 1 63 63 PHE N N 63 120.476 120.476 120.634 -0.158 18387 12774 1 16 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.653 0.380 18387 12775 1 16 . 1 1 63 63 PHE C C 63 173.613 173.613 173.323 0.290 18387 12776 1 16 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.453 -0.603 18387 12777 1 16 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.924 -0.249 18387 12778 1 16 . 1 1 63 63 PHE H H 63 7.413 7.413 7.642 -0.229 18387 12779 1 16 . 1 1 64 64 THR N N 64 119.903 119.903 116.866 3.037 18387 12780 1 16 . 1 1 64 64 THR HA H 64 4.097 4.097 4.852 -0.755 18387 12781 1 16 . 1 1 64 64 THR C C 64 170.397 170.397 172.567 -2.170 18387 12782 1 16 . 1 1 64 64 THR CA C 64 60.261 60.261 60.115 0.145 18387 12783 1 16 . 1 1 64 64 THR CB C 64 69.507 69.507 72.176 -2.669 18387 12784 1 16 . 1 1 64 64 THR H H 64 7.665 7.665 8.360 -0.695 18387 12785 1 16 . 1 1 65 65 ILE N N 65 117.277 117.277 122.996 -5.719 18387 12786 1 16 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.411 0.065 18387 12787 1 16 . 1 1 65 65 ILE C C 65 173.056 173.056 174.087 -1.031 18387 12788 1 16 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.709 -1.001 18387 12789 1 16 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.535 0.311 18387 12790 1 16 . 1 1 65 65 ILE H H 65 7.321 7.321 8.827 -1.506 18387 12791 1 16 . 1 1 66 66 TYR N N 66 131.968 131.968 129.578 2.390 18387 12792 1 16 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.973 0.274 18387 12793 1 16 . 1 1 66 66 TYR C C 66 174.074 174.074 174.967 -0.893 18387 12794 1 16 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.459 -0.494 18387 12795 1 16 . 1 1 66 66 TYR CB C 66 41.117 41.117 40.008 1.109 18387 12796 1 16 . 1 1 66 66 TYR H H 66 9.038 9.038 9.248 -0.210 18387 12797 1 16 . 1 1 67 67 GLY N N 67 114.364 114.364 115.902 -1.538 18387 12798 1 16 . 1 1 67 67 GLY C C 67 172.461 172.461 172.549 -0.088 18387 12799 1 16 . 1 1 67 67 GLY CA C 67 45.000 45.000 45.167 -0.167 18387 12800 1 16 . 1 1 67 67 GLY H H 67 9.188 9.188 9.342 -0.154 18387 12801 1 16 . 1 1 68 68 VAL N N 68 126.938 126.938 128.353 -1.415 18387 12802 1 16 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.198 -0.062 18387 12803 1 16 . 1 1 68 68 VAL C C 68 173.822 173.822 174.726 -0.904 18387 12804 1 16 . 1 1 68 68 VAL CA C 68 61.498 61.498 62.455 -0.957 18387 12805 1 16 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.306 1.252 18387 12806 1 16 . 1 1 68 68 VAL H H 68 9.309 9.309 8.993 0.316 18387 12807 1 16 . 1 1 69 69 SER N N 69 118.813 118.813 123.901 -5.088 18387 12808 1 16 . 1 1 69 69 SER HA H 69 5.527 5.527 5.009 0.518 18387 12809 1 16 . 1 1 69 69 SER C C 69 175.753 175.753 173.221 2.532 18387 12810 1 16 . 1 1 69 69 SER CA C 69 54.407 54.407 56.922 -2.515 18387 12811 1 16 . 1 1 69 69 SER CB C 69 63.630 63.630 64.493 -0.863 18387 12812 1 16 . 1 1 69 69 SER H H 69 8.124 8.124 9.104 -0.980 18387 12813 1 16 . 1 1 70 70 THR N N 70 113.861 113.861 118.531 -4.670 18387 12814 1 16 . 1 1 70 70 THR HA H 70 4.381 4.381 4.340 0.041 18387 12815 1 16 . 1 1 70 70 THR C C 70 175.001 175.001 172.991 2.010 18387 12816 1 16 . 1 1 70 70 THR CA C 70 60.259 60.259 59.197 1.062 18387 12817 1 16 . 1 1 70 70 THR CB C 70 67.291 67.291 68.717 -1.426 18387 12818 1 16 . 1 1 70 70 THR H H 70 7.656 7.656 8.285 -0.629 18387 12819 1 16 . 1 1 71 71 ASP N N 71 125.133 125.133 121.030 4.103 18387 12820 1 16 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.383 -0.313 18387 12821 1 16 . 1 1 71 71 ASP C C 71 175.685 175.685 176.182 -0.497 18387 12822 1 16 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.907 2.704 18387 12823 1 16 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.742 0.627 18387 12824 1 16 . 1 1 71 71 ASP H H 71 8.931 8.931 7.583 1.348 18387 12825 1 16 . 1 1 72 72 ARG N N 72 118.814 118.814 120.187 -1.373 18387 12826 1 16 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.418 -0.223 18387 12827 1 16 . 1 1 72 72 ARG C C 72 177.300 177.300 176.119 1.181 18387 12828 1 16 . 1 1 72 72 ARG CA C 72 56.809 56.809 56.100 0.709 18387 12829 1 16 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.958 0.153 18387 12830 1 16 . 1 1 72 72 ARG H H 72 8.057 8.057 8.403 -0.346 18387 12831 1 16 . 1 1 73 73 ARG N N 73 118.174 118.174 119.784 -1.610 18387 12832 1 16 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.697 0.057 18387 12833 1 16 . 1 1 73 73 ARG C C 73 176.503 176.503 175.422 1.081 18387 12834 1 16 . 1 1 73 73 ARG CA C 73 54.536 54.536 55.012 -0.476 18387 12835 1 16 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.816 -2.788 18387 12836 1 16 . 1 1 73 73 ARG H H 73 8.639 8.639 8.250 0.389 18387 12837 1 16 . 1 1 74 74 GLU N N 74 127.609 127.609 123.537 4.072 18387 12838 1 16 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.306 -0.227 18387 12839 1 16 . 1 1 74 74 GLU C C 74 178.107 178.107 177.928 0.179 18387 12840 1 16 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.914 -0.129 18387 12841 1 16 . 1 1 74 74 GLU CB C 74 30.098 30.098 30.010 0.088 18387 12842 1 16 . 1 1 74 74 GLU H H 74 9.129 9.129 8.943 0.186 18387 12843 1 16 . 1 1 75 75 GLU N N 75 117.874 117.874 118.361 -0.487 18387 12844 1 16 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.077 0.023 18387 12845 1 16 . 1 1 75 75 GLU C C 75 178.993 178.993 179.091 -0.098 18387 12846 1 16 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.073 0.054 18387 12847 1 16 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.881 0.410 18387 12848 1 16 . 1 1 75 75 GLU H H 75 9.745 9.745 8.784 0.961 18387 12849 1 16 . 1 1 76 76 ASP N N 76 119.182 119.182 119.602 -0.420 18387 12850 1 16 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.510 -0.144 18387 12851 1 16 . 1 1 76 76 ASP C C 76 178.107 178.107 177.907 0.200 18387 12852 1 16 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.372 -0.399 18387 12853 1 16 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.882 -0.362 18387 12854 1 16 . 1 1 76 76 ASP H H 76 7.004 7.004 8.341 -1.337 18387 12855 1 16 . 1 1 77 77 TRP N N 77 123.008 123.008 122.639 0.369 18387 12856 1 16 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.316 -0.167 18387 12857 1 16 . 1 1 77 77 TRP C C 77 176.236 176.236 177.977 -1.741 18387 12858 1 16 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.443 0.040 18387 12859 1 16 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.287 -0.752 18387 12860 1 16 . 1 1 77 77 TRP H H 77 7.112 7.112 7.984 -0.872 18387 12861 1 16 . 1 1 78 78 LYS N N 78 115.727 115.727 118.222 -2.495 18387 12862 1 16 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.529 -0.284 18387 12863 1 16 . 1 1 78 78 LYS C C 78 179.426 179.426 178.875 0.551 18387 12864 1 16 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.232 1.200 18387 12865 1 16 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.808 0.937 18387 12866 1 16 . 1 1 78 78 LYS H H 78 8.431 8.431 8.501 -0.070 18387 12867 1 16 . 1 1 79 79 LYS N N 79 118.321 118.321 119.874 -1.553 18387 12868 1 16 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.946 0.074 18387 12869 1 16 . 1 1 79 79 LYS C C 79 178.239 178.239 178.462 -0.223 18387 12870 1 16 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.467 -0.400 18387 12871 1 16 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.494 -0.031 18387 12872 1 16 . 1 1 79 79 LYS H H 79 7.690 7.690 7.885 -0.195 18387 12873 1 16 . 1 1 80 80 ALA N N 80 120.679 120.679 122.208 -1.529 18387 12874 1 16 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.383 -0.228 18387 12875 1 16 . 1 1 80 80 ALA C C 80 178.811 178.811 180.055 -1.244 18387 12876 1 16 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.953 0.134 18387 12877 1 16 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.567 0.191 18387 12878 1 16 . 1 1 80 80 ALA H H 80 7.560 7.560 8.271 -0.711 18387 12879 1 16 . 1 1 81 81 ILE N N 81 118.019 118.019 118.961 -0.942 18387 12880 1 16 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.546 -0.144 18387 12881 1 16 . 1 1 81 81 ILE C C 81 178.113 178.113 178.226 -0.113 18387 12882 1 16 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.718 -0.198 18387 12883 1 16 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.386 0.818 18387 12884 1 16 . 1 1 81 81 ILE H H 81 7.514 7.514 7.944 -0.430 18387 12885 1 16 . 1 1 82 82 GLU N N 82 117.252 117.252 120.155 -2.903 18387 12886 1 16 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.868 0.226 18387 12887 1 16 . 1 1 82 82 GLU C C 82 179.558 179.558 179.018 0.540 18387 12888 1 16 . 1 1 82 82 GLU CA C 82 58.580 58.580 59.504 -0.924 18387 12889 1 16 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.188 0.195 18387 12890 1 16 . 1 1 82 82 GLU H H 82 7.401 7.401 7.579 -0.178 18387 12891 1 16 . 1 1 83 83 GLU N N 83 119.340 119.340 119.122 0.218 18387 12892 1 16 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.946 -0.048 18387 12893 1 16 . 1 1 83 83 GLU C C 83 178.740 178.740 179.266 -0.526 18387 12894 1 16 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.091 -0.092 18387 12895 1 16 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.602 0.318 18387 12896 1 16 . 1 1 83 83 GLU H H 83 8.191 8.191 8.423 -0.232 18387 12897 1 16 . 1 1 84 84 ASP N N 84 118.449 118.449 115.899 2.550 18387 12898 1 16 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.449 -0.175 18387 12899 1 16 . 1 1 84 84 ASP C C 84 175.597 175.597 175.852 -0.255 18387 12900 1 16 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.885 0.162 18387 12901 1 16 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.338 -1.442 18387 12902 1 16 . 1 1 84 84 ASP H H 84 8.252 8.252 8.184 0.068 18387 12903 1 16 . 1 1 85 85 LYS N N 85 116.410 116.410 115.836 0.574 18387 12904 1 16 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.374 -0.201 18387 12905 1 16 . 1 1 85 85 LYS C C 85 176.856 176.856 174.852 2.004 18387 12906 1 16 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.175 -0.202 18387 12907 1 16 . 1 1 85 85 LYS CB C 85 28.868 28.868 28.947 -0.079 18387 12908 1 16 . 1 1 85 85 LYS H H 85 7.890 7.890 7.511 0.379 18387 12909 1 16 . 1 1 86 86 SER N N 86 112.295 112.295 113.714 -1.419 18387 12910 1 16 . 1 1 86 86 SER HA H 86 3.139 3.139 3.330 -0.191 18387 12911 1 16 . 1 1 86 86 SER C C 86 175.805 175.805 173.029 2.776 18387 12912 1 16 . 1 1 86 86 SER CA C 86 53.637 53.637 56.998 -3.361 18387 12913 1 16 . 1 1 86 86 SER CB C 86 60.736 60.736 61.422 -0.687 18387 12914 1 16 . 1 1 86 86 SER H H 86 7.327 7.327 7.178 0.149 18387 12915 1 16 . 1 1 87 87 TYR N N 87 120.962 120.962 126.137 -5.175 18387 12916 1 16 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.197 0.108 18387 12917 1 16 . 1 1 87 87 TYR C C 87 177.064 177.064 174.072 2.992 18387 12918 1 16 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.268 -0.045 18387 12919 1 16 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.504 -0.151 18387 12920 1 16 . 1 1 87 87 TYR H H 87 6.933 6.933 7.462 -0.529 18387 12921 1 16 . 1 1 88 88 TRP N N 88 118.597 118.597 120.122 -1.525 18387 12922 1 16 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.707 0.144 18387 12923 1 16 . 1 1 88 88 TRP C C 88 175.456 175.456 173.862 1.594 18387 12924 1 16 . 1 1 88 88 TRP CA C 88 56.236 56.236 55.323 0.913 18387 12925 1 16 . 1 1 88 88 TRP CB C 88 25.727 25.727 30.152 -4.425 18387 12926 1 16 . 1 1 88 88 TRP H H 88 6.552 6.552 7.038 -0.486 18387 12927 1 16 . 1 1 89 89 ASN N N 89 118.067 118.067 120.941 -2.874 18387 12928 1 16 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.796 0.253 18387 12929 1 16 . 1 1 89 89 ASN C C 89 173.773 173.773 174.743 -0.970 18387 12930 1 16 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.693 1.764 18387 12931 1 16 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.490 0.707 18387 12932 1 16 . 1 1 89 89 ASN H H 89 7.864 7.864 8.724 -0.860 18387 12933 1 16 . 1 1 90 90 GLN N N 90 125.392 125.392 122.127 3.265 18387 12934 1 16 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.322 0.175 18387 12935 1 16 . 1 1 90 90 GLN C C 90 176.491 176.491 175.097 1.394 18387 12936 1 16 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.902 0.558 18387 12937 1 16 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.281 -2.054 18387 12938 1 16 . 1 1 90 90 GLN H H 90 7.904 7.904 8.569 -0.665 18387 12939 1 16 . 1 1 91 91 VAL N N 91 114.434 114.434 116.742 -2.308 18387 12940 1 16 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.960 0.520 18387 12941 1 16 . 1 1 91 91 VAL C C 91 174.248 174.248 173.081 1.167 18387 12942 1 16 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.917 -0.911 18387 12943 1 16 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.367 1.271 18387 12944 1 16 . 1 1 91 91 VAL H H 91 9.585 9.585 9.193 0.393 18387 12945 1 16 . 1 1 92 92 LEU N N 92 126.910 126.910 123.918 2.992 18387 12946 1 16 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.926 -0.857 18387 12947 1 16 . 1 1 92 92 LEU C C 92 177.696 177.696 176.010 1.686 18387 12948 1 16 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.228 0.616 18387 12949 1 16 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.801 -0.855 18387 12950 1 16 . 1 1 92 92 LEU H H 92 8.941 8.941 8.719 0.222 18387 12951 1 16 . 1 1 93 93 LEU N N 93 125.673 125.673 126.226 -0.553 18387 12952 1 16 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.265 0.135 18387 12953 1 16 . 1 1 93 93 LEU C C 93 177.291 177.291 176.813 0.478 18387 12954 1 16 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.517 -0.566 18387 12955 1 16 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.960 1.219 18387 12956 1 16 . 1 1 93 93 LEU H H 93 8.038 8.038 8.172 -0.134 18387 12957 1 16 . 1 1 94 94 GLN N N 94 122.206 122.206 120.075 2.131 18387 12958 1 16 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.364 -0.127 18387 12959 1 16 . 1 1 94 94 GLN C C 94 178.246 178.246 176.828 1.418 18387 12960 1 16 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.272 0.503 18387 12961 1 16 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.885 -0.630 18387 12962 1 16 . 1 1 94 94 GLN H H 94 9.298 9.298 8.528 0.770 18387 12963 1 16 . 1 1 95 95 LYS N N 95 122.668 122.668 120.001 2.667 18387 12964 1 16 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.928 0.038 18387 12965 1 16 . 1 1 95 95 LYS C C 95 178.787 178.787 178.003 0.784 18387 12966 1 16 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.692 0.380 18387 12967 1 16 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.048 0.417 18387 12968 1 16 . 1 1 95 95 LYS H H 95 8.645 8.645 8.762 -0.117 18387 12969 1 16 . 1 1 96 96 ASP N N 96 116.775 116.775 119.147 -2.372 18387 12970 1 16 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.547 0.033 18387 12971 1 16 . 1 1 96 96 ASP C C 96 176.220 176.220 178.230 -2.010 18387 12972 1 16 . 1 1 96 96 ASP CA C 96 56.346 56.346 57.212 -0.866 18387 12973 1 16 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.664 -0.107 18387 12974 1 16 . 1 1 96 96 ASP H H 96 8.606 8.606 8.265 0.341 18387 12975 1 16 . 1 1 97 97 ASP N N 97 118.213 118.213 120.261 -2.048 18387 12976 1 16 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.417 0.510 18387 12977 1 16 . 1 1 97 97 ASP C C 97 176.954 176.954 178.013 -1.059 18387 12978 1 16 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.077 -1.718 18387 12979 1 16 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.887 1.437 18387 12980 1 16 . 1 1 97 97 ASP H H 97 7.988 7.988 8.378 -0.390 18387 12981 1 16 . 1 1 98 98 VAL N N 98 118.907 118.907 119.079 -0.172 18387 12982 1 16 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.646 -0.230 18387 12983 1 16 . 1 1 98 98 VAL C C 98 176.470 176.470 177.485 -1.015 18387 12984 1 16 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.314 1.464 18387 12985 1 16 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.879 0.512 18387 12986 1 16 . 1 1 98 98 VAL H H 98 7.098 7.098 8.029 -0.931 18387 12987 1 16 . 1 1 99 99 LYS N N 99 117.909 117.909 118.851 -0.942 18387 12988 1 16 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.967 -0.024 18387 12989 1 16 . 1 1 99 99 LYS C C 99 178.762 178.762 178.791 -0.029 18387 12990 1 16 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.565 0.580 18387 12991 1 16 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.729 0.283 18387 12992 1 16 . 1 1 99 99 LYS H H 99 8.304 8.304 7.529 0.775 18387 12993 1 16 . 1 1 100 100 ASP N N 100 117.843 117.843 119.945 -2.102 18387 12994 1 16 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.434 0.044 18387 12995 1 16 . 1 1 100 100 ASP C C 100 179.694 179.694 178.653 1.041 18387 12996 1 16 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.474 0.052 18387 12997 1 16 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.819 0.009 18387 12998 1 16 . 1 1 100 100 ASP H H 100 8.024 8.024 7.868 0.156 18387 12999 1 16 . 1 1 101 101 VAL N N 101 122.202 122.202 120.139 2.063 18387 13000 1 16 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.739 0.256 18387 13001 1 16 . 1 1 101 101 VAL C C 101 178.533 178.533 177.985 0.548 18387 13002 1 16 . 1 1 101 101 VAL CA C 101 67.002 67.002 65.799 1.202 18387 13003 1 16 . 1 1 101 101 VAL CB C 101 32.037 32.037 32.033 0.004 18387 13004 1 16 . 1 1 101 101 VAL H H 101 8.205 8.205 7.368 0.837 18387 13005 1 16 . 1 1 102 102 LEU N N 102 118.798 118.798 120.027 -1.229 18387 13006 1 16 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.864 -0.084 18387 13007 1 16 . 1 1 102 102 LEU C C 102 180.254 180.254 179.296 0.958 18387 13008 1 16 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.889 1.052 18387 13009 1 16 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.523 -1.083 18387 13010 1 16 . 1 1 102 102 LEU H H 102 8.422 8.422 7.774 0.648 18387 13011 1 16 . 1 1 103 103 GLU N N 103 116.915 116.915 119.053 -2.138 18387 13012 1 16 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.037 0.098 18387 13013 1 16 . 1 1 103 103 GLU C C 103 180.910 180.910 179.162 1.748 18387 13014 1 16 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.960 0.443 18387 13015 1 16 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.062 0.669 18387 13016 1 16 . 1 1 103 103 GLU H H 103 8.262 8.262 7.941 0.321 18387 13017 1 16 . 1 1 104 104 SER N N 104 117.866 117.866 115.423 2.443 18387 13018 1 16 . 1 1 104 104 SER HA H 104 4.216 4.216 4.105 0.111 18387 13019 1 16 . 1 1 104 104 SER C C 104 175.455 175.455 175.314 0.141 18387 13020 1 16 . 1 1 104 104 SER CA C 104 62.019 62.019 61.283 0.736 18387 13021 1 16 . 1 1 104 104 SER CB C 104 62.891 62.891 63.056 -0.165 18387 13022 1 16 . 1 1 104 104 SER H H 104 8.544 8.544 7.663 0.881 18387 13023 1 16 . 1 1 105 105 TYR N N 105 117.278 117.278 116.252 1.026 18387 13024 1 16 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.398 -0.126 18387 13025 1 16 . 1 1 105 105 TYR C C 105 174.750 174.750 175.288 -0.538 18387 13026 1 16 . 1 1 105 105 TYR CA C 105 59.859 59.859 57.533 2.326 18387 13027 1 16 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.942 1.769 18387 13028 1 16 . 1 1 105 105 TYR H H 105 7.691 7.691 7.205 0.486 18387 13029 1 16 . 1 1 106 106 CYS N N 106 116.897 116.897 118.379 -1.482 18387 13030 1 16 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.029 -0.134 18387 13031 1 16 . 1 1 106 106 CYS C C 106 174.056 174.056 173.145 0.911 18387 13032 1 16 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.804 -0.194 18387 13033 1 16 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.838 -0.806 18387 13034 1 16 . 1 1 106 106 CYS H H 106 7.862 7.862 8.062 -0.200 18387 13035 1 16 . 1 1 107 107 ILE N N 107 118.885 118.885 120.699 -1.814 18387 13036 1 16 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.004 -0.665 18387 13037 1 16 . 1 1 107 107 ILE C C 107 176.793 176.793 174.758 2.035 18387 13038 1 16 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.441 2.304 18387 13039 1 16 . 1 1 107 107 ILE CB C 107 38.079 38.079 38.661 -0.582 18387 13040 1 16 . 1 1 107 107 ILE H H 107 7.707 7.707 7.381 0.326 18387 13041 1 16 . 1 1 108 108 VAL N N 108 123.983 123.983 125.283 -1.300 18387 13042 1 16 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.201 0.073 18387 13043 1 16 . 1 1 108 108 VAL C C 108 175.476 175.476 175.295 0.181 18387 13044 1 16 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.103 0.521 18387 13045 1 16 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.129 0.879 18387 13046 1 16 . 1 1 108 108 VAL H H 108 8.656 8.656 8.348 0.308 18387 13047 1 16 . 1 1 109 109 GLY N N 109 110.120 110.120 107.274 2.846 18387 13048 1 16 . 1 1 109 109 GLY C C 109 169.982 169.982 172.280 -2.298 18387 13049 1 16 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.565 0.038 18387 13050 1 16 . 1 1 109 109 GLY H H 109 7.500 7.500 7.318 0.182 18387 13051 1 16 . 1 1 110 110 PHE N N 110 115.276 115.276 119.280 -4.004 18387 13052 1 16 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.252 -0.478 18387 13053 1 16 . 1 1 110 110 PHE C C 110 174.361 174.361 174.484 -0.123 18387 13054 1 16 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.702 -0.014 18387 13055 1 16 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.827 0.124 18387 13056 1 16 . 1 1 110 110 PHE H H 110 8.203 8.203 8.718 -0.515 18387 13057 1 16 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.006 0.353 18387 13058 1 16 . 1 1 111 111 PRO C C 111 175.691 175.691 175.750 -0.059 18387 13059 1 16 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.724 0.433 18387 13060 1 16 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.278 2.026 18387 13061 1 16 . 1 1 112 112 HIS N N 112 123.708 123.708 116.556 7.152 18387 13062 1 16 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.891 0.072 18387 13063 1 16 . 1 1 112 112 HIS C C 112 173.649 173.649 173.810 -0.161 18387 13064 1 16 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.432 0.642 18387 13065 1 16 . 1 1 112 112 HIS CB C 112 32.197 32.197 33.453 -1.256 18387 13066 1 16 . 1 1 112 112 HIS H H 112 8.952 8.952 8.725 0.227 18387 13067 1 16 . 1 1 113 113 ILE N N 113 128.596 128.596 125.080 3.516 18387 13068 1 16 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.945 0.752 18387 13069 1 16 . 1 1 113 113 ILE C C 113 176.130 176.130 174.571 1.559 18387 13070 1 16 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.285 0.710 18387 13071 1 16 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.517 -2.462 18387 13072 1 16 . 1 1 113 113 ILE H H 113 8.808 8.808 8.944 -0.136 18387 13073 1 16 . 1 1 114 114 ILE N N 114 119.668 119.668 122.222 -2.554 18387 13074 1 16 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.872 0.101 18387 13075 1 16 . 1 1 114 114 ILE C C 114 173.186 173.186 173.344 -0.158 18387 13076 1 16 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.951 -0.221 18387 13077 1 16 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.578 -0.038 18387 13078 1 16 . 1 1 114 114 ILE H H 114 8.721 8.721 8.906 -0.185 18387 13079 1 16 . 1 1 115 115 LEU N N 115 122.770 122.770 124.491 -1.721 18387 13080 1 16 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.307 -0.032 18387 13081 1 16 . 1 1 115 115 LEU C C 115 173.601 173.601 174.671 -1.070 18387 13082 1 16 . 1 1 115 115 LEU CA C 115 53.782 53.782 52.997 0.785 18387 13083 1 16 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.576 0.558 18387 13084 1 16 . 1 1 115 115 LEU H H 115 8.665 8.665 9.021 -0.356 18387 13085 1 16 . 1 1 116 116 VAL N N 116 130.411 130.411 120.181 10.230 18387 13086 1 16 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.276 -0.418 18387 13087 1 16 . 1 1 116 116 VAL C C 116 174.565 174.565 175.662 -1.097 18387 13088 1 16 . 1 1 116 116 VAL CA C 116 60.804 60.804 58.779 2.025 18387 13089 1 16 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.925 -1.010 18387 13090 1 16 . 1 1 116 116 VAL H H 116 9.472 9.472 9.037 0.435 18387 13091 1 16 . 1 1 117 117 ASP N N 117 127.896 127.896 125.914 1.982 18387 13092 1 16 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.893 -0.501 18387 13093 1 16 . 1 1 117 117 ASP C C 117 176.567 176.567 175.987 0.580 18387 13094 1 16 . 1 1 117 117 ASP CA C 117 52.600 52.600 55.057 -2.457 18387 13095 1 16 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.103 0.481 18387 13096 1 16 . 1 1 117 117 ASP H H 117 9.429 9.429 8.802 0.627 18387 13097 1 16 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.365 -0.171 18387 13098 1 16 . 1 1 118 118 PRO C C 118 177.534 177.534 177.963 -0.429 18387 13099 1 16 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.149 0.016 18387 13100 1 16 . 1 1 118 118 PRO CB C 118 32.813 32.813 32.021 0.792 18387 13101 1 16 . 1 1 119 119 GLU N N 119 114.015 114.015 117.440 -3.425 18387 13102 1 16 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.160 0.179 18387 13103 1 16 . 1 1 119 119 GLU C C 119 176.722 176.722 177.413 -0.691 18387 13104 1 16 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.666 -2.027 18387 13105 1 16 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.671 0.906 18387 13106 1 16 . 1 1 119 119 GLU H H 119 7.733 7.733 8.797 -1.064 18387 13107 1 16 . 1 1 120 120 GLY N N 120 108.218 108.218 106.440 1.778 18387 13108 1 16 . 1 1 120 120 GLY C C 120 174.110 174.110 172.697 1.413 18387 13109 1 16 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.041 0.355 18387 13110 1 16 . 1 1 120 120 GLY H H 120 8.588 8.588 7.760 0.828 18387 13111 1 16 . 1 1 121 121 LYS N N 121 121.778 121.778 119.261 2.517 18387 13112 1 16 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.247 -0.388 18387 13113 1 16 . 1 1 121 121 LYS C C 121 176.458 176.458 175.552 0.906 18387 13114 1 16 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.464 0.498 18387 13115 1 16 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.606 -2.154 18387 13116 1 16 . 1 1 121 121 LYS H H 121 8.600 8.600 7.761 0.839 18387 13117 1 16 . 1 1 122 122 ILE N N 122 122.058 122.058 123.672 -1.614 18387 13118 1 16 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.503 -0.231 18387 13119 1 16 . 1 1 122 122 ILE C C 122 177.084 177.084 176.534 0.550 18387 13120 1 16 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.235 0.584 18387 13121 1 16 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.697 0.951 18387 13122 1 16 . 1 1 122 122 ILE H H 122 9.006 9.006 9.022 -0.016 18387 13123 1 16 . 1 1 123 123 VAL N N 123 120.561 120.561 125.616 -5.055 18387 13124 1 16 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.347 0.408 18387 13125 1 16 . 1 1 123 123 VAL C C 123 175.584 175.584 174.640 0.944 18387 13126 1 16 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.652 -1.501 18387 13127 1 16 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.385 1.016 18387 13128 1 16 . 1 1 123 123 VAL H H 123 9.054 9.054 8.501 0.553 18387 13129 1 16 . 1 1 124 124 ALA N N 124 121.102 121.102 122.065 -0.963 18387 13130 1 16 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.783 -0.126 18387 13131 1 16 . 1 1 124 124 ALA C C 124 174.832 174.832 175.031 -0.199 18387 13132 1 16 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.318 1.142 18387 13133 1 16 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.281 1.549 18387 13134 1 16 . 1 1 124 124 ALA H H 124 7.793 7.793 7.435 0.358 18387 13135 1 16 . 1 1 125 125 LYS N N 125 117.637 117.637 121.940 -4.303 18387 13136 1 16 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.868 0.165 18387 13137 1 16 . 1 1 125 125 LYS C C 125 173.417 173.417 175.347 -1.930 18387 13138 1 16 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.623 -0.482 18387 13139 1 16 . 1 1 125 125 LYS CB C 125 36.651 36.651 36.057 0.594 18387 13140 1 16 . 1 1 125 125 LYS H H 125 8.872 8.872 8.237 0.635 18387 13141 1 16 . 1 1 126 126 GLU N N 126 115.236 115.236 116.857 -1.621 18387 13142 1 16 . 1 1 126 126 GLU HA H 126 3.998 3.998 4.110 -0.112 18387 13143 1 16 . 1 1 126 126 GLU C C 126 175.998 175.998 176.284 -0.286 18387 13144 1 16 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.636 -0.674 18387 13145 1 16 . 1 1 126 126 GLU CB C 126 26.435 26.435 28.308 -1.873 18387 13146 1 16 . 1 1 126 126 GLU H H 126 7.941 7.941 8.722 -0.781 18387 13147 1 16 . 1 1 127 127 LEU N N 127 118.584 118.584 118.372 0.212 18387 13148 1 16 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.351 0.031 18387 13149 1 16 . 1 1 127 127 LEU C C 127 176.766 176.766 176.551 0.215 18387 13150 1 16 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.359 -0.750 18387 13151 1 16 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.808 1.155 18387 13152 1 16 . 1 1 127 127 LEU H H 127 7.300 7.300 7.266 0.034 18387 13153 1 16 . 1 1 128 128 ARG N N 128 118.625 118.625 118.584 0.041 18387 13154 1 16 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.743 -0.268 18387 13155 1 16 . 1 1 128 128 ARG C C 128 177.113 177.113 177.008 0.105 18387 13156 1 16 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.873 -0.483 18387 13157 1 16 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.876 1.736 18387 13158 1 16 . 1 1 128 128 ARG H H 128 7.929 7.929 7.864 0.065 18387 13159 1 16 . 1 1 129 129 GLY N N 129 114.010 114.010 114.855 -0.845 18387 13160 1 16 . 1 1 129 129 GLY C C 129 175.931 175.931 174.707 1.224 18387 13161 1 16 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.994 -1.533 18387 13162 1 16 . 1 1 129 129 GLY H H 129 10.649 10.649 9.672 0.977 18387 13163 1 16 . 1 1 130 130 ASP N N 130 123.975 123.975 123.602 0.373 18387 13164 1 16 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.757 0.775 18387 13165 1 16 . 1 1 130 130 ASP C C 130 177.507 177.507 177.936 -0.429 18387 13166 1 16 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.490 -0.118 18387 13167 1 16 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.268 0.635 18387 13168 1 16 . 1 1 130 130 ASP H H 130 8.540 8.540 8.407 0.133 18387 13169 1 16 . 1 1 131 131 ASP N N 131 116.806 116.806 120.123 -3.317 18387 13170 1 16 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.392 0.178 18387 13171 1 16 . 1 1 131 131 ASP C C 131 179.038 179.038 178.147 0.891 18387 13172 1 16 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.214 -0.231 18387 13173 1 16 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.795 0.139 18387 13174 1 16 . 1 1 131 131 ASP H H 131 7.907 7.907 8.241 -0.334 18387 13175 1 16 . 1 1 132 132 LEU N N 132 123.869 123.869 118.538 5.331 18387 13176 1 16 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.022 -0.231 18387 13177 1 16 . 1 1 132 132 LEU C C 132 176.343 176.343 178.252 -1.909 18387 13178 1 16 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.472 1.312 18387 13179 1 16 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.896 0.872 18387 13180 1 16 . 1 1 132 132 LEU H H 132 7.542 7.542 7.285 0.257 18387 13181 1 16 . 1 1 133 133 TYR N N 133 120.042 120.042 119.931 0.111 18387 13182 1 16 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.052 -0.056 18387 13183 1 16 . 1 1 133 133 TYR C C 133 177.426 177.426 177.357 0.069 18387 13184 1 16 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.865 0.268 18387 13185 1 16 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.736 -0.160 18387 13186 1 16 . 1 1 133 133 TYR H H 133 7.384 7.384 7.543 -0.159 18387 13187 1 16 . 1 1 134 134 ASN N N 134 114.936 114.936 117.661 -2.725 18387 13188 1 16 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.383 0.020 18387 13189 1 16 . 1 1 134 134 ASN C C 134 178.703 178.703 177.896 0.807 18387 13190 1 16 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.748 -0.939 18387 13191 1 16 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.323 -0.115 18387 13192 1 16 . 1 1 134 134 ASN H H 134 8.399 8.399 8.592 -0.193 18387 13193 1 16 . 1 1 135 135 THR N N 135 117.387 117.387 116.791 0.596 18387 13194 1 16 . 1 1 135 135 THR HA H 135 3.920 3.920 4.112 -0.192 18387 13195 1 16 . 1 1 135 135 THR C C 135 175.323 175.323 176.813 -1.490 18387 13196 1 16 . 1 1 135 135 THR CA C 135 67.402 67.402 66.894 0.508 18387 13197 1 16 . 1 1 135 135 THR CB C 135 68.111 68.111 68.791 -0.680 18387 13198 1 16 . 1 1 135 135 THR H H 135 8.265 8.265 8.587 -0.322 18387 13199 1 16 . 1 1 136 136 VAL N N 136 121.207 121.207 121.888 -0.681 18387 13200 1 16 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.363 -0.348 18387 13201 1 16 . 1 1 136 136 VAL C C 136 176.457 176.457 177.010 -0.553 18387 13202 1 16 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.799 1.473 18387 13203 1 16 . 1 1 136 136 VAL CB C 136 30.941 30.941 31.171 -0.230 18387 13204 1 16 . 1 1 136 136 VAL H H 136 7.595 7.595 7.475 0.120 18387 13205 1 16 . 1 1 137 137 GLU N N 137 118.266 118.266 120.240 -1.974 18387 13206 1 16 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.275 -1.593 18387 13207 1 16 . 1 1 137 137 GLU C C 137 177.482 177.482 178.742 -1.260 18387 13208 1 16 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.917 0.013 18387 13209 1 16 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.252 0.530 18387 13210 1 16 . 1 1 137 137 GLU H H 137 8.114 8.114 8.320 -0.206 18387 13211 1 16 . 1 1 138 138 LYS N N 138 116.431 116.431 118.836 -2.405 18387 13212 1 16 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.980 -0.212 18387 13213 1 16 . 1 1 138 138 LYS C C 138 179.193 179.193 178.548 0.645 18387 13214 1 16 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.453 -0.413 18387 13215 1 16 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.386 -0.228 18387 13216 1 16 . 1 1 138 138 LYS H H 138 7.133 7.133 8.107 -0.974 18387 13217 1 16 . 1 1 139 139 PHE N N 139 116.336 116.336 120.243 -3.907 18387 13218 1 16 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.223 -0.213 18387 13219 1 16 . 1 1 139 139 PHE C C 139 177.855 177.855 177.167 0.688 18387 13220 1 16 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.512 0.872 18387 13221 1 16 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.263 0.089 18387 13222 1 16 . 1 1 139 139 PHE H H 139 7.338 7.338 7.905 -0.567 18387 13223 1 16 . 1 1 140 140 VAL N N 140 116.491 116.491 119.083 -2.592 18387 13224 1 16 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.514 0.010 18387 13225 1 16 . 1 1 140 140 VAL C C 140 177.747 177.747 176.775 0.972 18387 13226 1 16 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.901 -0.659 18387 13227 1 16 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.734 -0.344 18387 13228 1 16 . 1 1 140 140 VAL H H 140 8.332 8.332 8.499 -0.167 18387 13229 1 16 . 1 1 141 141 ASN N N 141 116.956 116.956 119.884 -2.928 18387 13230 1 16 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.668 0.158 18387 13231 1 16 . 1 1 141 141 ASN C C 141 176.997 176.997 176.694 0.303 18387 13232 1 16 . 1 1 141 141 ASN CA C 141 53.677 53.677 53.651 0.026 18387 13233 1 16 . 1 1 141 141 ASN CB C 141 38.448 38.448 37.497 0.951 18387 13234 1 16 . 1 1 141 141 ASN H H 141 7.862 7.862 7.925 -0.063 18387 13235 1 16 . 1 1 142 142 GLY N N 142 107.938 107.938 112.316 -4.378 18387 13236 1 16 . 1 1 142 142 GLY C C 142 174.336 174.336 174.868 -0.532 18387 13237 1 16 . 1 1 142 142 GLY CA C 142 45.985 45.985 46.944 -0.959 18387 13238 1 16 . 1 1 142 142 GLY H H 142 7.466 7.466 8.210 -0.744 18387 13239 1 16 . 1 1 143 143 ALA N N 143 123.441 123.441 124.487 -1.046 18387 13240 1 16 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.399 -0.058 18387 13241 1 16 . 1 1 143 143 ALA C C 143 178.212 178.212 177.486 0.726 18387 13242 1 16 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.712 0.115 18387 13243 1 16 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.577 0.667 18387 13244 1 16 . 1 1 143 143 ALA H H 143 7.950 7.950 8.097 -0.147 18387 13245 1 16 . 1 1 144 144 LYS N N 144 120.149 120.149 123.495 -3.346 18387 13246 1 16 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.262 0.033 18387 13247 1 16 . 1 1 144 144 LYS C C 144 176.945 176.945 177.590 -0.645 18387 13248 1 16 . 1 1 144 144 LYS CA C 144 56.519 56.519 57.854 -1.335 18387 13249 1 16 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.856 0.174 18387 13250 1 16 . 1 1 144 144 LYS H H 144 8.187 8.187 8.490 -0.303 18387 13251 1 16 . 1 1 145 145 GLU N N 145 120.992 120.992 118.310 2.682 18387 13252 1 16 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.309 -0.014 18387 13253 1 16 . 1 1 145 145 GLU C C 145 177.116 177.116 177.154 -0.038 18387 13254 1 16 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.211 0.692 18387 13255 1 16 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.152 1.089 18387 13256 1 16 . 1 1 145 145 GLU H H 145 8.363 8.363 8.182 0.181 18387 13257 1 16 . 1 1 146 146 GLY N N 146 109.467 109.467 107.479 1.988 18387 13258 1 16 . 1 1 146 146 GLY C C 146 174.108 174.108 174.421 -0.313 18387 13259 1 16 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.683 0.718 18387 13260 1 16 . 1 1 146 146 GLY H H 146 8.371 8.371 8.001 0.370 18387 13261 1 16 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.062 0.547 18387 13262 1 16 . 1 1 151 151 HIS C C 151 174.258 174.258 174.894 -0.636 18387 13263 1 16 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.403 -0.238 18387 13264 1 16 . 1 1 151 151 HIS CB C 151 30.833 30.833 28.418 2.415 18387 13265 1 17 . 1 1 2 2 SER HA H 2 3.992 3.992 4.242 -0.250 18387 13266 1 17 . 1 1 2 2 SER CA C 2 57.555 57.555 61.590 -4.035 18387 13267 1 17 . 1 1 2 2 SER CB C 2 64.977 64.977 63.541 1.437 18387 13268 1 17 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.537 -0.098 18387 13269 1 17 . 1 1 3 3 LEU C C 3 176.631 176.631 175.495 1.136 18387 13270 1 17 . 1 1 3 3 LEU CA C 3 54.564 54.564 53.925 0.639 18387 13271 1 17 . 1 1 3 3 LEU CB C 3 42.724 42.724 40.622 2.102 18387 13272 1 17 . 1 1 4 4 ALA N N 4 125.483 125.483 121.179 4.304 18387 13273 1 17 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.065 0.314 18387 13274 1 17 . 1 1 4 4 ALA C C 4 179.642 179.642 175.958 3.684 18387 13275 1 17 . 1 1 4 4 ALA CA C 4 51.735 51.735 53.836 -2.101 18387 13276 1 17 . 1 1 4 4 ALA CB C 4 19.752 19.752 18.328 1.424 18387 13277 1 17 . 1 1 4 4 ALA H H 4 8.483 8.483 7.506 0.977 18387 13278 1 17 . 1 1 5 5 THR HA H 5 3.845 3.845 4.584 -0.739 18387 13279 1 17 . 1 1 5 5 THR C C 5 175.487 175.487 174.687 0.800 18387 13280 1 17 . 1 1 5 5 THR CA C 5 64.531 64.531 60.332 4.199 18387 13281 1 17 . 1 1 5 5 THR CB C 5 68.108 68.108 71.073 -2.965 18387 13282 1 17 . 1 1 6 6 GLY N N 6 114.298 114.298 111.865 2.433 18387 13283 1 17 . 1 1 6 6 GLY C C 6 174.324 174.324 174.316 0.008 18387 13284 1 17 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.157 -0.322 18387 13285 1 17 . 1 1 6 6 GLY H H 6 9.511 9.511 9.173 0.338 18387 13286 1 17 . 1 1 7 7 SER N N 7 115.270 115.270 116.990 -1.720 18387 13287 1 17 . 1 1 7 7 SER HA H 7 4.500 4.500 4.562 -0.062 18387 13288 1 17 . 1 1 7 7 SER C C 7 173.315 173.315 174.158 -0.843 18387 13289 1 17 . 1 1 7 7 SER CA C 7 58.915 58.915 58.002 0.913 18387 13290 1 17 . 1 1 7 7 SER CB C 7 64.308 64.308 64.144 0.163 18387 13291 1 17 . 1 1 7 7 SER H H 7 7.736 7.736 7.923 -0.187 18387 13292 1 17 . 1 1 8 8 VAL N N 8 123.708 123.708 124.796 -1.088 18387 13293 1 17 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.017 -0.185 18387 13294 1 17 . 1 1 8 8 VAL C C 8 176.673 176.673 176.142 0.531 18387 13295 1 17 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.861 0.812 18387 13296 1 17 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.469 0.753 18387 13297 1 17 . 1 1 8 8 VAL H H 8 8.632 8.632 8.508 0.123 18387 13298 1 17 . 1 1 9 9 ALA N N 9 133.040 133.040 132.831 0.209 18387 13299 1 17 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.774 -0.511 18387 13300 1 17 . 1 1 9 9 ALA C C 9 175.404 175.404 175.712 -0.308 18387 13301 1 17 . 1 1 9 9 ALA CA C 9 50.955 50.955 50.038 0.916 18387 13302 1 17 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.953 -0.923 18387 13303 1 17 . 1 1 9 9 ALA H H 9 8.448 8.448 8.784 -0.336 18387 13304 1 17 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.391 -0.060 18387 13305 1 17 . 1 1 10 10 PRO C C 10 175.071 175.071 176.034 -0.963 18387 13306 1 17 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.425 0.216 18387 13307 1 17 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.231 0.093 18387 13308 1 17 . 1 1 11 11 ALA N N 11 124.172 124.172 123.487 0.685 18387 13309 1 17 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.569 -0.325 18387 13310 1 17 . 1 1 11 11 ALA C C 11 177.688 177.688 177.814 -0.126 18387 13311 1 17 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.354 2.267 18387 13312 1 17 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.400 -0.073 18387 13313 1 17 . 1 1 11 11 ALA H H 11 8.221 8.221 8.296 -0.075 18387 13314 1 17 . 1 1 12 12 ILE N N 12 117.815 117.815 126.533 -8.718 18387 13315 1 17 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.355 -0.027 18387 13316 1 17 . 1 1 12 12 ILE C C 12 175.013 175.013 175.296 -0.283 18387 13317 1 17 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.411 0.755 18387 13318 1 17 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.011 5.279 18387 13319 1 17 . 1 1 12 12 ILE H H 12 7.693 7.693 8.606 -0.913 18387 13320 1 17 . 1 1 13 13 THR N N 13 121.186 121.186 122.141 -0.955 18387 13321 1 17 . 1 1 13 13 THR HA H 13 4.840 4.840 5.147 -0.307 18387 13322 1 17 . 1 1 13 13 THR C C 13 172.625 172.625 173.770 -1.145 18387 13323 1 17 . 1 1 13 13 THR CA C 13 62.297 62.297 61.533 0.764 18387 13324 1 17 . 1 1 13 13 THR CB C 13 71.585 71.585 70.356 1.228 18387 13325 1 17 . 1 1 13 13 THR H H 13 8.363 8.363 8.739 -0.376 18387 13326 1 17 . 1 1 14 14 GLY N N 14 110.785 110.785 112.272 -1.487 18387 13327 1 17 . 1 1 14 14 GLY C C 14 170.040 170.040 171.957 -1.917 18387 13328 1 17 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.441 0.948 18387 13329 1 17 . 1 1 14 14 GLY H H 14 7.993 7.993 8.630 -0.637 18387 13330 1 17 . 1 1 15 15 ILE N N 15 119.088 119.088 120.352 -1.264 18387 13331 1 17 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.998 0.127 18387 13332 1 17 . 1 1 15 15 ILE C C 15 176.359 176.359 176.051 0.308 18387 13333 1 17 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.224 -1.610 18387 13334 1 17 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.253 0.386 18387 13335 1 17 . 1 1 15 15 ILE H H 15 7.973 7.973 8.413 -0.440 18387 13336 1 17 . 1 1 16 16 ASP N N 16 126.633 126.633 128.210 -1.577 18387 13337 1 17 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.210 0.639 18387 13338 1 17 . 1 1 16 16 ASP C C 16 179.190 179.190 177.452 1.738 18387 13339 1 17 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.276 -0.396 18387 13340 1 17 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.739 -0.464 18387 13341 1 17 . 1 1 16 16 ASP H H 16 9.335 9.335 8.880 0.455 18387 13342 1 17 . 1 1 17 17 LEU N N 17 116.648 116.648 118.447 -1.799 18387 13343 1 17 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.051 0.123 18387 13344 1 17 . 1 1 17 17 LEU C C 17 178.432 178.432 179.297 -0.865 18387 13345 1 17 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.647 0.334 18387 13346 1 17 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.748 1.238 18387 13347 1 17 . 1 1 17 17 LEU H H 17 8.071 8.071 8.729 -0.658 18387 13348 1 17 . 1 1 18 18 LYS N N 18 117.401 117.401 118.147 -0.746 18387 13349 1 17 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.159 0.350 18387 13350 1 17 . 1 1 18 18 LYS C C 18 176.793 176.793 177.362 -0.569 18387 13351 1 17 . 1 1 18 18 LYS CA C 18 55.435 55.435 58.126 -2.691 18387 13352 1 17 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.862 0.201 18387 13353 1 17 . 1 1 18 18 LYS H H 18 8.207 8.207 9.036 -0.829 18387 13354 1 17 . 1 1 19 19 GLY N N 19 108.061 108.061 106.490 1.571 18387 13355 1 17 . 1 1 19 19 GLY C C 19 174.649 174.649 174.001 0.648 18387 13356 1 17 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.546 1.051 18387 13357 1 17 . 1 1 19 19 GLY H H 19 8.099 8.099 8.030 0.069 18387 13358 1 17 . 1 1 20 20 ASN N N 20 121.012 121.012 119.605 1.407 18387 13359 1 17 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.944 -0.039 18387 13360 1 17 . 1 1 20 20 ASN C C 20 174.827 174.827 174.506 0.321 18387 13361 1 17 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.551 -0.084 18387 13362 1 17 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.676 -1.000 18387 13363 1 17 . 1 1 20 20 ASN H H 20 8.945 8.945 9.291 -0.346 18387 13364 1 17 . 1 1 21 21 SER N N 21 117.285 117.285 117.508 -0.223 18387 13365 1 17 . 1 1 21 21 SER HA H 21 5.000 5.000 4.961 0.039 18387 13366 1 17 . 1 1 21 21 SER C C 21 174.911 174.911 174.210 0.701 18387 13367 1 17 . 1 1 21 21 SER CA C 21 58.730 58.730 57.957 0.773 18387 13368 1 17 . 1 1 21 21 SER CB C 21 63.162 63.162 62.554 0.608 18387 13369 1 17 . 1 1 21 21 SER H H 21 8.740 8.740 8.632 0.108 18387 13370 1 17 . 1 1 22 22 VAL N N 22 128.665 128.665 128.931 -0.266 18387 13371 1 17 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.346 0.034 18387 13372 1 17 . 1 1 22 22 VAL C C 22 176.276 176.276 174.497 1.779 18387 13373 1 17 . 1 1 22 22 VAL CA C 22 62.953 62.953 60.850 2.103 18387 13374 1 17 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.335 1.247 18387 13375 1 17 . 1 1 22 22 VAL H H 22 9.125 9.125 8.754 0.371 18387 13376 1 17 . 1 1 23 23 SER N N 23 127.457 127.457 121.489 5.968 18387 13377 1 17 . 1 1 23 23 SER HA H 23 5.878 5.878 5.540 0.338 18387 13378 1 17 . 1 1 23 23 SER C C 23 174.436 174.436 175.560 -1.124 18387 13379 1 17 . 1 1 23 23 SER CA C 23 57.101 57.101 56.550 0.551 18387 13380 1 17 . 1 1 23 23 SER CB C 23 66.078 66.078 64.909 1.169 18387 13381 1 17 . 1 1 23 23 SER H H 23 8.971 8.971 9.459 -0.488 18387 13382 1 17 . 1 1 24 24 LEU N N 24 126.734 126.734 123.145 3.589 18387 13383 1 17 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.766 -0.299 18387 13384 1 17 . 1 1 24 24 LEU C C 24 179.852 179.852 177.604 2.248 18387 13385 1 17 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.339 0.864 18387 13386 1 17 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.988 -0.010 18387 13387 1 17 . 1 1 24 24 LEU H H 24 8.450 8.450 8.419 0.031 18387 13388 1 17 . 1 1 25 25 ASN N N 25 115.642 115.642 114.169 1.473 18387 13389 1 17 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.459 -0.217 18387 13390 1 17 . 1 1 25 25 ASN C C 25 176.246 176.246 176.188 0.058 18387 13391 1 17 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.315 0.056 18387 13392 1 17 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.563 1.208 18387 13393 1 17 . 1 1 25 25 ASN H H 25 8.505 8.505 8.769 -0.264 18387 13394 1 17 . 1 1 26 26 ASP N N 26 119.722 119.722 121.132 -1.410 18387 13395 1 17 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.393 -0.188 18387 13396 1 17 . 1 1 26 26 ASP C C 26 176.708 176.708 176.303 0.405 18387 13397 1 17 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.403 0.122 18387 13398 1 17 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.457 -1.177 18387 13399 1 17 . 1 1 26 26 ASP H H 26 7.731 7.731 7.619 0.112 18387 13400 1 17 . 1 1 27 27 PHE N N 27 116.827 116.827 116.534 0.293 18387 13401 1 17 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.636 -0.156 18387 13402 1 17 . 1 1 27 27 PHE C C 27 174.227 174.227 175.625 -1.398 18387 13403 1 17 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.065 0.006 18387 13404 1 17 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.681 0.038 18387 13405 1 17 . 1 1 27 27 PHE H H 27 7.390 7.390 7.457 -0.067 18387 13406 1 17 . 1 1 28 28 LYS N N 28 120.357 120.357 120.996 -0.639 18387 13407 1 17 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.010 0.377 18387 13408 1 17 . 1 1 28 28 LYS C C 28 177.845 177.845 177.304 0.541 18387 13409 1 17 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.940 0.062 18387 13410 1 17 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.859 -0.315 18387 13411 1 17 . 1 1 28 28 LYS H H 28 6.883 6.883 7.314 -0.431 18387 13412 1 17 . 1 1 29 29 GLY N N 29 112.653 112.653 109.373 3.280 18387 13413 1 17 . 1 1 29 29 GLY C C 29 173.799 173.799 173.601 0.198 18387 13414 1 17 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.343 -0.355 18387 13415 1 17 . 1 1 29 29 GLY H H 29 8.930 8.930 8.651 0.279 18387 13416 1 17 . 1 1 30 30 LYS N N 30 120.516 120.516 117.552 2.964 18387 13417 1 17 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.484 0.151 18387 13418 1 17 . 1 1 30 30 LYS C C 30 176.505 176.505 174.563 1.942 18387 13419 1 17 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.461 0.719 18387 13420 1 17 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.994 -1.137 18387 13421 1 17 . 1 1 30 30 LYS H H 30 8.098 8.098 7.342 0.756 18387 13422 1 17 . 1 1 31 31 TYR N N 31 117.383 117.383 119.627 -2.244 18387 13423 1 17 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.837 -0.183 18387 13424 1 17 . 1 1 31 31 TYR C C 31 175.551 175.551 175.820 -0.269 18387 13425 1 17 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.622 1.543 18387 13426 1 17 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.563 2.630 18387 13427 1 17 . 1 1 31 31 TYR H H 31 8.263 8.263 8.923 -0.660 18387 13428 1 17 . 1 1 32 32 VAL N N 32 120.900 120.900 126.112 -5.212 18387 13429 1 17 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.659 -0.220 18387 13430 1 17 . 1 1 32 32 VAL C C 32 175.975 175.975 174.947 1.028 18387 13431 1 17 . 1 1 32 32 VAL CA C 32 59.706 59.706 61.305 -1.599 18387 13432 1 17 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.300 3.207 18387 13433 1 17 . 1 1 32 32 VAL H H 32 9.244 9.244 9.245 -0.001 18387 13434 1 17 . 1 1 33 33 LEU N N 33 130.058 130.058 131.203 -1.145 18387 13435 1 17 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.007 0.166 18387 13436 1 17 . 1 1 33 33 LEU C C 33 174.693 174.693 175.135 -0.442 18387 13437 1 17 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.839 -0.491 18387 13438 1 17 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.377 0.944 18387 13439 1 17 . 1 1 33 33 LEU H H 33 8.161 8.161 8.413 -0.252 18387 13440 1 17 . 1 1 34 34 VAL N N 34 129.232 129.232 128.742 0.490 18387 13441 1 17 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.975 0.007 18387 13442 1 17 . 1 1 34 34 VAL C C 34 174.285 174.285 174.604 -0.319 18387 13443 1 17 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.694 0.812 18387 13444 1 17 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.623 -0.245 18387 13445 1 17 . 1 1 34 34 VAL H H 34 9.296 9.296 9.216 0.080 18387 13446 1 17 . 1 1 35 35 ASP N N 35 123.675 123.675 126.777 -3.102 18387 13447 1 17 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.892 0.457 18387 13448 1 17 . 1 1 35 35 ASP C C 35 174.258 174.258 175.227 -0.969 18387 13449 1 17 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.370 -1.317 18387 13450 1 17 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.185 -0.723 18387 13451 1 17 . 1 1 35 35 ASP H H 35 8.015 8.015 8.225 -0.210 18387 13452 1 17 . 1 1 36 36 PHE N N 36 126.959 126.959 124.113 2.846 18387 13453 1 17 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.726 0.209 18387 13454 1 17 . 1 1 36 36 PHE C C 36 175.432 175.432 175.711 -0.279 18387 13455 1 17 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.588 0.507 18387 13456 1 17 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.118 -0.088 18387 13457 1 17 . 1 1 36 36 PHE H H 36 9.171 9.171 8.896 0.275 18387 13458 1 17 . 1 1 37 37 TRP N N 37 120.839 120.839 122.882 -2.043 18387 13459 1 17 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.471 0.286 18387 13460 1 17 . 1 1 37 37 TRP C C 37 172.412 172.412 173.520 -1.108 18387 13461 1 17 . 1 1 37 37 TRP CA C 37 55.909 55.909 56.005 -0.096 18387 13462 1 17 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.779 -0.099 18387 13463 1 17 . 1 1 37 37 TRP H H 37 9.280 9.280 8.982 0.298 18387 13464 1 17 . 1 1 38 38 PHE N N 38 109.215 109.215 112.496 -3.281 18387 13465 1 17 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.502 -0.569 18387 13466 1 17 . 1 1 38 38 PHE C C 38 176.141 176.141 174.142 1.999 18387 13467 1 17 . 1 1 38 38 PHE CA C 38 57.011 57.011 55.877 1.134 18387 13468 1 17 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.572 -0.953 18387 13469 1 17 . 1 1 38 38 PHE H H 38 7.062 7.062 8.420 -1.358 18387 13470 1 17 . 1 1 39 39 ALA N N 39 125.193 125.193 123.366 1.827 18387 13471 1 17 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.329 -0.264 18387 13472 1 17 . 1 1 39 39 ALA C C 39 179.349 179.349 177.639 1.710 18387 13473 1 17 . 1 1 39 39 ALA CA C 39 56.064 56.064 53.283 2.781 18387 13474 1 17 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.881 1.016 18387 13475 1 17 . 1 1 39 39 ALA H H 39 10.355 10.355 9.303 1.052 18387 13476 1 17 . 1 1 40 40 GLY N N 40 103.437 103.437 105.361 -1.924 18387 13477 1 17 . 1 1 40 40 GLY C C 40 172.732 172.732 173.929 -1.197 18387 13478 1 17 . 1 1 40 40 GLY CA C 40 44.936 44.936 44.639 0.297 18387 13479 1 17 . 1 1 40 40 GLY H H 40 8.583 8.583 7.506 1.077 18387 13480 1 17 . 1 1 41 41 CYS N N 41 124.859 124.859 120.154 4.705 18387 13481 1 17 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.477 -0.073 18387 13482 1 17 . 1 1 41 41 CYS C C 41 176.620 176.620 175.367 1.253 18387 13483 1 17 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.287 1.088 18387 13484 1 17 . 1 1 41 41 CYS CB C 41 28.376 28.376 28.983 -0.607 18387 13485 1 17 . 1 1 41 41 CYS H H 41 6.946 6.946 6.810 0.136 18387 13486 1 17 . 1 1 42 42 SER HA H 42 4.040 4.040 4.385 -0.345 18387 13487 1 17 . 1 1 42 42 SER CA C 42 61.552 61.552 61.034 0.518 18387 13488 1 17 . 1 1 42 42 SER CB C 42 62.675 62.675 62.924 -0.249 18387 13489 1 17 . 1 1 43 43 TRP N N 43 129.748 129.748 121.723 8.025 18387 13490 1 17 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.553 -0.004 18387 13491 1 17 . 1 1 43 43 TRP C C 43 180.400 180.400 178.237 2.163 18387 13492 1 17 . 1 1 43 43 TRP CA C 43 60.249 60.249 58.974 1.274 18387 13493 1 17 . 1 1 43 43 TRP CB C 43 29.592 29.592 30.020 -0.428 18387 13494 1 17 . 1 1 44 44 CYS N N 44 124.462 124.462 117.688 6.774 18387 13495 1 17 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.239 0.012 18387 13496 1 17 . 1 1 44 44 CYS C C 44 178.643 178.643 177.340 1.303 18387 13497 1 17 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.232 2.617 18387 13498 1 17 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.409 3.013 18387 13499 1 17 . 1 1 44 44 CYS H H 44 9.591 9.591 7.988 1.603 18387 13500 1 17 . 1 1 45 45 ARG N N 45 117.248 117.248 118.393 -1.145 18387 13501 1 17 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.286 -0.110 18387 13502 1 17 . 1 1 45 45 ARG C C 45 180.302 180.302 177.704 2.598 18387 13503 1 17 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.494 -0.551 18387 13504 1 17 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.591 -1.960 18387 13505 1 17 . 1 1 45 45 ARG H H 45 7.955 7.955 7.544 0.411 18387 13506 1 17 . 1 1 46 46 LYS N N 46 120.318 120.318 118.110 2.208 18387 13507 1 17 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.135 0.137 18387 13508 1 17 . 1 1 46 46 LYS C C 46 177.755 177.755 177.073 0.682 18387 13509 1 17 . 1 1 46 46 LYS CA C 46 58.769 58.769 56.889 1.880 18387 13510 1 17 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.097 1.060 18387 13511 1 17 . 1 1 46 46 LYS H H 46 8.129 8.129 7.606 0.523 18387 13512 1 17 . 1 1 47 47 GLU N N 47 114.278 114.278 117.207 -2.929 18387 13513 1 17 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.588 0.303 18387 13514 1 17 . 1 1 47 47 GLU C C 47 178.701 178.701 177.760 0.941 18387 13515 1 17 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.291 -0.737 18387 13516 1 17 . 1 1 47 47 GLU CB C 47 29.766 29.766 30.428 -0.662 18387 13517 1 17 . 1 1 47 47 GLU H H 47 7.386 7.386 7.453 -0.067 18387 13518 1 17 . 1 1 48 48 THR N N 48 115.665 115.665 117.062 -1.397 18387 13519 1 17 . 1 1 48 48 THR HA H 48 4.048 4.048 4.127 -0.079 18387 13520 1 17 . 1 1 48 48 THR C C 48 172.392 172.392 174.271 -1.879 18387 13521 1 17 . 1 1 48 48 THR CA C 48 69.426 69.426 68.449 0.977 18387 13522 1 17 . 1 1 48 48 THR CB C 48 66.906 66.906 66.198 0.708 18387 13523 1 17 . 1 1 48 48 THR H H 48 7.810 7.810 7.480 0.330 18387 13524 1 17 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.200 0.089 18387 13525 1 17 . 1 1 49 49 PRO C C 49 179.828 179.828 178.792 1.036 18387 13526 1 17 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.105 0.494 18387 13527 1 17 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.840 0.194 18387 13528 1 17 . 1 1 50 50 TYR N N 50 116.950 116.950 116.998 -0.048 18387 13529 1 17 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.295 -0.157 18387 13530 1 17 . 1 1 50 50 TYR C C 50 179.488 179.488 178.834 0.654 18387 13531 1 17 . 1 1 50 50 TYR CA C 50 61.135 61.135 60.664 0.471 18387 13532 1 17 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.456 0.845 18387 13533 1 17 . 1 1 50 50 TYR H H 50 7.071 7.071 7.123 -0.052 18387 13534 1 17 . 1 1 51 51 LEU N N 51 123.989 123.989 120.179 3.810 18387 13535 1 17 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.862 -0.192 18387 13536 1 17 . 1 1 51 51 LEU C C 51 178.072 178.072 178.947 -0.875 18387 13537 1 17 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.666 1.010 18387 13538 1 17 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.303 1.315 18387 13539 1 17 . 1 1 51 51 LEU H H 51 8.243 8.243 7.753 0.490 18387 13540 1 17 . 1 1 52 52 LEU N N 52 119.857 119.857 120.374 -0.517 18387 13541 1 17 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.118 0.209 18387 13542 1 17 . 1 1 52 52 LEU C C 52 178.704 178.704 178.163 0.541 18387 13543 1 17 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.240 0.335 18387 13544 1 17 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.741 0.997 18387 13545 1 17 . 1 1 52 52 LEU H H 52 9.085 9.085 8.466 0.619 18387 13546 1 17 . 1 1 53 53 LYS N N 53 118.658 118.658 118.900 -0.242 18387 13547 1 17 . 1 1 53 53 LYS HA H 53 4.109 4.109 3.948 0.161 18387 13548 1 17 . 1 1 53 53 LYS C C 53 179.786 179.786 178.982 0.804 18387 13549 1 17 . 1 1 53 53 LYS CA C 53 59.721 59.721 60.097 -0.376 18387 13550 1 17 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.239 0.920 18387 13551 1 17 . 1 1 53 53 LYS H H 53 7.807 7.807 8.458 -0.651 18387 13552 1 17 . 1 1 54 54 THR N N 54 116.869 116.869 116.206 0.663 18387 13553 1 17 . 1 1 54 54 THR HA H 54 3.965 3.965 4.564 -0.599 18387 13554 1 17 . 1 1 54 54 THR C C 54 175.328 175.328 176.349 -1.021 18387 13555 1 17 . 1 1 54 54 THR CA C 54 67.683 67.683 67.786 -0.103 18387 13556 1 17 . 1 1 54 54 THR CB C 54 68.452 68.452 68.799 -0.347 18387 13557 1 17 . 1 1 54 54 THR H H 54 7.771 7.771 8.010 -0.239 18387 13558 1 17 . 1 1 55 55 TYR N N 55 122.202 122.202 121.919 0.283 18387 13559 1 17 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.307 -0.035 18387 13560 1 17 . 1 1 55 55 TYR C C 55 176.809 176.809 176.873 -0.064 18387 13561 1 17 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.432 1.305 18387 13562 1 17 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.703 0.577 18387 13563 1 17 . 1 1 55 55 TYR H H 55 9.145 9.145 8.449 0.696 18387 13564 1 17 . 1 1 56 56 ASN N N 56 113.858 113.858 116.666 -2.808 18387 13565 1 17 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.648 -0.385 18387 13566 1 17 . 1 1 56 56 ASN C C 56 177.427 177.427 177.330 0.097 18387 13567 1 17 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.275 0.655 18387 13568 1 17 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.768 -0.814 18387 13569 1 17 . 1 1 56 56 ASN H H 56 8.850 8.850 8.314 0.536 18387 13570 1 17 . 1 1 57 57 ALA N N 57 118.829 118.829 120.389 -1.560 18387 13571 1 17 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.241 -0.177 18387 13572 1 17 . 1 1 57 57 ALA C C 57 180.445 180.445 177.627 2.818 18387 13573 1 17 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.910 0.441 18387 13574 1 17 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.370 -0.176 18387 13575 1 17 . 1 1 57 57 ALA H H 57 7.436 7.436 7.685 -0.249 18387 13576 1 17 . 1 1 58 58 PHE N N 58 112.082 112.082 114.916 -2.834 18387 13577 1 17 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.692 0.229 18387 13578 1 17 . 1 1 58 58 PHE C C 58 176.999 176.999 176.222 0.777 18387 13579 1 17 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.126 0.941 18387 13580 1 17 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.627 0.863 18387 13581 1 17 . 1 1 58 58 PHE H H 58 7.480 7.480 7.951 -0.471 18387 13582 1 17 . 1 1 59 59 LYS N N 59 120.666 120.666 119.640 1.026 18387 13583 1 17 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.131 0.672 18387 13584 1 17 . 1 1 59 59 LYS C C 59 177.157 177.157 176.192 0.965 18387 13585 1 17 . 1 1 59 59 LYS CA C 59 59.081 59.081 57.913 1.169 18387 13586 1 17 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.771 -1.203 18387 13587 1 17 . 1 1 59 59 LYS H H 59 8.411 8.411 7.843 0.568 18387 13588 1 17 . 1 1 60 60 ASP N N 60 118.908 118.908 115.776 3.132 18387 13589 1 17 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.656 0.469 18387 13590 1 17 . 1 1 60 60 ASP C C 60 176.889 176.889 176.003 0.886 18387 13591 1 17 . 1 1 60 60 ASP CA C 60 54.649 54.649 54.048 0.601 18387 13592 1 17 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.707 0.005 18387 13593 1 17 . 1 1 60 60 ASP H H 60 8.574 8.574 8.457 0.117 18387 13594 1 17 . 1 1 61 61 LYS N N 61 121.021 121.021 119.950 1.071 18387 13595 1 17 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.629 0.085 18387 13596 1 17 . 1 1 61 61 LYS C C 61 175.968 175.968 177.165 -1.197 18387 13597 1 17 . 1 1 61 61 LYS CA C 61 55.137 55.137 54.981 0.156 18387 13598 1 17 . 1 1 61 61 LYS CB C 61 33.078 33.078 34.828 -1.750 18387 13599 1 17 . 1 1 61 61 LYS H H 61 8.278 8.278 7.544 0.734 18387 13600 1 17 . 1 1 62 62 GLY C C 62 173.837 173.837 172.820 1.017 18387 13601 1 17 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.200 1.850 18387 13602 1 17 . 1 1 63 63 PHE N N 63 120.476 120.476 124.344 -3.868 18387 13603 1 17 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.647 0.386 18387 13604 1 17 . 1 1 63 63 PHE C C 63 173.613 173.613 173.455 0.158 18387 13605 1 17 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.464 -0.614 18387 13606 1 17 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.885 -0.210 18387 13607 1 17 . 1 1 63 63 PHE H H 63 7.413 7.413 8.395 -0.982 18387 13608 1 17 . 1 1 64 64 THR N N 64 119.903 119.903 118.503 1.400 18387 13609 1 17 . 1 1 64 64 THR HA H 64 4.097 4.097 4.682 -0.585 18387 13610 1 17 . 1 1 64 64 THR C C 64 170.397 170.397 172.633 -2.236 18387 13611 1 17 . 1 1 64 64 THR CA C 64 60.261 60.261 60.397 -0.136 18387 13612 1 17 . 1 1 64 64 THR CB C 64 69.507 69.507 71.895 -2.388 18387 13613 1 17 . 1 1 64 64 THR H H 64 7.665 7.665 8.609 -0.944 18387 13614 1 17 . 1 1 65 65 ILE N N 65 117.277 117.277 124.475 -7.198 18387 13615 1 17 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.323 0.153 18387 13616 1 17 . 1 1 65 65 ILE C C 65 173.056 173.056 174.130 -1.074 18387 13617 1 17 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.764 -1.056 18387 13618 1 17 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.915 0.930 18387 13619 1 17 . 1 1 65 65 ILE H H 65 7.321 7.321 8.895 -1.574 18387 13620 1 17 . 1 1 66 66 TYR N N 66 131.968 131.968 129.814 2.154 18387 13621 1 17 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.102 0.145 18387 13622 1 17 . 1 1 66 66 TYR C C 66 174.074 174.074 174.758 -0.684 18387 13623 1 17 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.594 -0.629 18387 13624 1 17 . 1 1 66 66 TYR CB C 66 41.117 41.117 40.529 0.589 18387 13625 1 17 . 1 1 66 66 TYR H H 66 9.038 9.038 9.153 -0.115 18387 13626 1 17 . 1 1 67 67 GLY N N 67 114.364 114.364 114.940 -0.576 18387 13627 1 17 . 1 1 67 67 GLY C C 67 172.461 172.461 172.613 -0.152 18387 13628 1 17 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.182 0.818 18387 13629 1 17 . 1 1 67 67 GLY H H 67 9.188 9.188 9.286 -0.098 18387 13630 1 17 . 1 1 68 68 VAL N N 68 126.938 126.938 125.104 1.834 18387 13631 1 17 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.686 -0.550 18387 13632 1 17 . 1 1 68 68 VAL C C 68 173.822 173.822 174.617 -0.795 18387 13633 1 17 . 1 1 68 68 VAL CA C 68 61.498 61.498 60.828 0.670 18387 13634 1 17 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.889 0.669 18387 13635 1 17 . 1 1 68 68 VAL H H 68 9.309 9.309 9.169 0.140 18387 13636 1 17 . 1 1 69 69 SER N N 69 118.813 118.813 122.438 -3.625 18387 13637 1 17 . 1 1 69 69 SER HA H 69 5.527 5.527 5.091 0.436 18387 13638 1 17 . 1 1 69 69 SER C C 69 175.753 175.753 173.447 2.306 18387 13639 1 17 . 1 1 69 69 SER CA C 69 54.407 54.407 56.880 -2.474 18387 13640 1 17 . 1 1 69 69 SER CB C 69 63.630 63.630 65.929 -2.299 18387 13641 1 17 . 1 1 69 69 SER H H 69 8.124 8.124 9.177 -1.053 18387 13642 1 17 . 1 1 70 70 THR N N 70 113.861 113.861 116.010 -2.149 18387 13643 1 17 . 1 1 70 70 THR HA H 70 4.381 4.381 4.363 0.018 18387 13644 1 17 . 1 1 70 70 THR C C 70 175.001 175.001 172.936 2.065 18387 13645 1 17 . 1 1 70 70 THR CA C 70 60.259 60.259 59.915 0.344 18387 13646 1 17 . 1 1 70 70 THR CB C 70 67.291 67.291 68.828 -1.537 18387 13647 1 17 . 1 1 70 70 THR H H 70 7.656 7.656 8.239 -0.583 18387 13648 1 17 . 1 1 71 71 ASP N N 71 125.133 125.133 120.698 4.435 18387 13649 1 17 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.588 -0.518 18387 13650 1 17 . 1 1 71 71 ASP C C 71 175.685 175.685 176.566 -0.881 18387 13651 1 17 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.380 3.232 18387 13652 1 17 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.313 1.056 18387 13653 1 17 . 1 1 71 71 ASP H H 71 8.931 8.931 7.585 1.346 18387 13654 1 17 . 1 1 72 72 ARG N N 72 118.814 118.814 119.764 -0.950 18387 13655 1 17 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.138 0.057 18387 13656 1 17 . 1 1 72 72 ARG C C 72 177.300 177.300 176.513 0.787 18387 13657 1 17 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.368 -1.559 18387 13658 1 17 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.855 0.256 18387 13659 1 17 . 1 1 72 72 ARG H H 72 8.057 8.057 8.625 -0.568 18387 13660 1 17 . 1 1 73 73 ARG N N 73 118.174 118.174 116.777 1.397 18387 13661 1 17 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.553 0.201 18387 13662 1 17 . 1 1 73 73 ARG C C 73 176.503 176.503 175.576 0.927 18387 13663 1 17 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.918 -0.382 18387 13664 1 17 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.258 -1.230 18387 13665 1 17 . 1 1 73 73 ARG H H 73 8.639 8.639 7.493 1.146 18387 13666 1 17 . 1 1 74 74 GLU N N 74 127.609 127.609 124.538 3.071 18387 13667 1 17 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.211 -0.132 18387 13668 1 17 . 1 1 74 74 GLU C C 74 178.107 178.107 178.049 0.058 18387 13669 1 17 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.690 -0.905 18387 13670 1 17 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.837 0.261 18387 13671 1 17 . 1 1 74 74 GLU H H 74 9.129 9.129 8.912 0.217 18387 13672 1 17 . 1 1 75 75 GLU N N 75 117.874 117.874 118.956 -1.082 18387 13673 1 17 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.122 -0.022 18387 13674 1 17 . 1 1 75 75 GLU C C 75 178.993 178.993 178.666 0.327 18387 13675 1 17 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.837 0.290 18387 13676 1 17 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.964 0.327 18387 13677 1 17 . 1 1 75 75 GLU H H 75 9.745 9.745 8.755 0.990 18387 13678 1 17 . 1 1 76 76 ASP N N 76 119.182 119.182 119.636 -0.454 18387 13679 1 17 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.481 -0.115 18387 13680 1 17 . 1 1 76 76 ASP C C 76 178.107 178.107 178.092 0.015 18387 13681 1 17 . 1 1 76 76 ASP CA C 76 56.973 56.973 56.847 0.126 18387 13682 1 17 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.474 0.046 18387 13683 1 17 . 1 1 76 76 ASP H H 76 7.004 7.004 8.207 -1.203 18387 13684 1 17 . 1 1 77 77 TRP N N 77 123.008 123.008 122.995 0.013 18387 13685 1 17 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.185 -0.036 18387 13686 1 17 . 1 1 77 77 TRP C C 77 176.236 176.236 178.183 -1.947 18387 13687 1 17 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.339 -0.856 18387 13688 1 17 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.290 -0.755 18387 13689 1 17 . 1 1 77 77 TRP H H 77 7.112 7.112 8.662 -1.550 18387 13690 1 17 . 1 1 78 78 LYS N N 78 115.727 115.727 118.334 -2.607 18387 13691 1 17 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.485 -0.240 18387 13692 1 17 . 1 1 78 78 LYS C C 78 179.426 179.426 179.005 0.421 18387 13693 1 17 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.446 0.986 18387 13694 1 17 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.687 1.058 18387 13695 1 17 . 1 1 78 78 LYS H H 78 8.431 8.431 8.641 -0.210 18387 13696 1 17 . 1 1 79 79 LYS N N 79 118.321 118.321 119.742 -1.421 18387 13697 1 17 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.936 0.084 18387 13698 1 17 . 1 1 79 79 LYS C C 79 178.239 178.239 178.500 -0.261 18387 13699 1 17 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.440 -0.373 18387 13700 1 17 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.514 -0.051 18387 13701 1 17 . 1 1 79 79 LYS H H 79 7.690 7.690 7.930 -0.240 18387 13702 1 17 . 1 1 80 80 ALA N N 80 120.679 120.679 122.492 -1.813 18387 13703 1 17 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.544 -0.389 18387 13704 1 17 . 1 1 80 80 ALA C C 80 178.811 178.811 180.153 -1.342 18387 13705 1 17 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.936 0.151 18387 13706 1 17 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.542 0.216 18387 13707 1 17 . 1 1 80 80 ALA H H 80 7.560 7.560 8.368 -0.808 18387 13708 1 17 . 1 1 81 81 ILE N N 81 118.019 118.019 118.148 -0.129 18387 13709 1 17 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.262 0.140 18387 13710 1 17 . 1 1 81 81 ILE C C 81 178.113 178.113 177.738 0.375 18387 13711 1 17 . 1 1 81 81 ILE CA C 81 64.520 64.520 65.284 -0.764 18387 13712 1 17 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.307 0.896 18387 13713 1 17 . 1 1 81 81 ILE H H 81 7.514 7.514 8.126 -0.612 18387 13714 1 17 . 1 1 82 82 GLU N N 82 117.252 117.252 119.874 -2.622 18387 13715 1 17 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.851 0.243 18387 13716 1 17 . 1 1 82 82 GLU C C 82 179.558 179.558 179.151 0.407 18387 13717 1 17 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.959 -0.379 18387 13718 1 17 . 1 1 82 82 GLU CB C 82 29.383 29.383 28.983 0.400 18387 13719 1 17 . 1 1 82 82 GLU H H 82 7.401 7.401 7.593 -0.192 18387 13720 1 17 . 1 1 83 83 GLU N N 83 119.340 119.340 119.667 -0.327 18387 13721 1 17 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.968 -0.070 18387 13722 1 17 . 1 1 83 83 GLU C C 83 178.740 178.740 178.646 0.094 18387 13723 1 17 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.991 0.008 18387 13724 1 17 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.654 0.266 18387 13725 1 17 . 1 1 83 83 GLU H H 83 8.191 8.191 8.162 0.029 18387 13726 1 17 . 1 1 84 84 ASP N N 84 118.449 118.449 114.820 3.629 18387 13727 1 17 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.534 -0.260 18387 13728 1 17 . 1 1 84 84 ASP C C 84 175.597 175.597 175.084 0.513 18387 13729 1 17 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.119 0.928 18387 13730 1 17 . 1 1 84 84 ASP CB C 84 39.896 39.896 40.500 -0.604 18387 13731 1 17 . 1 1 84 84 ASP H H 84 8.252 8.252 7.848 0.404 18387 13732 1 17 . 1 1 85 85 LYS N N 85 116.410 116.410 115.732 0.678 18387 13733 1 17 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.195 -0.022 18387 13734 1 17 . 1 1 85 85 LYS C C 85 176.856 176.856 175.486 1.370 18387 13735 1 17 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.326 -0.353 18387 13736 1 17 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.502 -0.634 18387 13737 1 17 . 1 1 85 85 LYS H H 85 7.890 7.890 7.314 0.576 18387 13738 1 17 . 1 1 86 86 SER N N 86 112.295 112.295 115.184 -2.889 18387 13739 1 17 . 1 1 86 86 SER HA H 86 3.139 3.139 3.506 -0.367 18387 13740 1 17 . 1 1 86 86 SER C C 86 175.805 175.805 172.829 2.976 18387 13741 1 17 . 1 1 86 86 SER CA C 86 53.637 53.637 56.693 -3.056 18387 13742 1 17 . 1 1 86 86 SER CB C 86 60.736 60.736 60.911 -0.175 18387 13743 1 17 . 1 1 86 86 SER H H 86 7.327 7.327 7.581 -0.254 18387 13744 1 17 . 1 1 87 87 TYR N N 87 120.962 120.962 125.551 -4.589 18387 13745 1 17 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.157 0.148 18387 13746 1 17 . 1 1 87 87 TYR C C 87 177.064 177.064 174.839 2.225 18387 13747 1 17 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.853 -0.631 18387 13748 1 17 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.217 0.136 18387 13749 1 17 . 1 1 87 87 TYR H H 87 6.933 6.933 7.593 -0.660 18387 13750 1 17 . 1 1 88 88 TRP N N 88 118.597 118.597 120.440 -1.843 18387 13751 1 17 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.599 0.252 18387 13752 1 17 . 1 1 88 88 TRP C C 88 175.456 175.456 174.432 1.024 18387 13753 1 17 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.959 1.277 18387 13754 1 17 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.450 -3.723 18387 13755 1 17 . 1 1 88 88 TRP H H 88 6.552 6.552 6.951 -0.399 18387 13756 1 17 . 1 1 89 89 ASN N N 89 118.067 118.067 120.633 -2.566 18387 13757 1 17 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.773 0.276 18387 13758 1 17 . 1 1 89 89 ASN C C 89 173.773 173.773 174.620 -0.847 18387 13759 1 17 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.010 2.446 18387 13760 1 17 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.286 0.911 18387 13761 1 17 . 1 1 89 89 ASN H H 89 7.864 7.864 8.636 -0.772 18387 13762 1 17 . 1 1 90 90 GLN N N 90 125.392 125.392 124.093 1.299 18387 13763 1 17 . 1 1 90 90 GLN HA H 90 5.497 5.497 4.958 0.539 18387 13764 1 17 . 1 1 90 90 GLN C C 90 176.491 176.491 175.393 1.098 18387 13765 1 17 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.744 0.716 18387 13766 1 17 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.354 -1.127 18387 13767 1 17 . 1 1 90 90 GLN H H 90 7.904 7.904 8.028 -0.124 18387 13768 1 17 . 1 1 91 91 VAL N N 91 114.434 114.434 117.449 -3.015 18387 13769 1 17 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.974 0.506 18387 13770 1 17 . 1 1 91 91 VAL C C 91 174.248 174.248 173.456 0.792 18387 13771 1 17 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.177 -0.171 18387 13772 1 17 . 1 1 91 91 VAL CB C 91 36.638 36.638 34.804 1.834 18387 13773 1 17 . 1 1 91 91 VAL H H 91 9.585 9.585 9.050 0.535 18387 13774 1 17 . 1 1 92 92 LEU N N 92 126.910 126.910 124.983 1.927 18387 13775 1 17 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.498 -0.429 18387 13776 1 17 . 1 1 92 92 LEU C C 92 177.696 177.696 175.729 1.967 18387 13777 1 17 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.707 0.137 18387 13778 1 17 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.073 -0.126 18387 13779 1 17 . 1 1 92 92 LEU H H 92 8.941 8.941 8.733 0.208 18387 13780 1 17 . 1 1 93 93 LEU N N 93 125.673 125.673 127.453 -1.780 18387 13781 1 17 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.244 0.156 18387 13782 1 17 . 1 1 93 93 LEU C C 93 177.291 177.291 176.711 0.580 18387 13783 1 17 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.559 -0.608 18387 13784 1 17 . 1 1 93 93 LEU CB C 93 43.179 43.179 42.043 1.136 18387 13785 1 17 . 1 1 93 93 LEU H H 93 8.038 8.038 8.534 -0.496 18387 13786 1 17 . 1 1 94 94 GLN N N 94 122.206 122.206 121.200 1.006 18387 13787 1 17 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.218 0.019 18387 13788 1 17 . 1 1 94 94 GLN C C 94 178.246 178.246 176.916 1.330 18387 13789 1 17 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.061 -0.286 18387 13790 1 17 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.601 -0.346 18387 13791 1 17 . 1 1 94 94 GLN H H 94 9.298 9.298 8.557 0.741 18387 13792 1 17 . 1 1 95 95 LYS N N 95 122.668 122.668 122.109 0.559 18387 13793 1 17 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.903 0.063 18387 13794 1 17 . 1 1 95 95 LYS C C 95 178.787 178.787 178.650 0.137 18387 13795 1 17 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.688 0.384 18387 13796 1 17 . 1 1 95 95 LYS CB C 95 32.465 32.465 32.256 0.209 18387 13797 1 17 . 1 1 95 95 LYS H H 95 8.645 8.645 8.681 -0.036 18387 13798 1 17 . 1 1 96 96 ASP N N 96 116.775 116.775 117.180 -0.405 18387 13799 1 17 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.603 -0.023 18387 13800 1 17 . 1 1 96 96 ASP C C 96 176.220 176.220 177.559 -1.339 18387 13801 1 17 . 1 1 96 96 ASP CA C 96 56.346 56.346 55.749 0.597 18387 13802 1 17 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.754 -0.197 18387 13803 1 17 . 1 1 96 96 ASP H H 96 8.606 8.606 8.186 0.420 18387 13804 1 17 . 1 1 97 97 ASP N N 97 118.213 118.213 119.997 -1.784 18387 13805 1 17 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.525 0.402 18387 13806 1 17 . 1 1 97 97 ASP C C 97 176.954 176.954 178.137 -1.183 18387 13807 1 17 . 1 1 97 97 ASP CA C 97 55.359 55.359 55.964 -0.605 18387 13808 1 17 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.852 1.472 18387 13809 1 17 . 1 1 97 97 ASP H H 97 7.988 7.988 7.916 0.072 18387 13810 1 17 . 1 1 98 98 VAL N N 98 118.907 118.907 119.895 -0.988 18387 13811 1 17 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.574 -0.158 18387 13812 1 17 . 1 1 98 98 VAL C C 98 176.470 176.470 177.727 -1.257 18387 13813 1 17 . 1 1 98 98 VAL CA C 98 67.778 67.778 67.241 0.537 18387 13814 1 17 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.202 1.189 18387 13815 1 17 . 1 1 98 98 VAL H H 98 7.098 7.098 8.335 -1.237 18387 13816 1 17 . 1 1 99 99 LYS N N 99 117.909 117.909 119.026 -1.117 18387 13817 1 17 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.863 0.080 18387 13818 1 17 . 1 1 99 99 LYS C C 99 178.762 178.762 178.191 0.571 18387 13819 1 17 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.676 0.469 18387 13820 1 17 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.736 0.276 18387 13821 1 17 . 1 1 99 99 LYS H H 99 8.304 8.304 8.431 -0.127 18387 13822 1 17 . 1 1 100 100 ASP N N 100 117.843 117.843 118.335 -0.492 18387 13823 1 17 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.416 0.062 18387 13824 1 17 . 1 1 100 100 ASP C C 100 179.694 179.694 178.704 0.990 18387 13825 1 17 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.081 0.445 18387 13826 1 17 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.404 0.424 18387 13827 1 17 . 1 1 100 100 ASP H H 100 8.024 8.024 7.591 0.433 18387 13828 1 17 . 1 1 101 101 VAL N N 101 122.202 122.202 121.064 1.138 18387 13829 1 17 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.720 0.275 18387 13830 1 17 . 1 1 101 101 VAL C C 101 178.533 178.533 178.157 0.376 18387 13831 1 17 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.732 0.270 18387 13832 1 17 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.980 0.057 18387 13833 1 17 . 1 1 101 101 VAL H H 101 8.205 8.205 7.928 0.277 18387 13834 1 17 . 1 1 102 102 LEU N N 102 118.798 118.798 118.931 -0.133 18387 13835 1 17 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.643 0.137 18387 13836 1 17 . 1 1 102 102 LEU C C 102 180.254 180.254 178.912 1.342 18387 13837 1 17 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.888 1.053 18387 13838 1 17 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.196 -0.756 18387 13839 1 17 . 1 1 102 102 LEU H H 102 8.422 8.422 7.795 0.627 18387 13840 1 17 . 1 1 103 103 GLU N N 103 116.915 116.915 119.696 -2.781 18387 13841 1 17 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.854 0.281 18387 13842 1 17 . 1 1 103 103 GLU C C 103 180.910 180.910 179.155 1.755 18387 13843 1 17 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.129 0.274 18387 13844 1 17 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.174 0.557 18387 13845 1 17 . 1 1 103 103 GLU H H 103 8.262 8.262 7.894 0.368 18387 13846 1 17 . 1 1 104 104 SER N N 104 117.866 117.866 115.871 1.995 18387 13847 1 17 . 1 1 104 104 SER HA H 104 4.216 4.216 4.056 0.160 18387 13848 1 17 . 1 1 104 104 SER C C 104 175.455 175.455 175.584 -0.129 18387 13849 1 17 . 1 1 104 104 SER CA C 104 62.019 62.019 61.758 0.261 18387 13850 1 17 . 1 1 104 104 SER CB C 104 62.891 62.891 63.110 -0.219 18387 13851 1 17 . 1 1 104 104 SER H H 104 8.544 8.544 7.880 0.664 18387 13852 1 17 . 1 1 105 105 TYR N N 105 117.278 117.278 115.544 1.734 18387 13853 1 17 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.407 -0.135 18387 13854 1 17 . 1 1 105 105 TYR C C 105 174.750 174.750 175.274 -0.524 18387 13855 1 17 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.184 1.675 18387 13856 1 17 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.632 2.079 18387 13857 1 17 . 1 1 105 105 TYR H H 105 7.691 7.691 7.416 0.275 18387 13858 1 17 . 1 1 106 106 CYS N N 106 116.897 116.897 116.081 0.816 18387 13859 1 17 . 1 1 106 106 CYS HA H 106 3.895 3.895 3.996 -0.101 18387 13860 1 17 . 1 1 106 106 CYS C C 106 174.056 174.056 173.717 0.339 18387 13861 1 17 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.374 -0.764 18387 13862 1 17 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.639 0.393 18387 13863 1 17 . 1 1 106 106 CYS H H 106 7.862 7.862 8.475 -0.613 18387 13864 1 17 . 1 1 107 107 ILE N N 107 118.885 118.885 120.130 -1.245 18387 13865 1 17 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.575 -0.236 18387 13866 1 17 . 1 1 107 107 ILE C C 107 176.793 176.793 175.566 1.227 18387 13867 1 17 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.022 1.723 18387 13868 1 17 . 1 1 107 107 ILE CB C 107 38.079 38.079 36.201 1.878 18387 13869 1 17 . 1 1 107 107 ILE H H 107 7.707 7.707 7.824 -0.117 18387 13870 1 17 . 1 1 108 108 VAL N N 108 123.983 123.983 125.413 -1.430 18387 13871 1 17 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.016 0.258 18387 13872 1 17 . 1 1 108 108 VAL C C 108 175.476 175.476 176.307 -0.831 18387 13873 1 17 . 1 1 108 108 VAL CA C 108 61.624 61.624 62.843 -1.219 18387 13874 1 17 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.396 0.612 18387 13875 1 17 . 1 1 108 108 VAL H H 108 8.656 8.656 7.879 0.777 18387 13876 1 17 . 1 1 109 109 GLY N N 109 110.120 110.120 106.991 3.129 18387 13877 1 17 . 1 1 109 109 GLY C C 109 169.982 169.982 172.196 -2.214 18387 13878 1 17 . 1 1 109 109 GLY CA C 109 44.603 44.603 44.810 -0.207 18387 13879 1 17 . 1 1 109 109 GLY H H 109 7.500 7.500 7.361 0.139 18387 13880 1 17 . 1 1 110 110 PHE N N 110 115.276 115.276 118.909 -3.633 18387 13881 1 17 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.294 -0.520 18387 13882 1 17 . 1 1 110 110 PHE C C 110 174.361 174.361 175.459 -1.098 18387 13883 1 17 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.552 0.135 18387 13884 1 17 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.944 1.007 18387 13885 1 17 . 1 1 110 110 PHE H H 110 8.203 8.203 8.664 -0.461 18387 13886 1 17 . 1 1 111 111 PRO HA H 111 5.359 5.359 4.951 0.408 18387 13887 1 17 . 1 1 111 111 PRO C C 111 175.691 175.691 175.988 -0.297 18387 13888 1 17 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.090 0.067 18387 13889 1 17 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.234 2.070 18387 13890 1 17 . 1 1 112 112 HIS N N 112 123.708 123.708 116.384 7.324 18387 13891 1 17 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.876 0.087 18387 13892 1 17 . 1 1 112 112 HIS C C 112 173.649 173.649 173.899 -0.250 18387 13893 1 17 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.570 0.504 18387 13894 1 17 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.759 -0.562 18387 13895 1 17 . 1 1 112 112 HIS H H 112 8.952 8.952 8.391 0.561 18387 13896 1 17 . 1 1 113 113 ILE N N 113 128.596 128.596 125.596 3.000 18387 13897 1 17 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.378 0.319 18387 13898 1 17 . 1 1 113 113 ILE C C 113 176.130 176.130 174.307 1.823 18387 13899 1 17 . 1 1 113 113 ILE CA C 113 60.995 60.995 59.984 1.011 18387 13900 1 17 . 1 1 113 113 ILE CB C 113 38.055 38.055 41.626 -3.571 18387 13901 1 17 . 1 1 113 113 ILE H H 113 8.808 8.808 8.390 0.418 18387 13902 1 17 . 1 1 114 114 ILE N N 114 119.668 119.668 120.390 -0.722 18387 13903 1 17 . 1 1 114 114 ILE HA H 114 4.973 4.973 5.309 -0.336 18387 13904 1 17 . 1 1 114 114 ILE C C 114 173.186 173.186 173.436 -0.250 18387 13905 1 17 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.606 0.124 18387 13906 1 17 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.787 -0.247 18387 13907 1 17 . 1 1 114 114 ILE H H 114 8.721 8.721 8.995 -0.274 18387 13908 1 17 . 1 1 115 115 LEU N N 115 122.770 122.770 124.365 -1.595 18387 13909 1 17 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.085 0.190 18387 13910 1 17 . 1 1 115 115 LEU C C 115 173.601 173.601 174.598 -0.997 18387 13911 1 17 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.325 0.457 18387 13912 1 17 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.780 1.354 18387 13913 1 17 . 1 1 115 115 LEU H H 115 8.665 8.665 8.971 -0.306 18387 13914 1 17 . 1 1 116 116 VAL N N 116 130.411 130.411 127.980 2.431 18387 13915 1 17 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.929 -0.071 18387 13916 1 17 . 1 1 116 116 VAL C C 116 174.565 174.565 175.566 -1.001 18387 13917 1 17 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.945 -0.141 18387 13918 1 17 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.564 0.351 18387 13919 1 17 . 1 1 116 116 VAL H H 116 9.472 9.472 9.229 0.243 18387 13920 1 17 . 1 1 117 117 ASP N N 117 127.896 127.896 127.322 0.574 18387 13921 1 17 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.835 -0.443 18387 13922 1 17 . 1 1 117 117 ASP C C 117 176.567 176.567 175.846 0.721 18387 13923 1 17 . 1 1 117 117 ASP CA C 117 52.600 52.600 51.847 0.753 18387 13924 1 17 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.340 0.244 18387 13925 1 17 . 1 1 117 117 ASP H H 117 9.429 9.429 8.747 0.682 18387 13926 1 17 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.140 0.054 18387 13927 1 17 . 1 1 118 118 PRO C C 118 177.534 177.534 178.504 -0.970 18387 13928 1 17 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.420 -0.255 18387 13929 1 17 . 1 1 118 118 PRO CB C 118 32.813 32.813 32.007 0.806 18387 13930 1 17 . 1 1 119 119 GLU N N 119 114.015 114.015 117.216 -3.201 18387 13931 1 17 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.096 0.243 18387 13932 1 17 . 1 1 119 119 GLU C C 119 176.722 176.722 177.934 -1.212 18387 13933 1 17 . 1 1 119 119 GLU CA C 119 55.639 55.639 58.363 -2.724 18387 13934 1 17 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.857 0.720 18387 13935 1 17 . 1 1 119 119 GLU H H 119 7.733 7.733 8.527 -0.794 18387 13936 1 17 . 1 1 120 120 GLY N N 120 108.218 108.218 105.988 2.230 18387 13937 1 17 . 1 1 120 120 GLY C C 120 174.110 174.110 172.957 1.153 18387 13938 1 17 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.706 0.690 18387 13939 1 17 . 1 1 120 120 GLY H H 120 8.588 8.588 8.938 -0.350 18387 13940 1 17 . 1 1 121 121 LYS N N 121 121.778 121.778 119.901 1.877 18387 13941 1 17 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.069 -0.210 18387 13942 1 17 . 1 1 121 121 LYS C C 121 176.458 176.458 175.549 0.909 18387 13943 1 17 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.264 0.698 18387 13944 1 17 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.605 -2.153 18387 13945 1 17 . 1 1 121 121 LYS H H 121 8.600 8.600 8.807 -0.207 18387 13946 1 17 . 1 1 122 122 ILE N N 122 122.058 122.058 123.894 -1.836 18387 13947 1 17 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.600 -0.328 18387 13948 1 17 . 1 1 122 122 ILE C C 122 177.084 177.084 177.675 -0.591 18387 13949 1 17 . 1 1 122 122 ILE CA C 122 62.819 62.819 61.640 1.179 18387 13950 1 17 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.494 2.154 18387 13951 1 17 . 1 1 122 122 ILE H H 122 9.006 9.006 9.094 -0.088 18387 13952 1 17 . 1 1 123 123 VAL N N 123 120.561 120.561 123.808 -3.247 18387 13953 1 17 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.013 0.742 18387 13954 1 17 . 1 1 123 123 VAL C C 123 175.584 175.584 175.141 0.443 18387 13955 1 17 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.649 -2.498 18387 13956 1 17 . 1 1 123 123 VAL CB C 123 33.401 33.401 31.654 1.746 18387 13957 1 17 . 1 1 123 123 VAL H H 123 9.054 9.054 8.107 0.947 18387 13958 1 17 . 1 1 124 124 ALA N N 124 121.102 121.102 122.553 -1.451 18387 13959 1 17 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.595 0.062 18387 13960 1 17 . 1 1 124 124 ALA C C 124 174.832 174.832 175.003 -0.171 18387 13961 1 17 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.022 1.438 18387 13962 1 17 . 1 1 124 124 ALA CB C 124 22.830 22.830 20.960 1.870 18387 13963 1 17 . 1 1 124 124 ALA H H 124 7.793 7.793 7.377 0.416 18387 13964 1 17 . 1 1 125 125 LYS N N 125 117.637 117.637 125.131 -7.494 18387 13965 1 17 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.605 0.428 18387 13966 1 17 . 1 1 125 125 LYS C C 125 173.417 173.417 175.677 -2.260 18387 13967 1 17 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.097 0.044 18387 13968 1 17 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.547 1.104 18387 13969 1 17 . 1 1 125 125 LYS H H 125 8.872 8.872 8.477 0.395 18387 13970 1 17 . 1 1 126 126 GLU N N 126 115.236 115.236 117.505 -2.269 18387 13971 1 17 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.680 0.318 18387 13972 1 17 . 1 1 126 126 GLU C C 126 175.998 175.998 175.687 0.311 18387 13973 1 17 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.252 -0.290 18387 13974 1 17 . 1 1 126 126 GLU CB C 126 26.435 26.435 26.249 0.186 18387 13975 1 17 . 1 1 126 126 GLU H H 126 7.941 7.941 8.695 -0.754 18387 13976 1 17 . 1 1 127 127 LEU N N 127 118.584 118.584 119.553 -0.969 18387 13977 1 17 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.227 0.155 18387 13978 1 17 . 1 1 127 127 LEU C C 127 176.766 176.766 175.776 0.990 18387 13979 1 17 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.005 -0.397 18387 13980 1 17 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.740 1.223 18387 13981 1 17 . 1 1 127 127 LEU H H 127 7.300 7.300 7.832 -0.532 18387 13982 1 17 . 1 1 128 128 ARG N N 128 118.625 118.625 120.236 -1.611 18387 13983 1 17 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.580 -0.105 18387 13984 1 17 . 1 1 128 128 ARG C C 128 177.113 177.113 176.705 0.408 18387 13985 1 17 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.371 -0.981 18387 13986 1 17 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.902 1.710 18387 13987 1 17 . 1 1 128 128 ARG H H 128 7.929 7.929 8.207 -0.278 18387 13988 1 17 . 1 1 129 129 GLY N N 129 114.010 114.010 114.992 -0.982 18387 13989 1 17 . 1 1 129 129 GLY C C 129 175.931 175.931 174.679 1.252 18387 13990 1 17 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.480 -1.019 18387 13991 1 17 . 1 1 129 129 GLY H H 129 10.649 10.649 8.616 2.033 18387 13992 1 17 . 1 1 130 130 ASP N N 130 123.975 123.975 121.469 2.506 18387 13993 1 17 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.359 0.173 18387 13994 1 17 . 1 1 130 130 ASP C C 130 177.507 177.507 177.393 0.114 18387 13995 1 17 . 1 1 130 130 ASP CA C 130 57.372 57.372 55.636 1.736 18387 13996 1 17 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.498 0.405 18387 13997 1 17 . 1 1 130 130 ASP H H 130 8.540 8.540 8.067 0.473 18387 13998 1 17 . 1 1 131 131 ASP N N 131 116.806 116.806 120.797 -3.991 18387 13999 1 17 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.290 0.280 18387 14000 1 17 . 1 1 131 131 ASP C C 131 179.038 179.038 178.577 0.461 18387 14001 1 17 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.642 -0.659 18387 14002 1 17 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.326 0.608 18387 14003 1 17 . 1 1 131 131 ASP H H 131 7.907 7.907 7.617 0.290 18387 14004 1 17 . 1 1 132 132 LEU N N 132 123.869 123.869 118.524 5.345 18387 14005 1 17 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.063 -0.272 18387 14006 1 17 . 1 1 132 132 LEU C C 132 176.343 176.343 178.121 -1.778 18387 14007 1 17 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.664 1.120 18387 14008 1 17 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.826 0.942 18387 14009 1 17 . 1 1 132 132 LEU H H 132 7.542 7.542 7.880 -0.338 18387 14010 1 17 . 1 1 133 133 TYR N N 133 120.042 120.042 120.448 -0.406 18387 14011 1 17 . 1 1 133 133 TYR HA H 133 3.996 3.996 3.973 0.023 18387 14012 1 17 . 1 1 133 133 TYR C C 133 177.426 177.426 177.413 0.013 18387 14013 1 17 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.189 -0.056 18387 14014 1 17 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.342 0.235 18387 14015 1 17 . 1 1 133 133 TYR H H 133 7.384 7.384 7.468 -0.084 18387 14016 1 17 . 1 1 134 134 ASN N N 134 114.936 114.936 116.873 -1.937 18387 14017 1 17 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.517 -0.114 18387 14018 1 17 . 1 1 134 134 ASN C C 134 178.703 178.703 178.204 0.499 18387 14019 1 17 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.989 -1.180 18387 14020 1 17 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.410 -0.202 18387 14021 1 17 . 1 1 134 134 ASN H H 134 8.399 8.399 8.471 -0.072 18387 14022 1 17 . 1 1 135 135 THR N N 135 117.387 117.387 118.347 -0.960 18387 14023 1 17 . 1 1 135 135 THR HA H 135 3.920 3.920 4.046 -0.126 18387 14024 1 17 . 1 1 135 135 THR C C 135 175.323 175.323 176.587 -1.264 18387 14025 1 17 . 1 1 135 135 THR CA C 135 67.402 67.402 66.872 0.530 18387 14026 1 17 . 1 1 135 135 THR CB C 135 68.111 68.111 68.995 -0.884 18387 14027 1 17 . 1 1 135 135 THR H H 135 8.265 8.265 8.089 0.176 18387 14028 1 17 . 1 1 136 136 VAL N N 136 121.207 121.207 121.791 -0.584 18387 14029 1 17 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.530 -0.515 18387 14030 1 17 . 1 1 136 136 VAL C C 136 176.457 176.457 177.519 -1.062 18387 14031 1 17 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.843 1.429 18387 14032 1 17 . 1 1 136 136 VAL CB C 136 30.941 30.941 31.034 -0.093 18387 14033 1 17 . 1 1 136 136 VAL H H 136 7.595 7.595 8.272 -0.677 18387 14034 1 17 . 1 1 137 137 GLU N N 137 118.266 118.266 119.522 -1.256 18387 14035 1 17 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.110 -1.428 18387 14036 1 17 . 1 1 137 137 GLU C C 137 177.482 177.482 178.749 -1.267 18387 14037 1 17 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.892 0.038 18387 14038 1 17 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.284 0.498 18387 14039 1 17 . 1 1 137 137 GLU H H 137 8.114 8.114 8.504 -0.390 18387 14040 1 17 . 1 1 138 138 LYS N N 138 116.431 116.431 119.602 -3.171 18387 14041 1 17 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.989 -0.221 18387 14042 1 17 . 1 1 138 138 LYS C C 138 179.193 179.193 178.635 0.558 18387 14043 1 17 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.502 -0.462 18387 14044 1 17 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.422 -0.264 18387 14045 1 17 . 1 1 138 138 LYS H H 138 7.133 7.133 7.558 -0.425 18387 14046 1 17 . 1 1 139 139 PHE N N 139 116.336 116.336 119.823 -3.487 18387 14047 1 17 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.148 -0.138 18387 14048 1 17 . 1 1 139 139 PHE C C 139 177.855 177.855 177.555 0.300 18387 14049 1 17 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.485 0.899 18387 14050 1 17 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.302 0.050 18387 14051 1 17 . 1 1 139 139 PHE H H 139 7.338 7.338 8.056 -0.718 18387 14052 1 17 . 1 1 140 140 VAL N N 140 116.491 116.491 116.604 -0.113 18387 14053 1 17 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.307 0.217 18387 14054 1 17 . 1 1 140 140 VAL C C 140 177.747 177.747 178.106 -0.359 18387 14055 1 17 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.888 -0.646 18387 14056 1 17 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.074 0.316 18387 14057 1 17 . 1 1 140 140 VAL H H 140 8.332 8.332 8.387 -0.055 18387 14058 1 17 . 1 1 141 141 ASN N N 141 116.956 116.956 117.865 -0.909 18387 14059 1 17 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.608 0.218 18387 14060 1 17 . 1 1 141 141 ASN C C 141 176.997 176.997 177.899 -0.902 18387 14061 1 17 . 1 1 141 141 ASN CA C 141 53.677 53.677 56.034 -2.357 18387 14062 1 17 . 1 1 141 141 ASN CB C 141 38.448 38.448 38.569 -0.121 18387 14063 1 17 . 1 1 141 141 ASN H H 141 7.862 7.862 8.010 -0.148 18387 14064 1 17 . 1 1 142 142 GLY N N 142 107.938 107.938 106.273 1.665 18387 14065 1 17 . 1 1 142 142 GLY C C 142 174.336 174.336 174.102 0.234 18387 14066 1 17 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.942 1.043 18387 14067 1 17 . 1 1 142 142 GLY H H 142 7.466 7.466 8.154 -0.688 18387 14068 1 17 . 1 1 143 143 ALA N N 143 123.441 123.441 124.390 -0.949 18387 14069 1 17 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.301 0.040 18387 14070 1 17 . 1 1 143 143 ALA C C 143 178.212 178.212 176.901 1.311 18387 14071 1 17 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.478 0.348 18387 14072 1 17 . 1 1 143 143 ALA CB C 143 19.244 19.244 17.112 2.132 18387 14073 1 17 . 1 1 143 143 ALA H H 143 7.950 7.950 8.131 -0.181 18387 14074 1 17 . 1 1 144 144 LYS N N 144 120.149 120.149 120.655 -0.506 18387 14075 1 17 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.321 -0.026 18387 14076 1 17 . 1 1 144 144 LYS C C 144 176.945 176.945 175.504 1.441 18387 14077 1 17 . 1 1 144 144 LYS CA C 144 56.519 56.519 55.726 0.793 18387 14078 1 17 . 1 1 144 144 LYS CB C 144 33.030 33.030 33.591 -0.561 18387 14079 1 17 . 1 1 144 144 LYS H H 144 8.187 8.187 8.074 0.113 18387 14080 1 17 . 1 1 145 145 GLU N N 145 120.992 120.992 121.451 -0.459 18387 14081 1 17 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.385 -0.090 18387 14082 1 17 . 1 1 145 145 GLU C C 145 177.116 177.116 177.001 0.115 18387 14083 1 17 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.586 0.317 18387 14084 1 17 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.781 1.461 18387 14085 1 17 . 1 1 145 145 GLU H H 145 8.363 8.363 8.402 -0.039 18387 14086 1 17 . 1 1 146 146 GLY N N 146 109.467 109.467 110.922 -1.455 18387 14087 1 17 . 1 1 146 146 GLY C C 146 174.108 174.108 174.406 -0.298 18387 14088 1 17 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.348 0.053 18387 14089 1 17 . 1 1 146 146 GLY H H 146 8.371 8.371 8.335 0.036 18387 14090 1 17 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.187 0.422 18387 14091 1 17 . 1 1 151 151 HIS C C 151 174.258 174.258 173.665 0.593 18387 14092 1 17 . 1 1 151 151 HIS CA C 151 56.165 56.165 55.803 0.362 18387 14093 1 17 . 1 1 151 151 HIS CB C 151 30.833 30.833 29.634 1.199 18387 14094 1 18 . 1 1 2 2 SER HA H 2 3.992 3.992 4.261 -0.269 18387 14095 1 18 . 1 1 2 2 SER CA C 2 57.555 57.555 59.486 -1.931 18387 14096 1 18 . 1 1 2 2 SER CB C 2 64.977 64.977 63.296 1.681 18387 14097 1 18 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.476 -0.037 18387 14098 1 18 . 1 1 3 3 LEU C C 3 176.631 176.631 175.073 1.558 18387 14099 1 18 . 1 1 3 3 LEU CA C 3 54.564 54.564 53.953 0.611 18387 14100 1 18 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.880 -1.156 18387 14101 1 18 . 1 1 4 4 ALA N N 4 125.483 125.483 122.544 2.939 18387 14102 1 18 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.756 -0.377 18387 14103 1 18 . 1 1 4 4 ALA C C 4 179.642 179.642 175.674 3.968 18387 14104 1 18 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.679 0.056 18387 14105 1 18 . 1 1 4 4 ALA CB C 4 19.752 19.752 21.427 -1.675 18387 14106 1 18 . 1 1 4 4 ALA H H 4 8.483 8.483 8.219 0.264 18387 14107 1 18 . 1 1 5 5 THR HA H 5 3.845 3.845 5.039 -1.194 18387 14108 1 18 . 1 1 5 5 THR C C 5 175.487 175.487 175.470 0.017 18387 14109 1 18 . 1 1 5 5 THR CA C 5 64.531 64.531 61.026 3.505 18387 14110 1 18 . 1 1 5 5 THR CB C 5 68.108 68.108 69.145 -1.037 18387 14111 1 18 . 1 1 6 6 GLY N N 6 114.298 114.298 115.820 -1.522 18387 14112 1 18 . 1 1 6 6 GLY C C 6 174.324 174.324 174.134 0.190 18387 14113 1 18 . 1 1 6 6 GLY CA C 6 44.835 44.835 44.994 -0.159 18387 14114 1 18 . 1 1 6 6 GLY H H 6 9.511 9.511 9.091 0.420 18387 14115 1 18 . 1 1 7 7 SER N N 7 115.270 115.270 116.599 -1.329 18387 14116 1 18 . 1 1 7 7 SER HA H 7 4.500 4.500 4.377 0.123 18387 14117 1 18 . 1 1 7 7 SER C C 7 173.315 173.315 174.638 -1.323 18387 14118 1 18 . 1 1 7 7 SER CA C 7 58.915 58.915 58.045 0.870 18387 14119 1 18 . 1 1 7 7 SER CB C 7 64.308 64.308 63.848 0.460 18387 14120 1 18 . 1 1 7 7 SER H H 7 7.736 7.736 7.707 0.029 18387 14121 1 18 . 1 1 8 8 VAL N N 8 123.708 123.708 125.362 -1.654 18387 14122 1 18 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.073 -0.241 18387 14123 1 18 . 1 1 8 8 VAL C C 8 176.673 176.673 175.785 0.888 18387 14124 1 18 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.709 0.964 18387 14125 1 18 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.830 -0.608 18387 14126 1 18 . 1 1 8 8 VAL H H 8 8.632 8.632 8.348 0.284 18387 14127 1 18 . 1 1 9 9 ALA N N 9 133.040 133.040 131.808 1.232 18387 14128 1 18 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.498 -0.235 18387 14129 1 18 . 1 1 9 9 ALA C C 9 175.404 175.404 175.417 -0.013 18387 14130 1 18 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.908 1.047 18387 14131 1 18 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.729 -0.699 18387 14132 1 18 . 1 1 9 9 ALA H H 9 8.448 8.448 8.695 -0.247 18387 14133 1 18 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.282 0.050 18387 14134 1 18 . 1 1 10 10 PRO C C 10 175.071 175.071 176.057 -0.986 18387 14135 1 18 . 1 1 10 10 PRO CA C 10 62.641 62.641 63.026 -0.385 18387 14136 1 18 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.215 0.109 18387 14137 1 18 . 1 1 11 11 ALA N N 11 124.172 124.172 125.208 -1.036 18387 14138 1 18 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.538 -0.294 18387 14139 1 18 . 1 1 11 11 ALA C C 11 177.688 177.688 176.856 0.832 18387 14140 1 18 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.153 2.468 18387 14141 1 18 . 1 1 11 11 ALA CB C 11 19.327 19.327 18.829 0.498 18387 14142 1 18 . 1 1 11 11 ALA H H 11 8.221 8.221 8.467 -0.246 18387 14143 1 18 . 1 1 12 12 ILE N N 12 117.815 117.815 126.113 -8.298 18387 14144 1 18 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.102 0.226 18387 14145 1 18 . 1 1 12 12 ILE C C 12 175.013 175.013 175.981 -0.968 18387 14146 1 18 . 1 1 12 12 ILE CA C 12 62.166 62.166 60.802 1.364 18387 14147 1 18 . 1 1 12 12 ILE CB C 12 44.290 44.290 37.156 7.134 18387 14148 1 18 . 1 1 12 12 ILE H H 12 7.693 7.693 8.075 -0.382 18387 14149 1 18 . 1 1 13 13 THR N N 13 121.186 121.186 124.191 -3.005 18387 14150 1 18 . 1 1 13 13 THR HA H 13 4.840 4.840 5.054 -0.214 18387 14151 1 18 . 1 1 13 13 THR C C 13 172.625 172.625 173.708 -1.083 18387 14152 1 18 . 1 1 13 13 THR CA C 13 62.297 62.297 61.730 0.567 18387 14153 1 18 . 1 1 13 13 THR CB C 13 71.585 71.585 69.291 2.294 18387 14154 1 18 . 1 1 13 13 THR H H 13 8.363 8.363 9.390 -1.027 18387 14155 1 18 . 1 1 14 14 GLY N N 14 110.785 110.785 111.085 -0.300 18387 14156 1 18 . 1 1 14 14 GLY C C 14 170.040 170.040 172.281 -2.241 18387 14157 1 18 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.927 1.463 18387 14158 1 18 . 1 1 14 14 GLY H H 14 7.993 7.993 8.845 -0.852 18387 14159 1 18 . 1 1 15 15 ILE N N 15 119.088 119.088 121.823 -2.735 18387 14160 1 18 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.729 0.396 18387 14161 1 18 . 1 1 15 15 ILE C C 15 176.359 176.359 176.184 0.175 18387 14162 1 18 . 1 1 15 15 ILE CA C 15 58.614 58.614 61.363 -2.749 18387 14163 1 18 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.347 0.292 18387 14164 1 18 . 1 1 15 15 ILE H H 15 7.973 7.973 8.681 -0.708 18387 14165 1 18 . 1 1 16 16 ASP N N 16 126.633 126.633 127.660 -1.027 18387 14166 1 18 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.309 0.540 18387 14167 1 18 . 1 1 16 16 ASP C C 16 179.190 179.190 177.924 1.266 18387 14168 1 18 . 1 1 16 16 ASP CA C 16 52.880 52.880 52.780 0.100 18387 14169 1 18 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.525 -0.250 18387 14170 1 18 . 1 1 16 16 ASP H H 16 9.335 9.335 8.765 0.570 18387 14171 1 18 . 1 1 17 17 LEU N N 17 116.648 116.648 118.700 -2.052 18387 14172 1 18 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.059 0.115 18387 14173 1 18 . 1 1 17 17 LEU C C 17 178.432 178.432 178.951 -0.519 18387 14174 1 18 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.457 0.524 18387 14175 1 18 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.810 1.176 18387 14176 1 18 . 1 1 17 17 LEU H H 17 8.071 8.071 8.787 -0.716 18387 14177 1 18 . 1 1 18 18 LYS N N 18 117.401 117.401 117.810 -0.409 18387 14178 1 18 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.157 0.352 18387 14179 1 18 . 1 1 18 18 LYS C C 18 176.793 176.793 177.466 -0.673 18387 14180 1 18 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.922 -2.487 18387 14181 1 18 . 1 1 18 18 LYS CB C 18 33.063 33.063 32.972 0.091 18387 14182 1 18 . 1 1 18 18 LYS H H 18 8.207 8.207 8.771 -0.564 18387 14183 1 18 . 1 1 19 19 GLY N N 19 108.061 108.061 106.269 1.792 18387 14184 1 18 . 1 1 19 19 GLY C C 19 174.649 174.649 173.948 0.701 18387 14185 1 18 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.526 1.071 18387 14186 1 18 . 1 1 19 19 GLY H H 19 8.099 8.099 8.026 0.073 18387 14187 1 18 . 1 1 20 20 ASN N N 20 121.012 121.012 120.144 0.868 18387 14188 1 18 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.025 -0.120 18387 14189 1 18 . 1 1 20 20 ASN C C 20 174.827 174.827 175.041 -0.214 18387 14190 1 18 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.241 0.226 18387 14191 1 18 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.594 -0.918 18387 14192 1 18 . 1 1 20 20 ASN H H 20 8.945 8.945 9.144 -0.199 18387 14193 1 18 . 1 1 21 21 SER N N 21 117.285 117.285 119.045 -1.760 18387 14194 1 18 . 1 1 21 21 SER HA H 21 5.000 5.000 4.716 0.284 18387 14195 1 18 . 1 1 21 21 SER C C 21 174.911 174.911 174.265 0.646 18387 14196 1 18 . 1 1 21 21 SER CA C 21 58.730 58.730 58.652 0.078 18387 14197 1 18 . 1 1 21 21 SER CB C 21 63.162 63.162 62.540 0.622 18387 14198 1 18 . 1 1 21 21 SER H H 21 8.740 8.740 8.800 -0.060 18387 14199 1 18 . 1 1 22 22 VAL N N 22 128.665 128.665 127.119 1.546 18387 14200 1 18 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.340 0.040 18387 14201 1 18 . 1 1 22 22 VAL C C 22 176.276 176.276 175.210 1.066 18387 14202 1 18 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.037 0.916 18387 14203 1 18 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.829 1.753 18387 14204 1 18 . 1 1 22 22 VAL H H 22 9.125 9.125 9.099 0.026 18387 14205 1 18 . 1 1 23 23 SER N N 23 127.457 127.457 118.624 8.833 18387 14206 1 18 . 1 1 23 23 SER HA H 23 5.878 5.878 5.666 0.212 18387 14207 1 18 . 1 1 23 23 SER C C 23 174.436 174.436 175.955 -1.519 18387 14208 1 18 . 1 1 23 23 SER CA C 23 57.101 57.101 56.722 0.379 18387 14209 1 18 . 1 1 23 23 SER CB C 23 66.078 66.078 65.068 1.010 18387 14210 1 18 . 1 1 23 23 SER H H 23 8.971 8.971 9.206 -0.235 18387 14211 1 18 . 1 1 24 24 LEU N N 24 126.734 126.734 124.425 2.309 18387 14212 1 18 . 1 1 24 24 LEU HA H 24 3.467 3.467 4.005 -0.538 18387 14213 1 18 . 1 1 24 24 LEU C C 24 179.852 179.852 177.468 2.384 18387 14214 1 18 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.431 0.772 18387 14215 1 18 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.946 0.032 18387 14216 1 18 . 1 1 24 24 LEU H H 24 8.450 8.450 8.946 -0.496 18387 14217 1 18 . 1 1 25 25 ASN N N 25 115.642 115.642 114.969 0.673 18387 14218 1 18 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.456 -0.214 18387 14219 1 18 . 1 1 25 25 ASN C C 25 176.246 176.246 176.339 -0.093 18387 14220 1 18 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.423 -0.053 18387 14221 1 18 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.590 1.181 18387 14222 1 18 . 1 1 25 25 ASN H H 25 8.505 8.505 8.755 -0.250 18387 14223 1 18 . 1 1 26 26 ASP N N 26 119.722 119.722 120.685 -0.963 18387 14224 1 18 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.419 -0.214 18387 14225 1 18 . 1 1 26 26 ASP C C 26 176.708 176.708 175.910 0.798 18387 14226 1 18 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.184 0.341 18387 14227 1 18 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.194 -0.914 18387 14228 1 18 . 1 1 26 26 ASP H H 26 7.731 7.731 7.922 -0.191 18387 14229 1 18 . 1 1 27 27 PHE N N 27 116.827 116.827 116.749 0.078 18387 14230 1 18 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.681 -0.201 18387 14231 1 18 . 1 1 27 27 PHE C C 27 174.227 174.227 175.949 -1.722 18387 14232 1 18 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.308 -0.237 18387 14233 1 18 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.977 -0.258 18387 14234 1 18 . 1 1 27 27 PHE H H 27 7.390 7.390 7.456 -0.066 18387 14235 1 18 . 1 1 28 28 LYS N N 28 120.357 120.357 120.531 -0.174 18387 14236 1 18 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.055 0.332 18387 14237 1 18 . 1 1 28 28 LYS C C 28 177.845 177.845 177.520 0.325 18387 14238 1 18 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.788 0.214 18387 14239 1 18 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.950 -0.406 18387 14240 1 18 . 1 1 28 28 LYS H H 28 6.883 6.883 7.429 -0.546 18387 14241 1 18 . 1 1 29 29 GLY N N 29 112.653 112.653 107.196 5.457 18387 14242 1 18 . 1 1 29 29 GLY C C 29 173.799 173.799 173.186 0.613 18387 14243 1 18 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.525 -0.537 18387 14244 1 18 . 1 1 29 29 GLY H H 29 8.930 8.930 8.655 0.275 18387 14245 1 18 . 1 1 30 30 LYS N N 30 120.516 120.516 117.738 2.778 18387 14246 1 18 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.682 -0.047 18387 14247 1 18 . 1 1 30 30 LYS C C 30 176.505 176.505 175.680 0.825 18387 14248 1 18 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.381 0.799 18387 14249 1 18 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.769 -0.912 18387 14250 1 18 . 1 1 30 30 LYS H H 30 8.098 8.098 7.355 0.743 18387 14251 1 18 . 1 1 31 31 TYR N N 31 117.383 117.383 121.761 -4.378 18387 14252 1 18 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.693 -0.039 18387 14253 1 18 . 1 1 31 31 TYR C C 31 175.551 175.551 175.504 0.047 18387 14254 1 18 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.111 1.054 18387 14255 1 18 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.715 2.478 18387 14256 1 18 . 1 1 31 31 TYR H H 31 8.263 8.263 9.183 -0.920 18387 14257 1 18 . 1 1 32 32 VAL N N 32 120.900 120.900 125.686 -4.786 18387 14258 1 18 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.608 -0.169 18387 14259 1 18 . 1 1 32 32 VAL C C 32 175.975 175.975 175.111 0.864 18387 14260 1 18 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.810 -1.104 18387 14261 1 18 . 1 1 32 32 VAL CB C 32 35.507 35.507 31.948 3.559 18387 14262 1 18 . 1 1 32 32 VAL H H 32 9.244 9.244 9.152 0.092 18387 14263 1 18 . 1 1 33 33 LEU N N 33 130.058 130.058 131.567 -1.509 18387 14264 1 18 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.903 0.270 18387 14265 1 18 . 1 1 33 33 LEU C C 33 174.693 174.693 175.299 -0.606 18387 14266 1 18 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.657 -0.309 18387 14267 1 18 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.736 1.585 18387 14268 1 18 . 1 1 33 33 LEU H H 33 8.161 8.161 8.672 -0.511 18387 14269 1 18 . 1 1 34 34 VAL N N 34 129.232 129.232 128.986 0.246 18387 14270 1 18 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.511 0.471 18387 14271 1 18 . 1 1 34 34 VAL C C 34 174.285 174.285 174.550 -0.265 18387 14272 1 18 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.967 -0.461 18387 14273 1 18 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.684 -0.305 18387 14274 1 18 . 1 1 34 34 VAL H H 34 9.296 9.296 9.137 0.159 18387 14275 1 18 . 1 1 35 35 ASP N N 35 123.675 123.675 128.225 -4.550 18387 14276 1 18 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.058 0.291 18387 14277 1 18 . 1 1 35 35 ASP C C 35 174.258 174.258 174.855 -0.597 18387 14278 1 18 . 1 1 35 35 ASP CA C 35 51.054 51.054 51.981 -0.927 18387 14279 1 18 . 1 1 35 35 ASP CB C 35 40.462 40.462 41.945 -1.483 18387 14280 1 18 . 1 1 35 35 ASP H H 35 8.015 8.015 8.926 -0.911 18387 14281 1 18 . 1 1 36 36 PHE N N 36 126.959 126.959 126.454 0.505 18387 14282 1 18 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.480 0.455 18387 14283 1 18 . 1 1 36 36 PHE C C 36 175.432 175.432 175.677 -0.245 18387 14284 1 18 . 1 1 36 36 PHE CA C 36 58.095 58.095 58.295 -0.200 18387 14285 1 18 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.671 0.359 18387 14286 1 18 . 1 1 36 36 PHE H H 36 9.171 9.171 8.529 0.642 18387 14287 1 18 . 1 1 37 37 TRP N N 37 120.839 120.839 123.036 -2.197 18387 14288 1 18 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.485 0.272 18387 14289 1 18 . 1 1 37 37 TRP C C 37 172.412 172.412 173.747 -1.335 18387 14290 1 18 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.668 0.241 18387 14291 1 18 . 1 1 37 37 TRP CB C 37 32.680 32.680 33.057 -0.377 18387 14292 1 18 . 1 1 37 37 TRP H H 37 9.280 9.280 9.268 0.012 18387 14293 1 18 . 1 1 38 38 PHE N N 38 109.215 109.215 112.657 -3.442 18387 14294 1 18 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.582 -0.649 18387 14295 1 18 . 1 1 38 38 PHE C C 38 176.141 176.141 174.733 1.408 18387 14296 1 18 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.995 0.016 18387 14297 1 18 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.384 -0.765 18387 14298 1 18 . 1 1 38 38 PHE H H 38 7.062 7.062 8.119 -1.057 18387 14299 1 18 . 1 1 39 39 ALA N N 39 125.193 125.193 122.913 2.280 18387 14300 1 18 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.306 -0.241 18387 14301 1 18 . 1 1 39 39 ALA C C 39 179.349 179.349 178.031 1.318 18387 14302 1 18 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.556 1.508 18387 14303 1 18 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.703 1.194 18387 14304 1 18 . 1 1 39 39 ALA H H 39 10.355 10.355 9.326 1.029 18387 14305 1 18 . 1 1 40 40 GLY N N 40 103.437 103.437 104.511 -1.074 18387 14306 1 18 . 1 1 40 40 GLY C C 40 172.732 172.732 174.336 -1.604 18387 14307 1 18 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.393 -0.457 18387 14308 1 18 . 1 1 40 40 GLY H H 40 8.583 8.583 8.167 0.416 18387 14309 1 18 . 1 1 41 41 CYS N N 41 124.859 124.859 118.735 6.124 18387 14310 1 18 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.505 -0.101 18387 14311 1 18 . 1 1 41 41 CYS C C 41 176.620 176.620 174.802 1.818 18387 14312 1 18 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.456 0.919 18387 14313 1 18 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.717 0.659 18387 14314 1 18 . 1 1 41 41 CYS H H 41 6.946 6.946 6.813 0.133 18387 14315 1 18 . 1 1 42 42 SER HA H 42 4.040 4.040 4.285 -0.245 18387 14316 1 18 . 1 1 42 42 SER CA C 42 61.552 61.552 61.383 0.169 18387 14317 1 18 . 1 1 42 42 SER CB C 42 62.675 62.675 63.324 -0.649 18387 14318 1 18 . 1 1 43 43 TRP N N 43 129.748 129.748 123.010 6.738 18387 14319 1 18 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.395 0.154 18387 14320 1 18 . 1 1 43 43 TRP C C 43 180.400 180.400 177.020 3.380 18387 14321 1 18 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.529 0.720 18387 14322 1 18 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.170 0.422 18387 14323 1 18 . 1 1 44 44 CYS N N 44 124.462 124.462 115.597 8.865 18387 14324 1 18 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.055 0.196 18387 14325 1 18 . 1 1 44 44 CYS C C 44 178.643 178.643 176.722 1.921 18387 14326 1 18 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.275 2.574 18387 14327 1 18 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.059 2.362 18387 14328 1 18 . 1 1 44 44 CYS H H 44 9.591 9.591 8.028 1.563 18387 14329 1 18 . 1 1 45 45 ARG N N 45 117.248 117.248 117.087 0.161 18387 14330 1 18 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.297 -0.121 18387 14331 1 18 . 1 1 45 45 ARG C C 45 180.302 180.302 176.758 3.544 18387 14332 1 18 . 1 1 45 45 ARG CA C 45 56.943 56.943 56.340 0.603 18387 14333 1 18 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.737 -2.106 18387 14334 1 18 . 1 1 45 45 ARG H H 45 7.955 7.955 7.501 0.454 18387 14335 1 18 . 1 1 46 46 LYS N N 46 120.318 120.318 117.568 2.750 18387 14336 1 18 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.111 0.161 18387 14337 1 18 . 1 1 46 46 LYS C C 46 177.755 177.755 177.431 0.324 18387 14338 1 18 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.159 1.610 18387 14339 1 18 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.061 1.096 18387 14340 1 18 . 1 1 46 46 LYS H H 46 8.129 8.129 7.512 0.617 18387 14341 1 18 . 1 1 47 47 GLU N N 47 114.278 114.278 116.896 -2.618 18387 14342 1 18 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.413 0.478 18387 14343 1 18 . 1 1 47 47 GLU C C 47 178.701 178.701 177.971 0.730 18387 14344 1 18 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.609 -1.055 18387 14345 1 18 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.157 0.609 18387 14346 1 18 . 1 1 47 47 GLU H H 47 7.386 7.386 7.335 0.051 18387 14347 1 18 . 1 1 48 48 THR N N 48 115.665 115.665 117.804 -2.139 18387 14348 1 18 . 1 1 48 48 THR HA H 48 4.048 4.048 4.104 -0.056 18387 14349 1 18 . 1 1 48 48 THR C C 48 172.392 172.392 174.468 -2.076 18387 14350 1 18 . 1 1 48 48 THR CA C 48 69.426 69.426 69.301 0.125 18387 14351 1 18 . 1 1 48 48 THR CB C 48 66.906 66.906 66.950 -0.044 18387 14352 1 18 . 1 1 48 48 THR H H 48 7.810 7.810 7.789 0.021 18387 14353 1 18 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.134 0.155 18387 14354 1 18 . 1 1 49 49 PRO C C 49 179.828 179.828 178.800 1.028 18387 14355 1 18 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.004 0.595 18387 14356 1 18 . 1 1 49 49 PRO CB C 49 31.034 31.034 30.983 0.051 18387 14357 1 18 . 1 1 50 50 TYR N N 50 116.950 116.950 117.455 -0.505 18387 14358 1 18 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.263 -0.125 18387 14359 1 18 . 1 1 50 50 TYR C C 50 179.488 179.488 178.730 0.758 18387 14360 1 18 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.664 -0.529 18387 14361 1 18 . 1 1 50 50 TYR CB C 50 38.301 38.301 38.044 0.257 18387 14362 1 18 . 1 1 50 50 TYR H H 50 7.071 7.071 7.431 -0.360 18387 14363 1 18 . 1 1 51 51 LEU N N 51 123.989 123.989 120.959 3.030 18387 14364 1 18 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.808 -0.138 18387 14365 1 18 . 1 1 51 51 LEU C C 51 178.072 178.072 178.693 -0.621 18387 14366 1 18 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.134 0.542 18387 14367 1 18 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.487 1.130 18387 14368 1 18 . 1 1 51 51 LEU H H 51 8.243 8.243 8.454 -0.211 18387 14369 1 18 . 1 1 52 52 LEU N N 52 119.857 119.857 119.679 0.178 18387 14370 1 18 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.156 0.171 18387 14371 1 18 . 1 1 52 52 LEU C C 52 178.704 178.704 178.754 -0.050 18387 14372 1 18 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.580 -0.005 18387 14373 1 18 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.739 0.999 18387 14374 1 18 . 1 1 52 52 LEU H H 52 9.085 9.085 8.817 0.268 18387 14375 1 18 . 1 1 53 53 LYS N N 53 118.658 118.658 119.127 -0.469 18387 14376 1 18 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.075 0.034 18387 14377 1 18 . 1 1 53 53 LYS C C 53 179.786 179.786 178.986 0.800 18387 14378 1 18 . 1 1 53 53 LYS CA C 53 59.721 59.721 58.975 0.746 18387 14379 1 18 . 1 1 53 53 LYS CB C 53 33.159 33.159 31.591 1.568 18387 14380 1 18 . 1 1 53 53 LYS H H 53 7.807 7.807 7.960 -0.153 18387 14381 1 18 . 1 1 54 54 THR N N 54 116.869 116.869 117.146 -0.277 18387 14382 1 18 . 1 1 54 54 THR HA H 54 3.965 3.965 4.482 -0.517 18387 14383 1 18 . 1 1 54 54 THR C C 54 175.328 175.328 176.587 -1.259 18387 14384 1 18 . 1 1 54 54 THR CA C 54 67.683 67.683 68.021 -0.338 18387 14385 1 18 . 1 1 54 54 THR CB C 54 68.452 68.452 68.802 -0.350 18387 14386 1 18 . 1 1 54 54 THR H H 54 7.771 7.771 8.593 -0.822 18387 14387 1 18 . 1 1 55 55 TYR N N 55 122.202 122.202 121.688 0.514 18387 14388 1 18 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.312 -0.040 18387 14389 1 18 . 1 1 55 55 TYR C C 55 176.809 176.809 177.221 -0.412 18387 14390 1 18 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.399 1.338 18387 14391 1 18 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.592 0.688 18387 14392 1 18 . 1 1 55 55 TYR H H 55 9.145 9.145 8.623 0.522 18387 14393 1 18 . 1 1 56 56 ASN N N 56 113.858 113.858 117.849 -3.991 18387 14394 1 18 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.393 -0.130 18387 14395 1 18 . 1 1 56 56 ASN C C 56 177.427 177.427 176.553 0.874 18387 14396 1 18 . 1 1 56 56 ASN CA C 56 55.930 55.930 56.229 -0.299 18387 14397 1 18 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.926 -0.972 18387 14398 1 18 . 1 1 56 56 ASN H H 56 8.850 8.850 8.347 0.503 18387 14399 1 18 . 1 1 57 57 ALA N N 57 118.829 118.829 119.933 -1.104 18387 14400 1 18 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.112 -0.048 18387 14401 1 18 . 1 1 57 57 ALA C C 57 180.445 180.445 178.237 2.208 18387 14402 1 18 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.746 0.605 18387 14403 1 18 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.228 -0.034 18387 14404 1 18 . 1 1 57 57 ALA H H 57 7.436 7.436 7.936 -0.500 18387 14405 1 18 . 1 1 58 58 PHE N N 58 112.082 112.082 115.535 -3.453 18387 14406 1 18 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.649 0.272 18387 14407 1 18 . 1 1 58 58 PHE C C 58 176.999 176.999 176.978 0.021 18387 14408 1 18 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.640 0.427 18387 14409 1 18 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.395 1.095 18387 14410 1 18 . 1 1 58 58 PHE H H 58 7.480 7.480 7.827 -0.347 18387 14411 1 18 . 1 1 59 59 LYS N N 59 120.666 120.666 120.021 0.645 18387 14412 1 18 . 1 1 59 59 LYS HA H 59 4.803 4.803 3.976 0.827 18387 14413 1 18 . 1 1 59 59 LYS C C 59 177.157 177.157 176.592 0.565 18387 14414 1 18 . 1 1 59 59 LYS CA C 59 59.081 59.081 58.426 0.655 18387 14415 1 18 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.701 -1.133 18387 14416 1 18 . 1 1 59 59 LYS H H 59 8.411 8.411 7.500 0.911 18387 14417 1 18 . 1 1 60 60 ASP N N 60 118.908 118.908 118.441 0.467 18387 14418 1 18 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.751 0.374 18387 14419 1 18 . 1 1 60 60 ASP C C 60 176.889 176.889 175.872 1.017 18387 14420 1 18 . 1 1 60 60 ASP CA C 60 54.649 54.649 54.805 -0.156 18387 14421 1 18 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.377 0.335 18387 14422 1 18 . 1 1 60 60 ASP H H 60 8.574 8.574 8.697 -0.123 18387 14423 1 18 . 1 1 61 61 LYS N N 61 121.021 121.021 119.998 1.023 18387 14424 1 18 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.651 0.063 18387 14425 1 18 . 1 1 61 61 LYS C C 61 175.968 175.968 177.250 -1.282 18387 14426 1 18 . 1 1 61 61 LYS CA C 61 55.137 55.137 54.738 0.399 18387 14427 1 18 . 1 1 61 61 LYS CB C 61 33.078 33.078 35.281 -2.203 18387 14428 1 18 . 1 1 61 61 LYS H H 61 8.278 8.278 7.499 0.779 18387 14429 1 18 . 1 1 62 62 GLY C C 62 173.837 173.837 173.257 0.580 18387 14430 1 18 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.103 1.946 18387 14431 1 18 . 1 1 63 63 PHE N N 63 120.476 120.476 122.667 -2.191 18387 14432 1 18 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.596 0.437 18387 14433 1 18 . 1 1 63 63 PHE C C 63 173.613 173.613 173.131 0.482 18387 14434 1 18 . 1 1 63 63 PHE CA C 63 55.850 55.850 57.307 -1.457 18387 14435 1 18 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.298 -0.623 18387 14436 1 18 . 1 1 63 63 PHE H H 63 7.413 7.413 8.249 -0.836 18387 14437 1 18 . 1 1 64 64 THR N N 64 119.903 119.903 118.324 1.579 18387 14438 1 18 . 1 1 64 64 THR HA H 64 4.097 4.097 4.733 -0.636 18387 14439 1 18 . 1 1 64 64 THR C C 64 170.397 170.397 172.312 -1.915 18387 14440 1 18 . 1 1 64 64 THR CA C 64 60.261 60.261 60.306 -0.045 18387 14441 1 18 . 1 1 64 64 THR CB C 64 69.507 69.507 71.882 -2.375 18387 14442 1 18 . 1 1 64 64 THR H H 64 7.665 7.665 8.532 -0.867 18387 14443 1 18 . 1 1 65 65 ILE N N 65 117.277 117.277 125.816 -8.539 18387 14444 1 18 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.211 0.265 18387 14445 1 18 . 1 1 65 65 ILE C C 65 173.056 173.056 174.742 -1.686 18387 14446 1 18 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.646 -0.938 18387 14447 1 18 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.550 1.296 18387 14448 1 18 . 1 1 65 65 ILE H H 65 7.321 7.321 8.598 -1.277 18387 14449 1 18 . 1 1 66 66 TYR N N 66 131.968 131.968 129.914 2.054 18387 14450 1 18 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.992 0.255 18387 14451 1 18 . 1 1 66 66 TYR C C 66 174.074 174.074 175.253 -1.179 18387 14452 1 18 . 1 1 66 66 TYR CA C 66 54.965 54.965 56.020 -1.055 18387 14453 1 18 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.801 1.315 18387 14454 1 18 . 1 1 66 66 TYR H H 66 9.038 9.038 9.142 -0.104 18387 14455 1 18 . 1 1 67 67 GLY N N 67 114.364 114.364 115.734 -1.370 18387 14456 1 18 . 1 1 67 67 GLY C C 67 172.461 172.461 172.092 0.369 18387 14457 1 18 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.798 0.202 18387 14458 1 18 . 1 1 67 67 GLY H H 67 9.188 9.188 9.285 -0.097 18387 14459 1 18 . 1 1 68 68 VAL N N 68 126.938 126.938 123.843 3.095 18387 14460 1 18 . 1 1 68 68 VAL HA H 68 4.136 4.136 5.128 -0.992 18387 14461 1 18 . 1 1 68 68 VAL C C 68 173.822 173.822 173.205 0.617 18387 14462 1 18 . 1 1 68 68 VAL CA C 68 61.498 61.498 59.837 1.661 18387 14463 1 18 . 1 1 68 68 VAL CB C 68 33.558 33.558 35.147 -1.589 18387 14464 1 18 . 1 1 68 68 VAL H H 68 9.309 9.309 9.246 0.063 18387 14465 1 18 . 1 1 69 69 SER N N 69 118.813 118.813 123.032 -4.219 18387 14466 1 18 . 1 1 69 69 SER HA H 69 5.527 5.527 5.480 0.047 18387 14467 1 18 . 1 1 69 69 SER C C 69 175.753 175.753 172.531 3.222 18387 14468 1 18 . 1 1 69 69 SER CA C 69 54.407 54.407 55.978 -1.571 18387 14469 1 18 . 1 1 69 69 SER CB C 69 63.630 63.630 65.297 -1.667 18387 14470 1 18 . 1 1 69 69 SER H H 69 8.124 8.124 8.882 -0.758 18387 14471 1 18 . 1 1 70 70 THR N N 70 113.861 113.861 117.424 -3.563 18387 14472 1 18 . 1 1 70 70 THR HA H 70 4.381 4.381 4.379 0.002 18387 14473 1 18 . 1 1 70 70 THR C C 70 175.001 175.001 173.235 1.766 18387 14474 1 18 . 1 1 70 70 THR CA C 70 60.259 60.259 60.631 -0.372 18387 14475 1 18 . 1 1 70 70 THR CB C 70 67.291 67.291 68.892 -1.601 18387 14476 1 18 . 1 1 70 70 THR H H 70 7.656 7.656 8.253 -0.597 18387 14477 1 18 . 1 1 71 71 ASP N N 71 125.133 125.133 121.458 3.675 18387 14478 1 18 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.469 -0.399 18387 14479 1 18 . 1 1 71 71 ASP C C 71 175.685 175.685 176.841 -1.156 18387 14480 1 18 . 1 1 71 71 ASP CA C 71 57.612 57.612 53.867 3.745 18387 14481 1 18 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.513 -0.144 18387 14482 1 18 . 1 1 71 71 ASP H H 71 8.931 8.931 7.672 1.259 18387 14483 1 18 . 1 1 72 72 ARG N N 72 118.814 118.814 117.564 1.250 18387 14484 1 18 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.075 0.120 18387 14485 1 18 . 1 1 72 72 ARG C C 72 177.300 177.300 176.606 0.694 18387 14486 1 18 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.487 -0.678 18387 14487 1 18 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.484 0.627 18387 14488 1 18 . 1 1 72 72 ARG H H 72 8.057 8.057 8.395 -0.338 18387 14489 1 18 . 1 1 73 73 ARG N N 73 118.174 118.174 117.366 0.808 18387 14490 1 18 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.566 0.188 18387 14491 1 18 . 1 1 73 73 ARG C C 73 176.503 176.503 175.386 1.117 18387 14492 1 18 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.708 -0.172 18387 14493 1 18 . 1 1 73 73 ARG CB C 73 31.028 31.028 33.659 -2.631 18387 14494 1 18 . 1 1 73 73 ARG H H 73 8.639 8.639 7.477 1.162 18387 14495 1 18 . 1 1 74 74 GLU N N 74 127.609 127.609 122.604 5.005 18387 14496 1 18 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.123 -0.044 18387 14497 1 18 . 1 1 74 74 GLU C C 74 178.107 178.107 177.833 0.274 18387 14498 1 18 . 1 1 74 74 GLU CA C 74 59.785 59.785 59.913 -0.128 18387 14499 1 18 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.949 0.149 18387 14500 1 18 . 1 1 74 74 GLU H H 74 9.129 9.129 9.030 0.099 18387 14501 1 18 . 1 1 75 75 GLU N N 75 117.874 117.874 119.628 -1.754 18387 14502 1 18 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.101 -0.001 18387 14503 1 18 . 1 1 75 75 GLU C C 75 178.993 178.993 178.666 0.327 18387 14504 1 18 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.022 0.105 18387 14505 1 18 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.844 0.447 18387 14506 1 18 . 1 1 75 75 GLU H H 75 9.745 9.745 8.844 0.901 18387 14507 1 18 . 1 1 76 76 ASP N N 76 119.182 119.182 119.553 -0.371 18387 14508 1 18 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.440 -0.074 18387 14509 1 18 . 1 1 76 76 ASP C C 76 178.107 178.107 178.121 -0.014 18387 14510 1 18 . 1 1 76 76 ASP CA C 76 56.973 56.973 58.174 -1.201 18387 14511 1 18 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.485 0.035 18387 14512 1 18 . 1 1 76 76 ASP H H 76 7.004 7.004 8.583 -1.579 18387 14513 1 18 . 1 1 77 77 TRP N N 77 123.008 123.008 122.843 0.165 18387 14514 1 18 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.174 -0.025 18387 14515 1 18 . 1 1 77 77 TRP C C 77 176.236 176.236 177.912 -1.676 18387 14516 1 18 . 1 1 77 77 TRP CA C 77 60.483 60.483 61.534 -1.051 18387 14517 1 18 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.152 -0.617 18387 14518 1 18 . 1 1 77 77 TRP H H 77 7.112 7.112 7.939 -0.827 18387 14519 1 18 . 1 1 78 78 LYS N N 78 115.727 115.727 118.346 -2.619 18387 14520 1 18 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.349 -0.104 18387 14521 1 18 . 1 1 78 78 LYS C C 78 179.426 179.426 178.774 0.652 18387 14522 1 18 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.445 0.987 18387 14523 1 18 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.778 0.967 18387 14524 1 18 . 1 1 78 78 LYS H H 78 8.431 8.431 8.379 0.052 18387 14525 1 18 . 1 1 79 79 LYS N N 79 118.321 118.321 119.492 -1.171 18387 14526 1 18 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.920 0.100 18387 14527 1 18 . 1 1 79 79 LYS C C 79 178.239 178.239 178.569 -0.330 18387 14528 1 18 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.361 -0.294 18387 14529 1 18 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.512 -0.049 18387 14530 1 18 . 1 1 79 79 LYS H H 79 7.690 7.690 8.140 -0.450 18387 14531 1 18 . 1 1 80 80 ALA N N 80 120.679 120.679 122.395 -1.716 18387 14532 1 18 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.285 -0.130 18387 14533 1 18 . 1 1 80 80 ALA C C 80 178.811 178.811 180.030 -1.219 18387 14534 1 18 . 1 1 80 80 ALA CA C 80 55.087 55.087 54.940 0.147 18387 14535 1 18 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.443 0.315 18387 14536 1 18 . 1 1 80 80 ALA H H 80 7.560 7.560 8.433 -0.873 18387 14537 1 18 . 1 1 81 81 ILE N N 81 118.019 118.019 118.833 -0.814 18387 14538 1 18 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.282 0.120 18387 14539 1 18 . 1 1 81 81 ILE C C 81 178.113 178.113 177.717 0.396 18387 14540 1 18 . 1 1 81 81 ILE CA C 81 64.520 64.520 65.162 -0.642 18387 14541 1 18 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.414 0.790 18387 14542 1 18 . 1 1 81 81 ILE H H 81 7.514 7.514 7.936 -0.422 18387 14543 1 18 . 1 1 82 82 GLU N N 82 117.252 117.252 119.533 -2.281 18387 14544 1 18 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.773 0.321 18387 14545 1 18 . 1 1 82 82 GLU C C 82 179.558 179.558 178.670 0.888 18387 14546 1 18 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.737 -0.157 18387 14547 1 18 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.142 0.241 18387 14548 1 18 . 1 1 82 82 GLU H H 82 7.401 7.401 7.474 -0.073 18387 14549 1 18 . 1 1 83 83 GLU N N 83 119.340 119.340 118.747 0.593 18387 14550 1 18 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.008 -0.110 18387 14551 1 18 . 1 1 83 83 GLU C C 83 178.740 178.740 178.233 0.507 18387 14552 1 18 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.511 0.488 18387 14553 1 18 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.761 0.160 18387 14554 1 18 . 1 1 83 83 GLU H H 83 8.191 8.191 8.086 0.105 18387 14555 1 18 . 1 1 84 84 ASP N N 84 118.449 118.449 116.205 2.244 18387 14556 1 18 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.408 -0.134 18387 14557 1 18 . 1 1 84 84 ASP C C 84 175.597 175.597 176.024 -0.427 18387 14558 1 18 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.388 0.659 18387 14559 1 18 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.127 -1.231 18387 14560 1 18 . 1 1 84 84 ASP H H 84 8.252 8.252 7.978 0.274 18387 14561 1 18 . 1 1 85 85 LYS N N 85 116.410 116.410 114.750 1.660 18387 14562 1 18 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.421 -0.248 18387 14563 1 18 . 1 1 85 85 LYS C C 85 176.856 176.856 175.073 1.783 18387 14564 1 18 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.775 -0.802 18387 14565 1 18 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.381 -0.513 18387 14566 1 18 . 1 1 85 85 LYS H H 85 7.890 7.890 7.564 0.326 18387 14567 1 18 . 1 1 86 86 SER N N 86 112.295 112.295 114.889 -2.594 18387 14568 1 18 . 1 1 86 86 SER HA H 86 3.139 3.139 3.774 -0.635 18387 14569 1 18 . 1 1 86 86 SER C C 86 175.805 175.805 172.524 3.281 18387 14570 1 18 . 1 1 86 86 SER CA C 86 53.637 53.637 57.308 -3.671 18387 14571 1 18 . 1 1 86 86 SER CB C 86 60.736 60.736 61.705 -0.969 18387 14572 1 18 . 1 1 86 86 SER H H 86 7.327 7.327 7.157 0.170 18387 14573 1 18 . 1 1 87 87 TYR N N 87 120.962 120.962 126.250 -5.288 18387 14574 1 18 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.243 0.062 18387 14575 1 18 . 1 1 87 87 TYR C C 87 177.064 177.064 175.023 2.041 18387 14576 1 18 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.062 -0.839 18387 14577 1 18 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.936 -0.583 18387 14578 1 18 . 1 1 87 87 TYR H H 87 6.933 6.933 7.738 -0.805 18387 14579 1 18 . 1 1 88 88 TRP N N 88 118.597 118.597 121.139 -2.542 18387 14580 1 18 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.681 0.170 18387 14581 1 18 . 1 1 88 88 TRP C C 88 175.456 175.456 174.164 1.292 18387 14582 1 18 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.804 1.432 18387 14583 1 18 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.494 -3.767 18387 14584 1 18 . 1 1 88 88 TRP H H 88 6.552 6.552 7.093 -0.541 18387 14585 1 18 . 1 1 89 89 ASN N N 89 118.067 118.067 120.730 -2.663 18387 14586 1 18 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.672 0.377 18387 14587 1 18 . 1 1 89 89 ASN C C 89 173.773 173.773 174.502 -0.729 18387 14588 1 18 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.446 2.010 18387 14589 1 18 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.438 1.759 18387 14590 1 18 . 1 1 89 89 ASN H H 89 7.864 7.864 8.639 -0.775 18387 14591 1 18 . 1 1 90 90 GLN N N 90 125.392 125.392 121.969 3.423 18387 14592 1 18 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.297 0.200 18387 14593 1 18 . 1 1 90 90 GLN C C 90 176.491 176.491 175.018 1.473 18387 14594 1 18 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.501 0.959 18387 14595 1 18 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.983 -1.756 18387 14596 1 18 . 1 1 90 90 GLN H H 90 7.904 7.904 8.148 -0.244 18387 14597 1 18 . 1 1 91 91 VAL N N 91 114.434 114.434 117.028 -2.594 18387 14598 1 18 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.980 0.500 18387 14599 1 18 . 1 1 91 91 VAL C C 91 174.248 174.248 172.834 1.414 18387 14600 1 18 . 1 1 91 91 VAL CA C 91 59.006 59.006 58.856 0.150 18387 14601 1 18 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.484 1.154 18387 14602 1 18 . 1 1 91 91 VAL H H 91 9.585 9.585 8.992 0.593 18387 14603 1 18 . 1 1 92 92 LEU N N 92 126.910 126.910 122.578 4.332 18387 14604 1 18 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.387 -0.318 18387 14605 1 18 . 1 1 92 92 LEU C C 92 177.696 177.696 175.723 1.973 18387 14606 1 18 . 1 1 92 92 LEU CA C 92 52.844 52.844 51.990 0.854 18387 14607 1 18 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.958 -1.011 18387 14608 1 18 . 1 1 92 92 LEU H H 92 8.941 8.941 8.211 0.730 18387 14609 1 18 . 1 1 93 93 LEU N N 93 125.673 125.673 126.748 -1.075 18387 14610 1 18 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.405 -0.005 18387 14611 1 18 . 1 1 93 93 LEU C C 93 177.291 177.291 176.807 0.484 18387 14612 1 18 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.740 -0.789 18387 14613 1 18 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.566 1.613 18387 14614 1 18 . 1 1 93 93 LEU H H 93 8.038 8.038 8.407 -0.369 18387 14615 1 18 . 1 1 94 94 GLN N N 94 122.206 122.206 121.762 0.444 18387 14616 1 18 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.383 -0.146 18387 14617 1 18 . 1 1 94 94 GLN C C 94 178.246 178.246 177.011 1.235 18387 14618 1 18 . 1 1 94 94 GLN CA C 94 55.775 55.775 54.757 1.018 18387 14619 1 18 . 1 1 94 94 GLN CB C 94 29.255 29.255 30.329 -1.074 18387 14620 1 18 . 1 1 94 94 GLN H H 94 9.298 9.298 8.148 1.150 18387 14621 1 18 . 1 1 95 95 LYS N N 95 122.668 122.668 121.052 1.616 18387 14622 1 18 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.873 0.093 18387 14623 1 18 . 1 1 95 95 LYS C C 95 178.787 178.787 177.767 1.020 18387 14624 1 18 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.967 0.105 18387 14625 1 18 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.908 0.557 18387 14626 1 18 . 1 1 95 95 LYS H H 95 8.645 8.645 8.775 -0.130 18387 14627 1 18 . 1 1 96 96 ASP N N 96 116.775 116.775 116.980 -0.205 18387 14628 1 18 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.521 0.059 18387 14629 1 18 . 1 1 96 96 ASP C C 96 176.220 176.220 178.353 -2.133 18387 14630 1 18 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.351 -0.005 18387 14631 1 18 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.088 0.469 18387 14632 1 18 . 1 1 96 96 ASP H H 96 8.606 8.606 8.280 0.326 18387 14633 1 18 . 1 1 97 97 ASP N N 97 118.213 118.213 121.872 -3.659 18387 14634 1 18 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.390 0.537 18387 14635 1 18 . 1 1 97 97 ASP C C 97 176.954 176.954 177.993 -1.039 18387 14636 1 18 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.954 -1.595 18387 14637 1 18 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.597 1.727 18387 14638 1 18 . 1 1 97 97 ASP H H 97 7.988 7.988 8.248 -0.260 18387 14639 1 18 . 1 1 98 98 VAL N N 98 118.907 118.907 119.817 -0.910 18387 14640 1 18 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.523 -0.107 18387 14641 1 18 . 1 1 98 98 VAL C C 98 176.470 176.470 177.806 -1.336 18387 14642 1 18 . 1 1 98 98 VAL CA C 98 67.778 67.778 65.989 1.789 18387 14643 1 18 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.637 0.754 18387 14644 1 18 . 1 1 98 98 VAL H H 98 7.098 7.098 8.516 -1.418 18387 14645 1 18 . 1 1 99 99 LYS N N 99 117.909 117.909 119.965 -2.056 18387 14646 1 18 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.965 -0.022 18387 14647 1 18 . 1 1 99 99 LYS C C 99 178.762 178.762 178.103 0.659 18387 14648 1 18 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.422 0.723 18387 14649 1 18 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.792 0.220 18387 14650 1 18 . 1 1 99 99 LYS H H 99 8.304 8.304 7.640 0.664 18387 14651 1 18 . 1 1 100 100 ASP N N 100 117.843 117.843 117.836 0.007 18387 14652 1 18 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.439 0.039 18387 14653 1 18 . 1 1 100 100 ASP C C 100 179.694 179.694 178.867 0.827 18387 14654 1 18 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.161 0.365 18387 14655 1 18 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.374 0.454 18387 14656 1 18 . 1 1 100 100 ASP H H 100 8.024 8.024 7.953 0.071 18387 14657 1 18 . 1 1 101 101 VAL N N 101 122.202 122.202 120.136 2.066 18387 14658 1 18 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.936 0.059 18387 14659 1 18 . 1 1 101 101 VAL C C 101 178.533 178.533 178.031 0.502 18387 14660 1 18 . 1 1 101 101 VAL CA C 101 67.002 67.002 67.475 -0.473 18387 14661 1 18 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.964 0.073 18387 14662 1 18 . 1 1 101 101 VAL H H 101 8.205 8.205 7.752 0.453 18387 14663 1 18 . 1 1 102 102 LEU N N 102 118.798 118.798 118.187 0.611 18387 14664 1 18 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.838 -0.058 18387 14665 1 18 . 1 1 102 102 LEU C C 102 180.254 180.254 179.092 1.162 18387 14666 1 18 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.508 1.433 18387 14667 1 18 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.468 -1.029 18387 14668 1 18 . 1 1 102 102 LEU H H 102 8.422 8.422 7.670 0.752 18387 14669 1 18 . 1 1 103 103 GLU N N 103 116.915 116.915 120.200 -3.285 18387 14670 1 18 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.079 0.056 18387 14671 1 18 . 1 1 103 103 GLU C C 103 180.910 180.910 179.176 1.734 18387 14672 1 18 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.850 0.553 18387 14673 1 18 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.684 0.047 18387 14674 1 18 . 1 1 103 103 GLU H H 103 8.262 8.262 8.043 0.219 18387 14675 1 18 . 1 1 104 104 SER N N 104 117.866 117.866 116.193 1.673 18387 14676 1 18 . 1 1 104 104 SER HA H 104 4.216 4.216 4.220 -0.004 18387 14677 1 18 . 1 1 104 104 SER C C 104 175.455 175.455 175.946 -0.491 18387 14678 1 18 . 1 1 104 104 SER CA C 104 62.019 62.019 60.823 1.196 18387 14679 1 18 . 1 1 104 104 SER CB C 104 62.891 62.891 63.511 -0.620 18387 14680 1 18 . 1 1 104 104 SER H H 104 8.544 8.544 8.440 0.104 18387 14681 1 18 . 1 1 105 105 TYR N N 105 117.278 117.278 117.558 -0.280 18387 14682 1 18 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.464 -0.192 18387 14683 1 18 . 1 1 105 105 TYR C C 105 174.750 174.750 174.970 -0.220 18387 14684 1 18 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.568 1.291 18387 14685 1 18 . 1 1 105 105 TYR CB C 105 39.711 39.711 38.132 1.579 18387 14686 1 18 . 1 1 105 105 TYR H H 105 7.691 7.691 7.578 0.113 18387 14687 1 18 . 1 1 106 106 CYS N N 106 116.897 116.897 118.324 -1.427 18387 14688 1 18 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.059 -0.164 18387 14689 1 18 . 1 1 106 106 CYS C C 106 174.056 174.056 173.843 0.213 18387 14690 1 18 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.998 -0.388 18387 14691 1 18 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.745 -0.713 18387 14692 1 18 . 1 1 106 106 CYS H H 106 7.862 7.862 7.966 -0.104 18387 14693 1 18 . 1 1 107 107 ILE N N 107 118.885 118.885 121.534 -2.649 18387 14694 1 18 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.479 -0.140 18387 14695 1 18 . 1 1 107 107 ILE C C 107 176.793 176.793 175.641 1.152 18387 14696 1 18 . 1 1 107 107 ILE CA C 107 62.745 62.745 61.523 1.222 18387 14697 1 18 . 1 1 107 107 ILE CB C 107 38.079 38.079 36.027 2.052 18387 14698 1 18 . 1 1 107 107 ILE H H 107 7.707 7.707 7.608 0.099 18387 14699 1 18 . 1 1 108 108 VAL N N 108 123.983 123.983 122.055 1.928 18387 14700 1 18 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.333 -0.059 18387 14701 1 18 . 1 1 108 108 VAL C C 108 175.476 175.476 175.190 0.286 18387 14702 1 18 . 1 1 108 108 VAL CA C 108 61.624 61.624 60.477 1.147 18387 14703 1 18 . 1 1 108 108 VAL CB C 108 33.008 33.008 31.592 1.416 18387 14704 1 18 . 1 1 108 108 VAL H H 108 8.656 8.656 7.720 0.936 18387 14705 1 18 . 1 1 109 109 GLY N N 109 110.120 110.120 108.111 2.009 18387 14706 1 18 . 1 1 109 109 GLY C C 109 169.982 169.982 171.743 -1.761 18387 14707 1 18 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.059 -0.456 18387 14708 1 18 . 1 1 109 109 GLY H H 109 7.500 7.500 7.143 0.357 18387 14709 1 18 . 1 1 110 110 PHE N N 110 115.276 115.276 119.210 -3.934 18387 14710 1 18 . 1 1 110 110 PHE HA H 110 4.774 4.774 4.962 -0.188 18387 14711 1 18 . 1 1 110 110 PHE C C 110 174.361 174.361 174.332 0.029 18387 14712 1 18 . 1 1 110 110 PHE CA C 110 55.687 55.687 56.001 -0.314 18387 14713 1 18 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.481 1.470 18387 14714 1 18 . 1 1 110 110 PHE H H 110 8.203 8.203 8.399 -0.196 18387 14715 1 18 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.069 0.290 18387 14716 1 18 . 1 1 111 111 PRO C C 111 175.691 175.691 175.626 0.065 18387 14717 1 18 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.592 0.565 18387 14718 1 18 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.343 1.961 18387 14719 1 18 . 1 1 112 112 HIS N N 112 123.708 123.708 118.806 4.902 18387 14720 1 18 . 1 1 112 112 HIS HA H 112 4.963 4.963 5.141 -0.178 18387 14721 1 18 . 1 1 112 112 HIS C C 112 173.649 173.649 174.124 -0.475 18387 14722 1 18 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.706 1.368 18387 14723 1 18 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.305 -0.108 18387 14724 1 18 . 1 1 112 112 HIS H H 112 8.952 8.952 8.557 0.395 18387 14725 1 18 . 1 1 113 113 ILE N N 113 128.596 128.596 126.836 1.760 18387 14726 1 18 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.277 0.420 18387 14727 1 18 . 1 1 113 113 ILE C C 113 176.130 176.130 174.773 1.357 18387 14728 1 18 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.300 0.695 18387 14729 1 18 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.027 -0.972 18387 14730 1 18 . 1 1 113 113 ILE H H 113 8.808 8.808 8.396 0.412 18387 14731 1 18 . 1 1 114 114 ILE N N 114 119.668 119.668 122.553 -2.885 18387 14732 1 18 . 1 1 114 114 ILE HA H 114 4.973 4.973 5.123 -0.150 18387 14733 1 18 . 1 1 114 114 ILE C C 114 173.186 173.186 173.600 -0.414 18387 14734 1 18 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.466 0.264 18387 14735 1 18 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.285 0.255 18387 14736 1 18 . 1 1 114 114 ILE H H 114 8.721 8.721 8.720 0.001 18387 14737 1 18 . 1 1 115 115 LEU N N 115 122.770 122.770 123.685 -0.915 18387 14738 1 18 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.061 0.214 18387 14739 1 18 . 1 1 115 115 LEU C C 115 173.601 173.601 175.184 -1.583 18387 14740 1 18 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.405 0.377 18387 14741 1 18 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.519 1.615 18387 14742 1 18 . 1 1 115 115 LEU H H 115 8.665 8.665 8.765 -0.100 18387 14743 1 18 . 1 1 116 116 VAL N N 116 130.411 130.411 126.968 3.443 18387 14744 1 18 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.751 0.107 18387 14745 1 18 . 1 1 116 116 VAL C C 116 174.565 174.565 175.363 -0.798 18387 14746 1 18 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.999 -0.195 18387 14747 1 18 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.075 -0.160 18387 14748 1 18 . 1 1 116 116 VAL H H 116 9.472 9.472 9.303 0.169 18387 14749 1 18 . 1 1 117 117 ASP N N 117 127.896 127.896 125.876 2.020 18387 14750 1 18 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.749 -0.357 18387 14751 1 18 . 1 1 117 117 ASP C C 117 176.567 176.567 176.137 0.430 18387 14752 1 18 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.181 0.419 18387 14753 1 18 . 1 1 117 117 ASP CB C 117 40.584 40.584 41.022 -0.438 18387 14754 1 18 . 1 1 117 117 ASP H H 117 9.429 9.429 9.041 0.388 18387 14755 1 18 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.341 -0.147 18387 14756 1 18 . 1 1 118 118 PRO C C 118 177.534 177.534 177.943 -0.409 18387 14757 1 18 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.115 0.050 18387 14758 1 18 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.564 1.249 18387 14759 1 18 . 1 1 119 119 GLU N N 119 114.015 114.015 116.263 -2.248 18387 14760 1 18 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.293 0.047 18387 14761 1 18 . 1 1 119 119 GLU C C 119 176.722 176.722 176.603 0.119 18387 14762 1 18 . 1 1 119 119 GLU CA C 119 55.639 55.639 55.588 0.051 18387 14763 1 18 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.816 0.761 18387 14764 1 18 . 1 1 119 119 GLU H H 119 7.733 7.733 8.654 -0.921 18387 14765 1 18 . 1 1 120 120 GLY N N 120 108.218 108.218 108.130 0.088 18387 14766 1 18 . 1 1 120 120 GLY C C 120 174.110 174.110 173.578 0.532 18387 14767 1 18 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.483 -0.088 18387 14768 1 18 . 1 1 120 120 GLY H H 120 8.588 8.588 8.214 0.374 18387 14769 1 18 . 1 1 121 121 LYS N N 121 121.778 121.778 119.790 1.988 18387 14770 1 18 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.000 -0.141 18387 14771 1 18 . 1 1 121 121 LYS C C 121 176.458 176.458 175.975 0.483 18387 14772 1 18 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.301 0.661 18387 14773 1 18 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.120 -1.668 18387 14774 1 18 . 1 1 121 121 LYS H H 121 8.600 8.600 8.875 -0.275 18387 14775 1 18 . 1 1 122 122 ILE N N 122 122.058 122.058 124.984 -2.926 18387 14776 1 18 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.067 0.205 18387 14777 1 18 . 1 1 122 122 ILE C C 122 177.084 177.084 176.211 0.873 18387 14778 1 18 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.982 -0.163 18387 14779 1 18 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.098 1.550 18387 14780 1 18 . 1 1 122 122 ILE H H 122 9.006 9.006 9.096 -0.090 18387 14781 1 18 . 1 1 123 123 VAL N N 123 120.561 120.561 130.104 -9.543 18387 14782 1 18 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.137 0.618 18387 14783 1 18 . 1 1 123 123 VAL C C 123 175.584 175.584 174.707 0.877 18387 14784 1 18 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.328 -1.177 18387 14785 1 18 . 1 1 123 123 VAL CB C 123 33.401 33.401 33.227 0.174 18387 14786 1 18 . 1 1 123 123 VAL H H 123 9.054 9.054 8.343 0.711 18387 14787 1 18 . 1 1 124 124 ALA N N 124 121.102 121.102 120.980 0.122 18387 14788 1 18 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.718 -0.061 18387 14789 1 18 . 1 1 124 124 ALA C C 124 174.832 174.832 174.617 0.215 18387 14790 1 18 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.033 1.427 18387 14791 1 18 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.402 1.428 18387 14792 1 18 . 1 1 124 124 ALA H H 124 7.793 7.793 7.770 0.023 18387 14793 1 18 . 1 1 125 125 LYS N N 125 117.637 117.637 118.463 -0.826 18387 14794 1 18 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.473 0.560 18387 14795 1 18 . 1 1 125 125 LYS C C 125 173.417 173.417 175.342 -1.925 18387 14796 1 18 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.729 -0.588 18387 14797 1 18 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.263 1.388 18387 14798 1 18 . 1 1 125 125 LYS H H 125 8.872 8.872 8.203 0.669 18387 14799 1 18 . 1 1 126 126 GLU N N 126 115.236 115.236 117.663 -2.427 18387 14800 1 18 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.921 0.077 18387 14801 1 18 . 1 1 126 126 GLU C C 126 175.998 175.998 175.568 0.430 18387 14802 1 18 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.471 -0.509 18387 14803 1 18 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.636 -1.201 18387 14804 1 18 . 1 1 126 126 GLU H H 126 7.941 7.941 8.490 -0.549 18387 14805 1 18 . 1 1 127 127 LEU N N 127 118.584 118.584 118.683 -0.099 18387 14806 1 18 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.360 0.022 18387 14807 1 18 . 1 1 127 127 LEU C C 127 176.766 176.766 176.543 0.223 18387 14808 1 18 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.149 0.460 18387 14809 1 18 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.744 1.219 18387 14810 1 18 . 1 1 127 127 LEU H H 127 7.300 7.300 7.552 -0.252 18387 14811 1 18 . 1 1 128 128 ARG N N 128 118.625 118.625 119.865 -1.240 18387 14812 1 18 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.533 -0.058 18387 14813 1 18 . 1 1 128 128 ARG C C 128 177.113 177.113 177.564 -0.451 18387 14814 1 18 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.525 -1.135 18387 14815 1 18 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.313 2.299 18387 14816 1 18 . 1 1 128 128 ARG H H 128 7.929 7.929 8.088 -0.159 18387 14817 1 18 . 1 1 129 129 GLY N N 129 114.010 114.010 113.550 0.460 18387 14818 1 18 . 1 1 129 129 GLY C C 129 175.931 175.931 174.685 1.246 18387 14819 1 18 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.428 -1.967 18387 14820 1 18 . 1 1 129 129 GLY H H 129 10.649 10.649 9.279 1.370 18387 14821 1 18 . 1 1 130 130 ASP N N 130 123.975 123.975 120.608 3.367 18387 14822 1 18 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.436 1.096 18387 14823 1 18 . 1 1 130 130 ASP C C 130 177.507 177.507 177.914 -0.407 18387 14824 1 18 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.909 0.463 18387 14825 1 18 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.158 0.745 18387 14826 1 18 . 1 1 130 130 ASP H H 130 8.540 8.540 8.162 0.378 18387 14827 1 18 . 1 1 131 131 ASP N N 131 116.806 116.806 120.378 -3.572 18387 14828 1 18 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.572 -0.002 18387 14829 1 18 . 1 1 131 131 ASP C C 131 179.038 179.038 178.270 0.768 18387 14830 1 18 . 1 1 131 131 ASP CA C 131 56.983 56.983 55.735 1.248 18387 14831 1 18 . 1 1 131 131 ASP CB C 131 40.934 40.934 41.172 -0.238 18387 14832 1 18 . 1 1 131 131 ASP H H 131 7.907 7.907 7.612 0.295 18387 14833 1 18 . 1 1 132 132 LEU N N 132 123.869 123.869 121.694 2.175 18387 14834 1 18 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.786 0.005 18387 14835 1 18 . 1 1 132 132 LEU C C 132 176.343 176.343 178.492 -2.149 18387 14836 1 18 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.584 1.200 18387 14837 1 18 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.622 0.146 18387 14838 1 18 . 1 1 132 132 LEU H H 132 7.542 7.542 8.474 -0.932 18387 14839 1 18 . 1 1 133 133 TYR N N 133 120.042 120.042 118.328 1.714 18387 14840 1 18 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.106 -0.111 18387 14841 1 18 . 1 1 133 133 TYR C C 133 177.426 177.426 177.821 -0.395 18387 14842 1 18 . 1 1 133 133 TYR CA C 133 62.133 62.133 61.434 0.699 18387 14843 1 18 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.609 -0.033 18387 14844 1 18 . 1 1 133 133 TYR H H 133 7.384 7.384 7.633 -0.249 18387 14845 1 18 . 1 1 134 134 ASN N N 134 114.936 114.936 117.490 -2.554 18387 14846 1 18 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.334 0.069 18387 14847 1 18 . 1 1 134 134 ASN C C 134 178.703 178.703 178.028 0.675 18387 14848 1 18 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.462 -0.653 18387 14849 1 18 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.020 0.188 18387 14850 1 18 . 1 1 134 134 ASN H H 134 8.399 8.399 7.858 0.541 18387 14851 1 18 . 1 1 135 135 THR N N 135 117.387 117.387 117.642 -0.255 18387 14852 1 18 . 1 1 135 135 THR HA H 135 3.920 3.920 4.106 -0.186 18387 14853 1 18 . 1 1 135 135 THR C C 135 175.323 175.323 176.390 -1.067 18387 14854 1 18 . 1 1 135 135 THR CA C 135 67.402 67.402 67.129 0.273 18387 14855 1 18 . 1 1 135 135 THR CB C 135 68.111 68.111 68.892 -0.781 18387 14856 1 18 . 1 1 135 135 THR H H 135 8.265 8.265 8.645 -0.380 18387 14857 1 18 . 1 1 136 136 VAL N N 136 121.207 121.207 121.296 -0.089 18387 14858 1 18 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.258 -0.243 18387 14859 1 18 . 1 1 136 136 VAL C C 136 176.457 176.457 177.007 -0.550 18387 14860 1 18 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.473 1.799 18387 14861 1 18 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.619 0.323 18387 14862 1 18 . 1 1 136 136 VAL H H 136 7.595 7.595 7.426 0.169 18387 14863 1 18 . 1 1 137 137 GLU N N 137 118.266 118.266 118.579 -0.313 18387 14864 1 18 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.045 -1.363 18387 14865 1 18 . 1 1 137 137 GLU C C 137 177.482 177.482 178.225 -0.743 18387 14866 1 18 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.385 0.545 18387 14867 1 18 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.507 0.275 18387 14868 1 18 . 1 1 137 137 GLU H H 137 8.114 8.114 7.764 0.350 18387 14869 1 18 . 1 1 138 138 LYS N N 138 116.431 116.431 118.954 -2.523 18387 14870 1 18 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.990 -0.222 18387 14871 1 18 . 1 1 138 138 LYS C C 138 179.193 179.193 178.693 0.500 18387 14872 1 18 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.260 -0.220 18387 14873 1 18 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.517 -0.358 18387 14874 1 18 . 1 1 138 138 LYS H H 138 7.133 7.133 7.855 -0.722 18387 14875 1 18 . 1 1 139 139 PHE N N 139 116.336 116.336 116.230 0.106 18387 14876 1 18 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.224 -0.214 18387 14877 1 18 . 1 1 139 139 PHE C C 139 177.855 177.855 177.282 0.573 18387 14878 1 18 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.238 1.146 18387 14879 1 18 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.504 -0.152 18387 14880 1 18 . 1 1 139 139 PHE H H 139 7.338 7.338 8.286 -0.948 18387 14881 1 18 . 1 1 140 140 VAL N N 140 116.491 116.491 116.803 -0.312 18387 14882 1 18 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.276 0.248 18387 14883 1 18 . 1 1 140 140 VAL C C 140 177.747 177.747 177.361 0.386 18387 14884 1 18 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.079 0.163 18387 14885 1 18 . 1 1 140 140 VAL CB C 140 31.390 31.390 30.938 0.452 18387 14886 1 18 . 1 1 140 140 VAL H H 140 8.332 8.332 7.507 0.825 18387 14887 1 18 . 1 1 141 141 ASN N N 141 116.956 116.956 116.355 0.601 18387 14888 1 18 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.707 0.119 18387 14889 1 18 . 1 1 141 141 ASN C C 141 176.997 176.997 176.072 0.925 18387 14890 1 18 . 1 1 141 141 ASN CA C 141 53.677 53.677 53.934 -0.257 18387 14891 1 18 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.113 -0.665 18387 14892 1 18 . 1 1 141 141 ASN H H 141 7.862 7.862 7.517 0.345 18387 14893 1 18 . 1 1 142 142 GLY N N 142 107.938 107.938 105.950 1.988 18387 14894 1 18 . 1 1 142 142 GLY C C 142 174.336 174.336 174.415 -0.079 18387 14895 1 18 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.650 0.335 18387 14896 1 18 . 1 1 142 142 GLY H H 142 7.466 7.466 7.489 -0.023 18387 14897 1 18 . 1 1 143 143 ALA N N 143 123.441 123.441 116.720 6.721 18387 14898 1 18 . 1 1 143 143 ALA HA H 143 4.341 4.341 3.895 0.446 18387 14899 1 18 . 1 1 143 143 ALA C C 143 178.212 178.212 176.728 1.484 18387 14900 1 18 . 1 1 143 143 ALA CA C 143 52.826 52.826 53.785 -0.959 18387 14901 1 18 . 1 1 143 143 ALA CB C 143 19.244 19.244 17.459 1.784 18387 14902 1 18 . 1 1 143 143 ALA H H 143 7.950 7.950 7.811 0.139 18387 14903 1 18 . 1 1 144 144 LYS N N 144 120.149 120.149 115.858 4.291 18387 14904 1 18 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.448 -0.153 18387 14905 1 18 . 1 1 144 144 LYS C C 144 176.945 176.945 178.069 -1.124 18387 14906 1 18 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.574 -0.055 18387 14907 1 18 . 1 1 144 144 LYS CB C 144 33.030 33.030 34.422 -1.392 18387 14908 1 18 . 1 1 144 144 LYS H H 144 8.187 8.187 7.608 0.579 18387 14909 1 18 . 1 1 145 145 GLU N N 145 120.992 120.992 116.757 4.235 18387 14910 1 18 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.008 0.287 18387 14911 1 18 . 1 1 145 145 GLU C C 145 177.116 177.116 176.444 0.672 18387 14912 1 18 . 1 1 145 145 GLU CA C 145 56.903 56.903 58.501 -1.598 18387 14913 1 18 . 1 1 145 145 GLU CB C 145 30.242 30.242 28.568 1.674 18387 14914 1 18 . 1 1 145 145 GLU H H 145 8.363 8.363 8.552 -0.189 18387 14915 1 18 . 1 1 146 146 GLY N N 146 109.467 109.467 106.231 3.236 18387 14916 1 18 . 1 1 146 146 GLY C C 146 174.108 174.108 173.866 0.242 18387 14917 1 18 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.761 0.640 18387 14918 1 18 . 1 1 146 146 GLY H H 146 8.371 8.371 7.881 0.490 18387 14919 1 18 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.636 -0.027 18387 14920 1 18 . 1 1 151 151 HIS C C 151 174.258 174.258 174.632 -0.374 18387 14921 1 18 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.347 -0.182 18387 14922 1 18 . 1 1 151 151 HIS CB C 151 30.833 30.833 31.821 -0.988 18387 14923 1 19 . 1 1 2 2 SER HA H 2 3.992 3.992 4.056 -0.064 18387 14924 1 19 . 1 1 2 2 SER CA C 2 57.555 57.555 60.497 -2.942 18387 14925 1 19 . 1 1 2 2 SER CB C 2 64.977 64.977 62.074 2.904 18387 14926 1 19 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.610 -0.171 18387 14927 1 19 . 1 1 3 3 LEU C C 3 176.631 176.631 175.427 1.204 18387 14928 1 19 . 1 1 3 3 LEU CA C 3 54.564 54.564 53.685 0.879 18387 14929 1 19 . 1 1 3 3 LEU CB C 3 42.724 42.724 43.857 -1.133 18387 14930 1 19 . 1 1 4 4 ALA N N 4 125.483 125.483 121.655 3.828 18387 14931 1 19 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.703 -0.324 18387 14932 1 19 . 1 1 4 4 ALA C C 4 179.642 179.642 176.637 3.005 18387 14933 1 19 . 1 1 4 4 ALA CA C 4 51.735 51.735 52.215 -0.480 18387 14934 1 19 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.827 -1.075 18387 14935 1 19 . 1 1 4 4 ALA H H 4 8.483 8.483 8.152 0.331 18387 14936 1 19 . 1 1 5 5 THR HA H 5 3.845 3.845 4.961 -1.116 18387 14937 1 19 . 1 1 5 5 THR C C 5 175.487 175.487 175.264 0.223 18387 14938 1 19 . 1 1 5 5 THR CA C 5 64.531 64.531 61.192 3.339 18387 14939 1 19 . 1 1 5 5 THR CB C 5 68.108 68.108 71.157 -3.049 18387 14940 1 19 . 1 1 6 6 GLY N N 6 114.298 114.298 114.447 -0.149 18387 14941 1 19 . 1 1 6 6 GLY C C 6 174.324 174.324 174.181 0.143 18387 14942 1 19 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.849 -1.014 18387 14943 1 19 . 1 1 6 6 GLY H H 6 9.511 9.511 8.789 0.722 18387 14944 1 19 . 1 1 7 7 SER N N 7 115.270 115.270 116.634 -1.364 18387 14945 1 19 . 1 1 7 7 SER HA H 7 4.500 4.500 4.641 -0.141 18387 14946 1 19 . 1 1 7 7 SER C C 7 173.315 173.315 173.714 -0.399 18387 14947 1 19 . 1 1 7 7 SER CA C 7 58.915 58.915 57.670 1.245 18387 14948 1 19 . 1 1 7 7 SER CB C 7 64.308 64.308 64.723 -0.415 18387 14949 1 19 . 1 1 7 7 SER H H 7 7.736 7.736 7.692 0.044 18387 14950 1 19 . 1 1 8 8 VAL N N 8 123.708 123.708 124.266 -0.558 18387 14951 1 19 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.132 -0.300 18387 14952 1 19 . 1 1 8 8 VAL C C 8 176.673 176.673 175.200 1.473 18387 14953 1 19 . 1 1 8 8 VAL CA C 8 63.673 63.673 61.695 1.978 18387 14954 1 19 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.970 -0.748 18387 14955 1 19 . 1 1 8 8 VAL H H 8 8.632 8.632 8.534 0.098 18387 14956 1 19 . 1 1 9 9 ALA N N 9 133.040 133.040 130.761 2.279 18387 14957 1 19 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.720 -0.457 18387 14958 1 19 . 1 1 9 9 ALA C C 9 175.404 175.404 174.762 0.642 18387 14959 1 19 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.095 1.860 18387 14960 1 19 . 1 1 9 9 ALA CB C 9 18.030 18.030 19.816 -1.786 18387 14961 1 19 . 1 1 9 9 ALA H H 9 8.448 8.448 9.022 -0.574 18387 14962 1 19 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.405 -0.074 18387 14963 1 19 . 1 1 10 10 PRO C C 10 175.071 175.071 175.823 -0.752 18387 14964 1 19 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.307 0.334 18387 14965 1 19 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.362 -0.038 18387 14966 1 19 . 1 1 11 11 ALA N N 11 124.172 124.172 123.672 0.500 18387 14967 1 19 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.494 -0.250 18387 14968 1 19 . 1 1 11 11 ALA C C 11 177.688 177.688 177.443 0.245 18387 14969 1 19 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.011 2.610 18387 14970 1 19 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.210 0.116 18387 14971 1 19 . 1 1 11 11 ALA H H 11 8.221 8.221 8.357 -0.136 18387 14972 1 19 . 1 1 12 12 ILE N N 12 117.815 117.815 125.760 -7.945 18387 14973 1 19 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.142 0.186 18387 14974 1 19 . 1 1 12 12 ILE C C 12 175.013 175.013 175.712 -0.699 18387 14975 1 19 . 1 1 12 12 ILE CA C 12 62.166 62.166 62.268 -0.102 18387 14976 1 19 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.224 5.066 18387 14977 1 19 . 1 1 12 12 ILE H H 12 7.693 7.693 8.450 -0.757 18387 14978 1 19 . 1 1 13 13 THR N N 13 121.186 121.186 119.218 1.968 18387 14979 1 19 . 1 1 13 13 THR HA H 13 4.840 4.840 5.129 -0.289 18387 14980 1 19 . 1 1 13 13 THR C C 13 172.625 172.625 173.414 -0.789 18387 14981 1 19 . 1 1 13 13 THR CA C 13 62.297 62.297 60.982 1.315 18387 14982 1 19 . 1 1 13 13 THR CB C 13 71.585 71.585 70.953 0.632 18387 14983 1 19 . 1 1 13 13 THR H H 13 8.363 8.363 8.314 0.049 18387 14984 1 19 . 1 1 14 14 GLY N N 14 110.785 110.785 113.849 -3.064 18387 14985 1 19 . 1 1 14 14 GLY C C 14 170.040 170.040 171.961 -1.921 18387 14986 1 19 . 1 1 14 14 GLY CA C 14 44.390 44.390 44.392 -0.002 18387 14987 1 19 . 1 1 14 14 GLY H H 14 7.993 7.993 9.008 -1.015 18387 14988 1 19 . 1 1 15 15 ILE N N 15 119.088 119.088 120.857 -1.769 18387 14989 1 19 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.912 0.213 18387 14990 1 19 . 1 1 15 15 ILE C C 15 176.359 176.359 176.046 0.313 18387 14991 1 19 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.813 -2.199 18387 14992 1 19 . 1 1 15 15 ILE CB C 15 38.639 38.639 37.759 0.880 18387 14993 1 19 . 1 1 15 15 ILE H H 15 7.973 7.973 8.409 -0.436 18387 14994 1 19 . 1 1 16 16 ASP N N 16 126.633 126.633 127.778 -1.145 18387 14995 1 19 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.380 0.469 18387 14996 1 19 . 1 1 16 16 ASP C C 16 179.190 179.190 177.399 1.791 18387 14997 1 19 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.207 -0.327 18387 14998 1 19 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.919 -0.643 18387 14999 1 19 . 1 1 16 16 ASP H H 16 9.335 9.335 8.829 0.506 18387 15000 1 19 . 1 1 17 17 LEU N N 17 116.648 116.648 118.301 -1.653 18387 15001 1 19 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.058 0.116 18387 15002 1 19 . 1 1 17 17 LEU C C 17 178.432 178.432 178.805 -0.373 18387 15003 1 19 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.139 0.842 18387 15004 1 19 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.950 1.036 18387 15005 1 19 . 1 1 17 17 LEU H H 17 8.071 8.071 8.675 -0.604 18387 15006 1 19 . 1 1 18 18 LYS N N 18 117.401 117.401 117.007 0.394 18387 15007 1 19 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.219 0.290 18387 15008 1 19 . 1 1 18 18 LYS C C 18 176.793 176.793 177.386 -0.593 18387 15009 1 19 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.214 -1.779 18387 15010 1 19 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.209 -0.146 18387 15011 1 19 . 1 1 18 18 LYS H H 18 8.207 8.207 8.622 -0.415 18387 15012 1 19 . 1 1 19 19 GLY N N 19 108.061 108.061 107.109 0.952 18387 15013 1 19 . 1 1 19 19 GLY C C 19 174.649 174.649 173.986 0.663 18387 15014 1 19 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.611 0.986 18387 15015 1 19 . 1 1 19 19 GLY H H 19 8.099 8.099 8.218 -0.119 18387 15016 1 19 . 1 1 20 20 ASN N N 20 121.012 121.012 119.779 1.233 18387 15017 1 19 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.044 -0.139 18387 15018 1 19 . 1 1 20 20 ASN C C 20 174.827 174.827 174.834 -0.007 18387 15019 1 19 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.348 0.119 18387 15020 1 19 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.154 -1.478 18387 15021 1 19 . 1 1 20 20 ASN H H 20 8.945 8.945 9.316 -0.371 18387 15022 1 19 . 1 1 21 21 SER N N 21 117.285 117.285 117.470 -0.185 18387 15023 1 19 . 1 1 21 21 SER HA H 21 5.000 5.000 4.756 0.244 18387 15024 1 19 . 1 1 21 21 SER C C 21 174.911 174.911 174.378 0.533 18387 15025 1 19 . 1 1 21 21 SER CA C 21 58.730 58.730 58.603 0.127 18387 15026 1 19 . 1 1 21 21 SER CB C 21 63.162 63.162 62.536 0.626 18387 15027 1 19 . 1 1 21 21 SER H H 21 8.740 8.740 8.688 0.052 18387 15028 1 19 . 1 1 22 22 VAL N N 22 128.665 128.665 127.440 1.225 18387 15029 1 19 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.324 0.056 18387 15030 1 19 . 1 1 22 22 VAL C C 22 176.276 176.276 175.559 0.717 18387 15031 1 19 . 1 1 22 22 VAL CA C 22 62.953 62.953 62.057 0.896 18387 15032 1 19 . 1 1 22 22 VAL CB C 22 35.582 35.582 33.360 2.222 18387 15033 1 19 . 1 1 22 22 VAL H H 22 9.125 9.125 9.031 0.094 18387 15034 1 19 . 1 1 23 23 SER N N 23 127.457 127.457 122.070 5.387 18387 15035 1 19 . 1 1 23 23 SER HA H 23 5.878 5.878 5.323 0.555 18387 15036 1 19 . 1 1 23 23 SER C C 23 174.436 174.436 175.754 -1.318 18387 15037 1 19 . 1 1 23 23 SER CA C 23 57.101 57.101 57.037 0.064 18387 15038 1 19 . 1 1 23 23 SER CB C 23 66.078 66.078 65.013 1.066 18387 15039 1 19 . 1 1 23 23 SER H H 23 8.971 8.971 8.815 0.156 18387 15040 1 19 . 1 1 24 24 LEU N N 24 126.734 126.734 124.048 2.686 18387 15041 1 19 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.886 -0.419 18387 15042 1 19 . 1 1 24 24 LEU C C 24 179.852 179.852 177.452 2.400 18387 15043 1 19 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.034 1.169 18387 15044 1 19 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.931 0.047 18387 15045 1 19 . 1 1 24 24 LEU H H 24 8.450 8.450 9.134 -0.684 18387 15046 1 19 . 1 1 25 25 ASN N N 25 115.642 115.642 116.431 -0.789 18387 15047 1 19 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.489 -0.247 18387 15048 1 19 . 1 1 25 25 ASN C C 25 176.246 176.246 176.368 -0.122 18387 15049 1 19 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.100 0.270 18387 15050 1 19 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.434 1.337 18387 15051 1 19 . 1 1 25 25 ASN H H 25 8.505 8.505 8.548 -0.043 18387 15052 1 19 . 1 1 26 26 ASP N N 26 119.722 119.722 120.180 -0.458 18387 15053 1 19 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.446 -0.241 18387 15054 1 19 . 1 1 26 26 ASP C C 26 176.708 176.708 176.079 0.629 18387 15055 1 19 . 1 1 26 26 ASP CA C 26 56.525 56.525 55.823 0.702 18387 15056 1 19 . 1 1 26 26 ASP CB C 26 39.280 39.280 41.223 -1.943 18387 15057 1 19 . 1 1 26 26 ASP H H 26 7.731 7.731 7.974 -0.243 18387 15058 1 19 . 1 1 27 27 PHE N N 27 116.827 116.827 115.995 0.832 18387 15059 1 19 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.543 -0.063 18387 15060 1 19 . 1 1 27 27 PHE C C 27 174.227 174.227 175.738 -1.511 18387 15061 1 19 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.235 -0.164 18387 15062 1 19 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.334 0.385 18387 15063 1 19 . 1 1 27 27 PHE H H 27 7.390 7.390 7.366 0.024 18387 15064 1 19 . 1 1 28 28 LYS N N 28 120.357 120.357 122.183 -1.826 18387 15065 1 19 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.252 0.135 18387 15066 1 19 . 1 1 28 28 LYS C C 28 177.845 177.845 176.544 1.301 18387 15067 1 19 . 1 1 28 28 LYS CA C 28 58.002 58.002 56.743 1.258 18387 15068 1 19 . 1 1 28 28 LYS CB C 28 32.544 32.544 30.557 1.987 18387 15069 1 19 . 1 1 28 28 LYS H H 28 6.883 6.883 7.260 -0.377 18387 15070 1 19 . 1 1 29 29 GLY N N 29 112.653 112.653 108.030 4.623 18387 15071 1 19 . 1 1 29 29 GLY C C 29 173.799 173.799 173.709 0.090 18387 15072 1 19 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.172 -0.184 18387 15073 1 19 . 1 1 29 29 GLY H H 29 8.930 8.930 8.378 0.552 18387 15074 1 19 . 1 1 30 30 LYS N N 30 120.516 120.516 118.180 2.336 18387 15075 1 19 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.685 -0.050 18387 15076 1 19 . 1 1 30 30 LYS C C 30 176.505 176.505 174.317 2.188 18387 15077 1 19 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.806 0.374 18387 15078 1 19 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.172 -1.315 18387 15079 1 19 . 1 1 30 30 LYS H H 30 8.098 8.098 7.402 0.696 18387 15080 1 19 . 1 1 31 31 TYR N N 31 117.383 117.383 120.778 -3.395 18387 15081 1 19 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.510 0.144 18387 15082 1 19 . 1 1 31 31 TYR C C 31 175.551 175.551 175.079 0.472 18387 15083 1 19 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.630 0.535 18387 15084 1 19 . 1 1 31 31 TYR CB C 31 41.193 41.193 39.687 1.506 18387 15085 1 19 . 1 1 31 31 TYR H H 31 8.263 8.263 8.950 -0.687 18387 15086 1 19 . 1 1 32 32 VAL N N 32 120.900 120.900 126.099 -5.199 18387 15087 1 19 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.817 -0.378 18387 15088 1 19 . 1 1 32 32 VAL C C 32 175.975 175.975 174.678 1.297 18387 15089 1 19 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.099 -0.393 18387 15090 1 19 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.676 2.831 18387 15091 1 19 . 1 1 32 32 VAL H H 32 9.244 9.244 9.178 0.066 18387 15092 1 19 . 1 1 33 33 LEU N N 33 130.058 130.058 130.970 -0.912 18387 15093 1 19 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.072 0.101 18387 15094 1 19 . 1 1 33 33 LEU C C 33 174.693 174.693 175.024 -0.331 18387 15095 1 19 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.688 -0.340 18387 15096 1 19 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.748 0.573 18387 15097 1 19 . 1 1 33 33 LEU H H 33 8.161 8.161 7.935 0.226 18387 15098 1 19 . 1 1 34 34 VAL N N 34 129.232 129.232 129.012 0.220 18387 15099 1 19 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.736 0.246 18387 15100 1 19 . 1 1 34 34 VAL C C 34 174.285 174.285 175.013 -0.728 18387 15101 1 19 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.293 0.213 18387 15102 1 19 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.968 -0.590 18387 15103 1 19 . 1 1 34 34 VAL H H 34 9.296 9.296 9.098 0.198 18387 15104 1 19 . 1 1 35 35 ASP N N 35 123.675 123.675 128.382 -4.707 18387 15105 1 19 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.984 0.365 18387 15106 1 19 . 1 1 35 35 ASP C C 35 174.258 174.258 175.287 -1.029 18387 15107 1 19 . 1 1 35 35 ASP CA C 35 51.054 51.054 54.345 -3.291 18387 15108 1 19 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.263 -1.801 18387 15109 1 19 . 1 1 35 35 ASP H H 35 8.015 8.015 8.587 -0.572 18387 15110 1 19 . 1 1 36 36 PHE N N 36 126.959 126.959 123.246 3.713 18387 15111 1 19 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.766 0.169 18387 15112 1 19 . 1 1 36 36 PHE C C 36 175.432 175.432 175.332 0.100 18387 15113 1 19 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.128 0.967 18387 15114 1 19 . 1 1 36 36 PHE CB C 36 40.030 40.030 41.706 -1.676 18387 15115 1 19 . 1 1 36 36 PHE H H 36 9.171 9.171 8.711 0.460 18387 15116 1 19 . 1 1 37 37 TRP N N 37 120.839 120.839 122.760 -1.921 18387 15117 1 19 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.344 0.413 18387 15118 1 19 . 1 1 37 37 TRP C C 37 172.412 172.412 173.387 -0.975 18387 15119 1 19 . 1 1 37 37 TRP CA C 37 55.909 55.909 56.130 -0.221 18387 15120 1 19 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.700 -0.020 18387 15121 1 19 . 1 1 37 37 TRP H H 37 9.280 9.280 9.009 0.271 18387 15122 1 19 . 1 1 38 38 PHE N N 38 109.215 109.215 113.063 -3.848 18387 15123 1 19 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.346 -0.413 18387 15124 1 19 . 1 1 38 38 PHE C C 38 176.141 176.141 174.235 1.906 18387 15125 1 19 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.957 0.054 18387 15126 1 19 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.164 -0.545 18387 15127 1 19 . 1 1 38 38 PHE H H 38 7.062 7.062 7.900 -0.838 18387 15128 1 19 . 1 1 39 39 ALA N N 39 125.193 125.193 121.979 3.214 18387 15129 1 19 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.188 -0.123 18387 15130 1 19 . 1 1 39 39 ALA C C 39 179.349 179.349 178.747 0.602 18387 15131 1 19 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.518 1.546 18387 15132 1 19 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.788 1.109 18387 15133 1 19 . 1 1 39 39 ALA H H 39 10.355 10.355 9.507 0.848 18387 15134 1 19 . 1 1 40 40 GLY N N 40 103.437 103.437 107.063 -3.626 18387 15135 1 19 . 1 1 40 40 GLY C C 40 172.732 172.732 173.863 -1.131 18387 15136 1 19 . 1 1 40 40 GLY CA C 40 44.936 44.936 46.009 -1.073 18387 15137 1 19 . 1 1 40 40 GLY H H 40 8.583 8.583 8.633 -0.050 18387 15138 1 19 . 1 1 41 41 CYS N N 41 124.859 124.859 119.286 5.573 18387 15139 1 19 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.287 0.117 18387 15140 1 19 . 1 1 41 41 CYS C C 41 176.620 176.620 175.543 1.077 18387 15141 1 19 . 1 1 41 41 CYS CA C 41 58.375 58.375 58.874 -0.499 18387 15142 1 19 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.137 1.239 18387 15143 1 19 . 1 1 41 41 CYS H H 41 6.946 6.946 6.588 0.358 18387 15144 1 19 . 1 1 42 42 SER HA H 42 4.040 4.040 4.304 -0.264 18387 15145 1 19 . 1 1 42 42 SER CA C 42 61.552 61.552 59.996 1.556 18387 15146 1 19 . 1 1 42 42 SER CB C 42 62.675 62.675 62.779 -0.104 18387 15147 1 19 . 1 1 43 43 TRP N N 43 129.748 129.748 122.498 7.250 18387 15148 1 19 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.696 -0.146 18387 15149 1 19 . 1 1 43 43 TRP C C 43 180.400 180.400 178.071 2.329 18387 15150 1 19 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.404 0.845 18387 15151 1 19 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.938 -0.346 18387 15152 1 19 . 1 1 44 44 CYS N N 44 124.462 124.462 118.665 5.797 18387 15153 1 19 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.057 0.194 18387 15154 1 19 . 1 1 44 44 CYS C C 44 178.643 178.643 176.462 2.181 18387 15155 1 19 . 1 1 44 44 CYS CA C 44 64.849 64.849 63.551 1.298 18387 15156 1 19 . 1 1 44 44 CYS CB C 44 29.422 29.422 26.889 2.533 18387 15157 1 19 . 1 1 44 44 CYS H H 44 9.591 9.591 7.944 1.647 18387 15158 1 19 . 1 1 45 45 ARG N N 45 117.248 117.248 116.449 0.799 18387 15159 1 19 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.454 -0.278 18387 15160 1 19 . 1 1 45 45 ARG C C 45 180.302 180.302 177.227 3.075 18387 15161 1 19 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.199 -0.256 18387 15162 1 19 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.419 -1.788 18387 15163 1 19 . 1 1 45 45 ARG H H 45 7.955 7.955 7.870 0.085 18387 15164 1 19 . 1 1 46 46 LYS N N 46 120.318 120.318 117.639 2.679 18387 15165 1 19 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.100 0.172 18387 15166 1 19 . 1 1 46 46 LYS C C 46 177.755 177.755 177.939 -0.184 18387 15167 1 19 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.540 1.229 18387 15168 1 19 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.124 1.033 18387 15169 1 19 . 1 1 46 46 LYS H H 46 8.129 8.129 7.585 0.544 18387 15170 1 19 . 1 1 47 47 GLU N N 47 114.278 114.278 117.351 -3.073 18387 15171 1 19 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.342 0.549 18387 15172 1 19 . 1 1 47 47 GLU C C 47 178.701 178.701 178.144 0.557 18387 15173 1 19 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.739 -1.185 18387 15174 1 19 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.252 0.514 18387 15175 1 19 . 1 1 47 47 GLU H H 47 7.386 7.386 7.392 -0.006 18387 15176 1 19 . 1 1 48 48 THR N N 48 115.665 115.665 117.731 -2.066 18387 15177 1 19 . 1 1 48 48 THR HA H 48 4.048 4.048 4.089 -0.041 18387 15178 1 19 . 1 1 48 48 THR C C 48 172.392 172.392 173.973 -1.581 18387 15179 1 19 . 1 1 48 48 THR CA C 48 69.426 69.426 68.595 0.831 18387 15180 1 19 . 1 1 48 48 THR CB C 48 66.906 66.906 67.003 -0.097 18387 15181 1 19 . 1 1 48 48 THR H H 48 7.810 7.810 7.518 0.292 18387 15182 1 19 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.096 0.193 18387 15183 1 19 . 1 1 49 49 PRO C C 49 179.828 179.828 178.576 1.252 18387 15184 1 19 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.450 0.149 18387 15185 1 19 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.009 0.025 18387 15186 1 19 . 1 1 50 50 TYR N N 50 116.950 116.950 116.374 0.576 18387 15187 1 19 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.279 -0.141 18387 15188 1 19 . 1 1 50 50 TYR C C 50 179.488 179.488 178.503 0.985 18387 15189 1 19 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.295 -0.160 18387 15190 1 19 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.854 0.447 18387 15191 1 19 . 1 1 50 50 TYR H H 50 7.071 7.071 7.351 -0.280 18387 15192 1 19 . 1 1 51 51 LEU N N 51 123.989 123.989 120.779 3.210 18387 15193 1 19 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.808 -0.138 18387 15194 1 19 . 1 1 51 51 LEU C C 51 178.072 178.072 178.761 -0.689 18387 15195 1 19 . 1 1 51 51 LEU CA C 51 58.676 58.676 58.072 0.604 18387 15196 1 19 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.544 1.073 18387 15197 1 19 . 1 1 51 51 LEU H H 51 8.243 8.243 8.400 -0.157 18387 15198 1 19 . 1 1 52 52 LEU N N 52 119.857 119.857 119.891 -0.034 18387 15199 1 19 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.026 0.301 18387 15200 1 19 . 1 1 52 52 LEU C C 52 178.704 178.704 178.335 0.369 18387 15201 1 19 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.312 0.263 18387 15202 1 19 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.701 1.037 18387 15203 1 19 . 1 1 52 52 LEU H H 52 9.085 9.085 8.701 0.384 18387 15204 1 19 . 1 1 53 53 LYS N N 53 118.658 118.658 119.076 -0.418 18387 15205 1 19 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.048 0.061 18387 15206 1 19 . 1 1 53 53 LYS C C 53 179.786 179.786 179.028 0.758 18387 15207 1 19 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.267 0.453 18387 15208 1 19 . 1 1 53 53 LYS CB C 53 33.159 33.159 31.819 1.340 18387 15209 1 19 . 1 1 53 53 LYS H H 53 7.807 7.807 7.994 -0.187 18387 15210 1 19 . 1 1 54 54 THR N N 54 116.869 116.869 116.992 -0.123 18387 15211 1 19 . 1 1 54 54 THR HA H 54 3.965 3.965 4.410 -0.445 18387 15212 1 19 . 1 1 54 54 THR C C 54 175.328 175.328 176.315 -0.987 18387 15213 1 19 . 1 1 54 54 THR CA C 54 67.683 67.683 67.893 -0.210 18387 15214 1 19 . 1 1 54 54 THR CB C 54 68.452 68.452 68.647 -0.195 18387 15215 1 19 . 1 1 54 54 THR H H 54 7.771 7.771 8.256 -0.485 18387 15216 1 19 . 1 1 55 55 TYR N N 55 122.202 122.202 121.945 0.257 18387 15217 1 19 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.185 0.087 18387 15218 1 19 . 1 1 55 55 TYR C C 55 176.809 176.809 177.463 -0.654 18387 15219 1 19 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.835 0.902 18387 15220 1 19 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.355 0.925 18387 15221 1 19 . 1 1 55 55 TYR H H 55 9.145 9.145 8.659 0.486 18387 15222 1 19 . 1 1 56 56 ASN N N 56 113.858 113.858 117.085 -3.227 18387 15223 1 19 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.385 -0.122 18387 15224 1 19 . 1 1 56 56 ASN C C 56 177.427 177.427 176.566 0.861 18387 15225 1 19 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.256 0.674 18387 15226 1 19 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.669 -0.716 18387 15227 1 19 . 1 1 56 56 ASN H H 56 8.850 8.850 8.186 0.664 18387 15228 1 19 . 1 1 57 57 ALA N N 57 118.829 118.829 120.127 -1.298 18387 15229 1 19 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.273 -0.209 18387 15230 1 19 . 1 1 57 57 ALA C C 57 180.445 180.445 178.699 1.746 18387 15231 1 19 . 1 1 57 57 ALA CA C 57 54.351 54.351 53.974 0.377 18387 15232 1 19 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.205 -0.011 18387 15233 1 19 . 1 1 57 57 ALA H H 57 7.436 7.436 7.979 -0.543 18387 15234 1 19 . 1 1 58 58 PHE N N 58 112.082 112.082 115.061 -2.979 18387 15235 1 19 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.464 0.457 18387 15236 1 19 . 1 1 58 58 PHE C C 58 176.999 176.999 174.943 2.056 18387 15237 1 19 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.975 0.092 18387 15238 1 19 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.926 0.564 18387 15239 1 19 . 1 1 58 58 PHE H H 58 7.480 7.480 8.223 -0.743 18387 15240 1 19 . 1 1 59 59 LYS N N 59 120.666 120.666 119.460 1.206 18387 15241 1 19 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.505 0.298 18387 15242 1 19 . 1 1 59 59 LYS C C 59 177.157 177.157 177.692 -0.535 18387 15243 1 19 . 1 1 59 59 LYS CA C 59 59.081 59.081 57.176 1.905 18387 15244 1 19 . 1 1 59 59 LYS CB C 59 30.568 30.568 32.890 -2.322 18387 15245 1 19 . 1 1 59 59 LYS H H 59 8.411 8.411 7.204 1.207 18387 15246 1 19 . 1 1 60 60 ASP N N 60 118.908 118.908 118.206 0.702 18387 15247 1 19 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.337 0.788 18387 15248 1 19 . 1 1 60 60 ASP C C 60 176.889 176.889 176.597 0.292 18387 15249 1 19 . 1 1 60 60 ASP CA C 60 54.649 54.649 57.230 -2.581 18387 15250 1 19 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.671 1.041 18387 15251 1 19 . 1 1 60 60 ASP H H 60 8.574 8.574 8.996 -0.422 18387 15252 1 19 . 1 1 61 61 LYS N N 61 121.021 121.021 119.412 1.609 18387 15253 1 19 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.186 0.528 18387 15254 1 19 . 1 1 61 61 LYS C C 61 175.968 175.968 177.921 -1.953 18387 15255 1 19 . 1 1 61 61 LYS CA C 61 55.137 55.137 57.256 -2.119 18387 15256 1 19 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.106 -0.028 18387 15257 1 19 . 1 1 61 61 LYS H H 61 8.278 8.278 8.097 0.181 18387 15258 1 19 . 1 1 62 62 GLY C C 62 173.837 173.837 172.741 1.096 18387 15259 1 19 . 1 1 62 62 GLY CA C 62 47.050 47.050 44.724 2.326 18387 15260 1 19 . 1 1 63 63 PHE N N 63 120.476 120.476 121.058 -0.582 18387 15261 1 19 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.935 0.098 18387 15262 1 19 . 1 1 63 63 PHE C C 63 173.613 173.613 173.287 0.326 18387 15263 1 19 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.400 -0.550 18387 15264 1 19 . 1 1 63 63 PHE CB C 63 42.675 42.675 43.188 -0.513 18387 15265 1 19 . 1 1 63 63 PHE H H 63 7.413 7.413 7.827 -0.414 18387 15266 1 19 . 1 1 64 64 THR N N 64 119.903 119.903 119.946 -0.043 18387 15267 1 19 . 1 1 64 64 THR HA H 64 4.097 4.097 4.800 -0.703 18387 15268 1 19 . 1 1 64 64 THR C C 64 170.397 170.397 172.165 -1.768 18387 15269 1 19 . 1 1 64 64 THR CA C 64 60.261 60.261 61.501 -1.240 18387 15270 1 19 . 1 1 64 64 THR CB C 64 69.507 69.507 72.936 -3.429 18387 15271 1 19 . 1 1 64 64 THR H H 64 7.665 7.665 8.582 -0.917 18387 15272 1 19 . 1 1 65 65 ILE N N 65 117.277 117.277 123.624 -6.347 18387 15273 1 19 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.549 -0.073 18387 15274 1 19 . 1 1 65 65 ILE C C 65 173.056 173.056 175.097 -2.041 18387 15275 1 19 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.527 -0.819 18387 15276 1 19 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.529 0.317 18387 15277 1 19 . 1 1 65 65 ILE H H 65 7.321 7.321 8.840 -1.519 18387 15278 1 19 . 1 1 66 66 TYR N N 66 131.968 131.968 129.251 2.717 18387 15279 1 19 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.843 0.404 18387 15280 1 19 . 1 1 66 66 TYR C C 66 174.074 174.074 175.229 -1.155 18387 15281 1 19 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.881 -0.916 18387 15282 1 19 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.904 1.213 18387 15283 1 19 . 1 1 66 66 TYR H H 66 9.038 9.038 9.357 -0.319 18387 15284 1 19 . 1 1 67 67 GLY N N 67 114.364 114.364 116.072 -1.708 18387 15285 1 19 . 1 1 67 67 GLY C C 67 172.461 172.461 172.677 -0.216 18387 15286 1 19 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.967 0.033 18387 15287 1 19 . 1 1 67 67 GLY H H 67 9.188 9.188 9.314 -0.126 18387 15288 1 19 . 1 1 68 68 VAL N N 68 126.938 126.938 127.970 -1.032 18387 15289 1 19 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.411 -0.275 18387 15290 1 19 . 1 1 68 68 VAL C C 68 173.822 173.822 174.383 -0.561 18387 15291 1 19 . 1 1 68 68 VAL CA C 68 61.498 61.498 61.601 -0.103 18387 15292 1 19 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.336 1.222 18387 15293 1 19 . 1 1 68 68 VAL H H 68 9.309 9.309 8.450 0.859 18387 15294 1 19 . 1 1 69 69 SER N N 69 118.813 118.813 121.147 -2.334 18387 15295 1 19 . 1 1 69 69 SER HA H 69 5.527 5.527 5.184 0.343 18387 15296 1 19 . 1 1 69 69 SER C C 69 175.753 175.753 172.345 3.408 18387 15297 1 19 . 1 1 69 69 SER CA C 69 54.407 54.407 55.904 -1.497 18387 15298 1 19 . 1 1 69 69 SER CB C 69 63.630 63.630 65.756 -2.126 18387 15299 1 19 . 1 1 69 69 SER H H 69 8.124 8.124 8.676 -0.552 18387 15300 1 19 . 1 1 70 70 THR N N 70 113.861 113.861 118.962 -5.101 18387 15301 1 19 . 1 1 70 70 THR HA H 70 4.381 4.381 4.349 0.032 18387 15302 1 19 . 1 1 70 70 THR C C 70 175.001 175.001 172.790 2.211 18387 15303 1 19 . 1 1 70 70 THR CA C 70 60.259 60.259 60.151 0.108 18387 15304 1 19 . 1 1 70 70 THR CB C 70 67.291 67.291 68.962 -1.671 18387 15305 1 19 . 1 1 70 70 THR H H 70 7.656 7.656 7.860 -0.204 18387 15306 1 19 . 1 1 71 71 ASP N N 71 125.133 125.133 121.485 3.648 18387 15307 1 19 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.364 -0.294 18387 15308 1 19 . 1 1 71 71 ASP C C 71 175.685 175.685 177.690 -2.005 18387 15309 1 19 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.660 2.953 18387 15310 1 19 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.201 0.168 18387 15311 1 19 . 1 1 71 71 ASP H H 71 8.931 8.931 7.350 1.581 18387 15312 1 19 . 1 1 72 72 ARG N N 72 118.814 118.814 119.076 -0.262 18387 15313 1 19 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.026 0.169 18387 15314 1 19 . 1 1 72 72 ARG C C 72 177.300 177.300 177.023 0.277 18387 15315 1 19 . 1 1 72 72 ARG CA C 72 56.809 56.809 58.790 -1.981 18387 15316 1 19 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.509 0.602 18387 15317 1 19 . 1 1 72 72 ARG H H 72 8.057 8.057 8.589 -0.532 18387 15318 1 19 . 1 1 73 73 ARG N N 73 118.174 118.174 115.720 2.454 18387 15319 1 19 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.526 0.228 18387 15320 1 19 . 1 1 73 73 ARG C C 73 176.503 176.503 176.154 0.349 18387 15321 1 19 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.532 0.004 18387 15322 1 19 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.981 -1.953 18387 15323 1 19 . 1 1 73 73 ARG H H 73 8.639 8.639 7.635 1.004 18387 15324 1 19 . 1 1 74 74 GLU N N 74 127.609 127.609 122.719 4.890 18387 15325 1 19 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.222 -0.143 18387 15326 1 19 . 1 1 74 74 GLU C C 74 178.107 178.107 177.942 0.165 18387 15327 1 19 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.193 -0.408 18387 15328 1 19 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.726 0.372 18387 15329 1 19 . 1 1 74 74 GLU H H 74 9.129 9.129 8.891 0.238 18387 15330 1 19 . 1 1 75 75 GLU N N 75 117.874 117.874 119.503 -1.629 18387 15331 1 19 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.113 -0.013 18387 15332 1 19 . 1 1 75 75 GLU C C 75 178.993 178.993 178.727 0.266 18387 15333 1 19 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.994 0.133 18387 15334 1 19 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.976 0.315 18387 15335 1 19 . 1 1 75 75 GLU H H 75 9.745 9.745 8.869 0.876 18387 15336 1 19 . 1 1 76 76 ASP N N 76 119.182 119.182 118.815 0.367 18387 15337 1 19 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.520 -0.154 18387 15338 1 19 . 1 1 76 76 ASP C C 76 178.107 178.107 177.940 0.167 18387 15339 1 19 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.695 -0.722 18387 15340 1 19 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.588 -0.068 18387 15341 1 19 . 1 1 76 76 ASP H H 76 7.004 7.004 8.631 -1.627 18387 15342 1 19 . 1 1 77 77 TRP N N 77 123.008 123.008 123.618 -0.610 18387 15343 1 19 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.206 -0.057 18387 15344 1 19 . 1 1 77 77 TRP C C 77 176.236 176.236 177.628 -1.392 18387 15345 1 19 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.988 -0.505 18387 15346 1 19 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.137 -0.602 18387 15347 1 19 . 1 1 77 77 TRP H H 77 7.112 7.112 8.128 -1.016 18387 15348 1 19 . 1 1 78 78 LYS N N 78 115.727 115.727 118.467 -2.740 18387 15349 1 19 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.444 -0.199 18387 15350 1 19 . 1 1 78 78 LYS C C 78 179.426 179.426 178.808 0.618 18387 15351 1 19 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.260 1.172 18387 15352 1 19 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.746 0.999 18387 15353 1 19 . 1 1 78 78 LYS H H 78 8.431 8.431 8.432 -0.001 18387 15354 1 19 . 1 1 79 79 LYS N N 79 118.321 118.321 119.885 -1.564 18387 15355 1 19 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.979 0.041 18387 15356 1 19 . 1 1 79 79 LYS C C 79 178.239 178.239 178.490 -0.251 18387 15357 1 19 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.407 -0.340 18387 15358 1 19 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.461 0.002 18387 15359 1 19 . 1 1 79 79 LYS H H 79 7.690 7.690 7.758 -0.068 18387 15360 1 19 . 1 1 80 80 ALA N N 80 120.679 120.679 121.787 -1.108 18387 15361 1 19 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.301 -0.146 18387 15362 1 19 . 1 1 80 80 ALA C C 80 178.811 178.811 179.752 -0.941 18387 15363 1 19 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.163 -0.076 18387 15364 1 19 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.538 0.220 18387 15365 1 19 . 1 1 80 80 ALA H H 80 7.560 7.560 8.096 -0.536 18387 15366 1 19 . 1 1 81 81 ILE N N 81 118.019 118.019 118.933 -0.914 18387 15367 1 19 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.644 -0.242 18387 15368 1 19 . 1 1 81 81 ILE C C 81 178.113 178.113 178.308 -0.195 18387 15369 1 19 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.321 0.199 18387 15370 1 19 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.654 0.550 18387 15371 1 19 . 1 1 81 81 ILE H H 81 7.514 7.514 7.907 -0.393 18387 15372 1 19 . 1 1 82 82 GLU N N 82 117.252 117.252 120.655 -3.403 18387 15373 1 19 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.872 0.222 18387 15374 1 19 . 1 1 82 82 GLU C C 82 179.558 179.558 178.558 1.000 18387 15375 1 19 . 1 1 82 82 GLU CA C 82 58.580 58.580 59.153 -0.573 18387 15376 1 19 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.035 0.347 18387 15377 1 19 . 1 1 82 82 GLU H H 82 7.401 7.401 8.017 -0.616 18387 15378 1 19 . 1 1 83 83 GLU N N 83 119.340 119.340 118.820 0.520 18387 15379 1 19 . 1 1 83 83 GLU HA H 83 3.898 3.898 3.994 -0.096 18387 15380 1 19 . 1 1 83 83 GLU C C 83 178.740 178.740 179.302 -0.562 18387 15381 1 19 . 1 1 83 83 GLU CA C 83 58.999 58.999 59.018 -0.019 18387 15382 1 19 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.695 0.225 18387 15383 1 19 . 1 1 83 83 GLU H H 83 8.191 8.191 8.150 0.041 18387 15384 1 19 . 1 1 84 84 ASP N N 84 118.449 118.449 116.264 2.185 18387 15385 1 19 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.471 -0.197 18387 15386 1 19 . 1 1 84 84 ASP C C 84 175.597 175.597 176.219 -0.622 18387 15387 1 19 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.930 0.117 18387 15388 1 19 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.112 -1.216 18387 15389 1 19 . 1 1 84 84 ASP H H 84 8.252 8.252 8.109 0.143 18387 15390 1 19 . 1 1 85 85 LYS N N 85 116.410 116.410 115.589 0.821 18387 15391 1 19 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.409 -0.236 18387 15392 1 19 . 1 1 85 85 LYS C C 85 176.856 176.856 175.087 1.769 18387 15393 1 19 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.541 -0.568 18387 15394 1 19 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.040 -0.172 18387 15395 1 19 . 1 1 85 85 LYS H H 85 7.890 7.890 7.923 -0.033 18387 15396 1 19 . 1 1 86 86 SER N N 86 112.295 112.295 114.012 -1.717 18387 15397 1 19 . 1 1 86 86 SER HA H 86 3.139 3.139 3.933 -0.794 18387 15398 1 19 . 1 1 86 86 SER C C 86 175.805 175.805 173.133 2.672 18387 15399 1 19 . 1 1 86 86 SER CA C 86 53.637 53.637 57.228 -3.591 18387 15400 1 19 . 1 1 86 86 SER CB C 86 60.736 60.736 61.598 -0.862 18387 15401 1 19 . 1 1 86 86 SER H H 86 7.327 7.327 7.265 0.062 18387 15402 1 19 . 1 1 87 87 TYR N N 87 120.962 120.962 126.424 -5.462 18387 15403 1 19 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.259 0.046 18387 15404 1 19 . 1 1 87 87 TYR C C 87 177.064 177.064 174.477 2.587 18387 15405 1 19 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.520 -0.297 18387 15406 1 19 . 1 1 87 87 TYR CB C 87 36.353 36.353 37.042 -0.689 18387 15407 1 19 . 1 1 87 87 TYR H H 87 6.933 6.933 7.714 -0.781 18387 15408 1 19 . 1 1 88 88 TRP N N 88 118.597 118.597 120.774 -2.177 18387 15409 1 19 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.658 0.193 18387 15410 1 19 . 1 1 88 88 TRP C C 88 175.456 175.456 174.300 1.156 18387 15411 1 19 . 1 1 88 88 TRP CA C 88 56.236 56.236 55.080 1.156 18387 15412 1 19 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.074 -3.347 18387 15413 1 19 . 1 1 88 88 TRP H H 88 6.552 6.552 7.115 -0.563 18387 15414 1 19 . 1 1 89 89 ASN N N 89 118.067 118.067 120.887 -2.820 18387 15415 1 19 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.717 0.332 18387 15416 1 19 . 1 1 89 89 ASN C C 89 173.773 173.773 174.813 -1.040 18387 15417 1 19 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.130 1.325 18387 15418 1 19 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.316 0.881 18387 15419 1 19 . 1 1 89 89 ASN H H 89 7.864 7.864 8.797 -0.933 18387 15420 1 19 . 1 1 90 90 GLN N N 90 125.392 125.392 122.235 3.157 18387 15421 1 19 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.100 0.397 18387 15422 1 19 . 1 1 90 90 GLN C C 90 176.491 176.491 175.562 0.929 18387 15423 1 19 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.867 0.593 18387 15424 1 19 . 1 1 90 90 GLN CB C 90 31.227 31.227 31.018 0.209 18387 15425 1 19 . 1 1 90 90 GLN H H 90 7.904 7.904 8.133 -0.229 18387 15426 1 19 . 1 1 91 91 VAL N N 91 114.434 114.434 116.809 -2.375 18387 15427 1 19 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.973 0.507 18387 15428 1 19 . 1 1 91 91 VAL C C 91 174.248 174.248 173.072 1.176 18387 15429 1 19 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.387 -0.381 18387 15430 1 19 . 1 1 91 91 VAL CB C 91 36.638 36.638 34.930 1.708 18387 15431 1 19 . 1 1 91 91 VAL H H 91 9.585 9.585 9.185 0.400 18387 15432 1 19 . 1 1 92 92 LEU N N 92 126.910 126.910 125.812 1.098 18387 15433 1 19 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.320 -0.251 18387 15434 1 19 . 1 1 92 92 LEU C C 92 177.696 177.696 175.358 2.338 18387 15435 1 19 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.260 0.584 18387 15436 1 19 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.185 -0.238 18387 15437 1 19 . 1 1 92 92 LEU H H 92 8.941 8.941 8.334 0.607 18387 15438 1 19 . 1 1 93 93 LEU N N 93 125.673 125.673 127.512 -1.839 18387 15439 1 19 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.320 0.080 18387 15440 1 19 . 1 1 93 93 LEU C C 93 177.291 177.291 176.827 0.464 18387 15441 1 19 . 1 1 93 93 LEU CA C 93 54.951 54.951 54.914 0.037 18387 15442 1 19 . 1 1 93 93 LEU CB C 93 43.179 43.179 42.094 1.085 18387 15443 1 19 . 1 1 93 93 LEU H H 93 8.038 8.038 8.494 -0.456 18387 15444 1 19 . 1 1 94 94 GLN N N 94 122.206 122.206 121.788 0.418 18387 15445 1 19 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.164 0.073 18387 15446 1 19 . 1 1 94 94 GLN C C 94 178.246 178.246 176.576 1.670 18387 15447 1 19 . 1 1 94 94 GLN CA C 94 55.775 55.775 56.115 -0.340 18387 15448 1 19 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.511 -0.256 18387 15449 1 19 . 1 1 94 94 GLN H H 94 9.298 9.298 8.415 0.883 18387 15450 1 19 . 1 1 95 95 LYS N N 95 122.668 122.668 122.104 0.564 18387 15451 1 19 . 1 1 95 95 LYS HA H 95 3.966 3.966 4.039 -0.073 18387 15452 1 19 . 1 1 95 95 LYS C C 95 178.787 178.787 177.048 1.739 18387 15453 1 19 . 1 1 95 95 LYS CA C 95 60.072 60.072 58.413 1.659 18387 15454 1 19 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.858 0.607 18387 15455 1 19 . 1 1 95 95 LYS H H 95 8.645 8.645 8.795 -0.150 18387 15456 1 19 . 1 1 96 96 ASP N N 96 116.775 116.775 117.118 -0.343 18387 15457 1 19 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.568 0.012 18387 15458 1 19 . 1 1 96 96 ASP C C 96 176.220 176.220 177.413 -1.193 18387 15459 1 19 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.531 -0.185 18387 15460 1 19 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.429 0.128 18387 15461 1 19 . 1 1 96 96 ASP H H 96 8.606 8.606 8.239 0.367 18387 15462 1 19 . 1 1 97 97 ASP N N 97 118.213 118.213 120.663 -2.450 18387 15463 1 19 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.452 0.475 18387 15464 1 19 . 1 1 97 97 ASP C C 97 176.954 176.954 178.340 -1.386 18387 15465 1 19 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.815 -1.456 18387 15466 1 19 . 1 1 97 97 ASP CB C 97 42.324 42.324 41.035 1.289 18387 15467 1 19 . 1 1 97 97 ASP H H 97 7.988 7.988 7.401 0.587 18387 15468 1 19 . 1 1 98 98 VAL N N 98 118.907 118.907 119.223 -0.316 18387 15469 1 19 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.619 -0.203 18387 15470 1 19 . 1 1 98 98 VAL C C 98 176.470 176.470 177.833 -1.363 18387 15471 1 19 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.274 1.504 18387 15472 1 19 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.161 1.230 18387 15473 1 19 . 1 1 98 98 VAL H H 98 7.098 7.098 8.152 -1.054 18387 15474 1 19 . 1 1 99 99 LYS N N 99 117.909 117.909 119.916 -2.007 18387 15475 1 19 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.920 0.023 18387 15476 1 19 . 1 1 99 99 LYS C C 99 178.762 178.762 178.587 0.175 18387 15477 1 19 . 1 1 99 99 LYS CA C 99 60.145 60.145 60.036 0.109 18387 15478 1 19 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.946 0.066 18387 15479 1 19 . 1 1 99 99 LYS H H 99 8.304 8.304 7.531 0.773 18387 15480 1 19 . 1 1 100 100 ASP N N 100 117.843 117.843 119.189 -1.346 18387 15481 1 19 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.471 0.007 18387 15482 1 19 . 1 1 100 100 ASP C C 100 179.694 179.694 178.625 1.069 18387 15483 1 19 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.353 0.173 18387 15484 1 19 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.335 0.493 18387 15485 1 19 . 1 1 100 100 ASP H H 100 8.024 8.024 7.753 0.271 18387 15486 1 19 . 1 1 101 101 VAL N N 101 122.202 122.202 120.426 1.776 18387 15487 1 19 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.830 0.165 18387 15488 1 19 . 1 1 101 101 VAL C C 101 178.533 178.533 178.025 0.508 18387 15489 1 19 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.532 0.470 18387 15490 1 19 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.488 0.549 18387 15491 1 19 . 1 1 101 101 VAL H H 101 8.205 8.205 7.625 0.580 18387 15492 1 19 . 1 1 102 102 LEU N N 102 118.798 118.798 120.082 -1.284 18387 15493 1 19 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.670 0.110 18387 15494 1 19 . 1 1 102 102 LEU C C 102 180.254 180.254 179.275 0.979 18387 15495 1 19 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.348 0.593 18387 15496 1 19 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.311 -0.872 18387 15497 1 19 . 1 1 102 102 LEU H H 102 8.422 8.422 8.087 0.335 18387 15498 1 19 . 1 1 103 103 GLU N N 103 116.915 116.915 119.033 -2.118 18387 15499 1 19 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.031 0.104 18387 15500 1 19 . 1 1 103 103 GLU C C 103 180.910 180.910 179.686 1.224 18387 15501 1 19 . 1 1 103 103 GLU CA C 103 59.403 59.403 58.848 0.555 18387 15502 1 19 . 1 1 103 103 GLU CB C 103 29.731 29.731 28.993 0.738 18387 15503 1 19 . 1 1 103 103 GLU H H 103 8.262 8.262 7.757 0.505 18387 15504 1 19 . 1 1 104 104 SER N N 104 117.866 117.866 116.172 1.694 18387 15505 1 19 . 1 1 104 104 SER HA H 104 4.216 4.216 4.161 0.055 18387 15506 1 19 . 1 1 104 104 SER C C 104 175.455 175.455 176.775 -1.320 18387 15507 1 19 . 1 1 104 104 SER CA C 104 62.019 62.019 60.830 1.189 18387 15508 1 19 . 1 1 104 104 SER CB C 104 62.891 62.891 62.920 -0.029 18387 15509 1 19 . 1 1 104 104 SER H H 104 8.544 8.544 8.253 0.291 18387 15510 1 19 . 1 1 105 105 TYR N N 105 117.278 117.278 119.802 -2.524 18387 15511 1 19 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.434 -0.162 18387 15512 1 19 . 1 1 105 105 TYR C C 105 174.750 174.750 174.933 -0.183 18387 15513 1 19 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.725 1.134 18387 15514 1 19 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.496 2.215 18387 15515 1 19 . 1 1 105 105 TYR H H 105 7.691 7.691 7.790 -0.099 18387 15516 1 19 . 1 1 106 106 CYS N N 106 116.897 116.897 115.089 1.808 18387 15517 1 19 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.143 -0.248 18387 15518 1 19 . 1 1 106 106 CYS C C 106 174.056 174.056 173.471 0.585 18387 15519 1 19 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.156 -0.545 18387 15520 1 19 . 1 1 106 106 CYS CB C 106 25.032 25.032 24.648 0.383 18387 15521 1 19 . 1 1 106 106 CYS H H 106 7.862 7.862 8.423 -0.561 18387 15522 1 19 . 1 1 107 107 ILE N N 107 118.885 118.885 121.062 -2.177 18387 15523 1 19 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.803 -0.464 18387 15524 1 19 . 1 1 107 107 ILE C C 107 176.793 176.793 175.177 1.616 18387 15525 1 19 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.321 2.424 18387 15526 1 19 . 1 1 107 107 ILE CB C 107 38.079 38.079 38.348 -0.269 18387 15527 1 19 . 1 1 107 107 ILE H H 107 7.707 7.707 7.701 0.006 18387 15528 1 19 . 1 1 108 108 VAL N N 108 123.983 123.983 120.763 3.220 18387 15529 1 19 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.389 -0.115 18387 15530 1 19 . 1 1 108 108 VAL C C 108 175.476 175.476 175.403 0.073 18387 15531 1 19 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.221 0.403 18387 15532 1 19 . 1 1 108 108 VAL CB C 108 33.008 33.008 31.799 1.208 18387 15533 1 19 . 1 1 108 108 VAL H H 108 8.656 8.656 8.502 0.154 18387 15534 1 19 . 1 1 109 109 GLY N N 109 110.120 110.120 108.413 1.707 18387 15535 1 19 . 1 1 109 109 GLY C C 109 169.982 169.982 172.444 -2.462 18387 15536 1 19 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.250 -0.647 18387 15537 1 19 . 1 1 109 109 GLY H H 109 7.500 7.500 7.451 0.049 18387 15538 1 19 . 1 1 110 110 PHE N N 110 115.276 115.276 119.296 -4.020 18387 15539 1 19 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.126 -0.352 18387 15540 1 19 . 1 1 110 110 PHE C C 110 174.361 174.361 173.997 0.364 18387 15541 1 19 . 1 1 110 110 PHE CA C 110 55.687 55.687 56.212 -0.525 18387 15542 1 19 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.219 0.732 18387 15543 1 19 . 1 1 110 110 PHE H H 110 8.203 8.203 8.404 -0.201 18387 15544 1 19 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.058 0.301 18387 15545 1 19 . 1 1 111 111 PRO C C 111 175.691 175.691 175.459 0.232 18387 15546 1 19 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.600 0.557 18387 15547 1 19 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.610 1.694 18387 15548 1 19 . 1 1 112 112 HIS N N 112 123.708 123.708 117.989 5.719 18387 15549 1 19 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.932 0.031 18387 15550 1 19 . 1 1 112 112 HIS C C 112 173.649 173.649 173.623 0.026 18387 15551 1 19 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.092 0.982 18387 15552 1 19 . 1 1 112 112 HIS CB C 112 32.197 32.197 33.423 -1.226 18387 15553 1 19 . 1 1 112 112 HIS H H 112 8.952 8.952 8.526 0.426 18387 15554 1 19 . 1 1 113 113 ILE N N 113 128.596 128.596 125.492 3.104 18387 15555 1 19 . 1 1 113 113 ILE HA H 113 5.697 5.697 4.832 0.865 18387 15556 1 19 . 1 1 113 113 ILE C C 113 176.130 176.130 174.969 1.161 18387 15557 1 19 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.659 0.336 18387 15558 1 19 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.123 -1.068 18387 15559 1 19 . 1 1 113 113 ILE H H 113 8.808 8.808 8.795 0.013 18387 15560 1 19 . 1 1 114 114 ILE N N 114 119.668 119.668 122.875 -3.207 18387 15561 1 19 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.914 0.059 18387 15562 1 19 . 1 1 114 114 ILE C C 114 173.186 173.186 173.647 -0.461 18387 15563 1 19 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.895 -0.165 18387 15564 1 19 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.194 0.346 18387 15565 1 19 . 1 1 114 114 ILE H H 114 8.721 8.721 8.956 -0.234 18387 15566 1 19 . 1 1 115 115 LEU N N 115 122.770 122.770 124.862 -2.092 18387 15567 1 19 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.099 0.176 18387 15568 1 19 . 1 1 115 115 LEU C C 115 173.601 173.601 174.608 -1.007 18387 15569 1 19 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.717 0.065 18387 15570 1 19 . 1 1 115 115 LEU CB C 115 46.134 46.134 45.139 0.995 18387 15571 1 19 . 1 1 115 115 LEU H H 115 8.665 8.665 9.070 -0.405 18387 15572 1 19 . 1 1 116 116 VAL N N 116 130.411 130.411 127.754 2.657 18387 15573 1 19 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.219 -0.361 18387 15574 1 19 . 1 1 116 116 VAL C C 116 174.565 174.565 175.616 -1.051 18387 15575 1 19 . 1 1 116 116 VAL CA C 116 60.804 60.804 59.639 1.165 18387 15576 1 19 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.490 -0.575 18387 15577 1 19 . 1 1 116 116 VAL H H 116 9.472 9.472 9.384 0.088 18387 15578 1 19 . 1 1 117 117 ASP N N 117 127.896 127.896 128.291 -0.395 18387 15579 1 19 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.016 0.376 18387 15580 1 19 . 1 1 117 117 ASP C C 117 176.567 176.567 175.711 0.856 18387 15581 1 19 . 1 1 117 117 ASP CA C 117 52.600 52.600 53.654 -1.054 18387 15582 1 19 . 1 1 117 117 ASP CB C 117 40.584 40.584 39.859 0.725 18387 15583 1 19 . 1 1 117 117 ASP H H 117 9.429 9.429 8.612 0.817 18387 15584 1 19 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.312 -0.118 18387 15585 1 19 . 1 1 118 118 PRO C C 118 177.534 177.534 176.903 0.631 18387 15586 1 19 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.989 0.176 18387 15587 1 19 . 1 1 118 118 PRO CB C 118 32.813 32.813 32.058 0.755 18387 15588 1 19 . 1 1 119 119 GLU N N 119 114.015 114.015 114.235 -0.220 18387 15589 1 19 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.073 0.266 18387 15590 1 19 . 1 1 119 119 GLU C C 119 176.722 176.722 176.634 0.088 18387 15591 1 19 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.493 -1.854 18387 15592 1 19 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.765 0.812 18387 15593 1 19 . 1 1 119 119 GLU H H 119 7.733 7.733 8.260 -0.527 18387 15594 1 19 . 1 1 120 120 GLY N N 120 108.218 108.218 106.116 2.102 18387 15595 1 19 . 1 1 120 120 GLY C C 120 174.110 174.110 172.748 1.362 18387 15596 1 19 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.711 0.685 18387 15597 1 19 . 1 1 120 120 GLY H H 120 8.588 8.588 7.910 0.678 18387 15598 1 19 . 1 1 121 121 LYS N N 121 121.778 121.778 119.475 2.303 18387 15599 1 19 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.078 -0.219 18387 15600 1 19 . 1 1 121 121 LYS C C 121 176.458 176.458 175.416 1.042 18387 15601 1 19 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.516 0.446 18387 15602 1 19 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.874 -2.422 18387 15603 1 19 . 1 1 121 121 LYS H H 121 8.600 8.600 7.575 1.025 18387 15604 1 19 . 1 1 122 122 ILE N N 122 122.058 122.058 123.978 -1.920 18387 15605 1 19 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.526 -0.254 18387 15606 1 19 . 1 1 122 122 ILE C C 122 177.084 177.084 176.413 0.671 18387 15607 1 19 . 1 1 122 122 ILE CA C 122 62.819 62.819 61.869 0.950 18387 15608 1 19 . 1 1 122 122 ILE CB C 122 38.648 38.648 37.166 1.482 18387 15609 1 19 . 1 1 122 122 ILE H H 122 9.006 9.006 9.101 -0.095 18387 15610 1 19 . 1 1 123 123 VAL N N 123 120.561 120.561 128.302 -7.741 18387 15611 1 19 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.181 0.574 18387 15612 1 19 . 1 1 123 123 VAL C C 123 175.584 175.584 174.737 0.847 18387 15613 1 19 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.865 -1.714 18387 15614 1 19 . 1 1 123 123 VAL CB C 123 33.401 33.401 33.140 0.261 18387 15615 1 19 . 1 1 123 123 VAL H H 123 9.054 9.054 8.344 0.710 18387 15616 1 19 . 1 1 124 124 ALA N N 124 121.102 121.102 120.605 0.497 18387 15617 1 19 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.980 -0.323 18387 15618 1 19 . 1 1 124 124 ALA C C 124 174.832 174.832 174.614 0.218 18387 15619 1 19 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.461 0.999 18387 15620 1 19 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.470 1.360 18387 15621 1 19 . 1 1 124 124 ALA H H 124 7.793 7.793 7.510 0.283 18387 15622 1 19 . 1 1 125 125 LYS N N 125 117.637 117.637 118.554 -0.917 18387 15623 1 19 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.979 0.054 18387 15624 1 19 . 1 1 125 125 LYS C C 125 173.417 173.417 175.669 -2.252 18387 15625 1 19 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.514 -0.373 18387 15626 1 19 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.226 1.425 18387 15627 1 19 . 1 1 125 125 LYS H H 125 8.872 8.872 8.306 0.566 18387 15628 1 19 . 1 1 126 126 GLU N N 126 115.236 115.236 114.979 0.257 18387 15629 1 19 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.999 -0.001 18387 15630 1 19 . 1 1 126 126 GLU C C 126 175.998 175.998 175.918 0.080 18387 15631 1 19 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.688 -0.726 18387 15632 1 19 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.040 -0.605 18387 15633 1 19 . 1 1 126 126 GLU H H 126 7.941 7.941 8.453 -0.512 18387 15634 1 19 . 1 1 127 127 LEU N N 127 118.584 118.584 118.588 -0.004 18387 15635 1 19 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.321 0.061 18387 15636 1 19 . 1 1 127 127 LEU C C 127 176.766 176.766 176.552 0.214 18387 15637 1 19 . 1 1 127 127 LEU CA C 127 54.609 54.609 54.594 0.015 18387 15638 1 19 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.918 1.045 18387 15639 1 19 . 1 1 127 127 LEU H H 127 7.300 7.300 7.764 -0.464 18387 15640 1 19 . 1 1 128 128 ARG N N 128 118.625 118.625 119.347 -0.722 18387 15641 1 19 . 1 1 128 128 ARG HA H 128 4.475 4.475 5.017 -0.542 18387 15642 1 19 . 1 1 128 128 ARG C C 128 177.113 177.113 178.210 -1.097 18387 15643 1 19 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.175 -0.785 18387 15644 1 19 . 1 1 128 128 ARG CB C 128 34.612 34.612 31.801 2.811 18387 15645 1 19 . 1 1 128 128 ARG H H 128 7.929 7.929 7.992 -0.063 18387 15646 1 19 . 1 1 129 129 GLY N N 129 114.010 114.010 109.618 4.392 18387 15647 1 19 . 1 1 129 129 GLY C C 129 175.931 175.931 175.182 0.749 18387 15648 1 19 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.448 -1.987 18387 15649 1 19 . 1 1 129 129 GLY H H 129 10.649 10.649 9.017 1.632 18387 15650 1 19 . 1 1 130 130 ASP N N 130 123.975 123.975 119.542 4.433 18387 15651 1 19 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.750 0.782 18387 15652 1 19 . 1 1 130 130 ASP C C 130 177.507 177.507 177.793 -0.286 18387 15653 1 19 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.965 -0.593 18387 15654 1 19 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.282 0.621 18387 15655 1 19 . 1 1 130 130 ASP H H 130 8.540 8.540 8.180 0.360 18387 15656 1 19 . 1 1 131 131 ASP N N 131 116.806 116.806 119.114 -2.308 18387 15657 1 19 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.435 0.135 18387 15658 1 19 . 1 1 131 131 ASP C C 131 179.038 179.038 178.132 0.906 18387 15659 1 19 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.801 0.182 18387 15660 1 19 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.654 0.280 18387 15661 1 19 . 1 1 131 131 ASP H H 131 7.907 7.907 8.036 -0.129 18387 15662 1 19 . 1 1 132 132 LEU N N 132 123.869 123.869 118.674 5.195 18387 15663 1 19 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.040 -0.249 18387 15664 1 19 . 1 1 132 132 LEU C C 132 176.343 176.343 178.462 -2.119 18387 15665 1 19 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.512 1.272 18387 15666 1 19 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.733 1.035 18387 15667 1 19 . 1 1 132 132 LEU H H 132 7.542 7.542 8.616 -1.074 18387 15668 1 19 . 1 1 133 133 TYR N N 133 120.042 120.042 120.986 -0.944 18387 15669 1 19 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.007 -0.011 18387 15670 1 19 . 1 1 133 133 TYR C C 133 177.426 177.426 177.286 0.140 18387 15671 1 19 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.165 -0.032 18387 15672 1 19 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.971 -0.395 18387 15673 1 19 . 1 1 133 133 TYR H H 133 7.384 7.384 7.723 -0.339 18387 15674 1 19 . 1 1 134 134 ASN N N 134 114.936 114.936 115.910 -0.974 18387 15675 1 19 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.507 -0.104 18387 15676 1 19 . 1 1 134 134 ASN C C 134 178.703 178.703 178.017 0.686 18387 15677 1 19 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.050 -0.242 18387 15678 1 19 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.169 0.039 18387 15679 1 19 . 1 1 134 134 ASN H H 134 8.399 8.399 8.079 0.320 18387 15680 1 19 . 1 1 135 135 THR N N 135 117.387 117.387 116.493 0.894 18387 15681 1 19 . 1 1 135 135 THR HA H 135 3.920 3.920 3.963 -0.043 18387 15682 1 19 . 1 1 135 135 THR C C 135 175.323 175.323 176.028 -0.705 18387 15683 1 19 . 1 1 135 135 THR CA C 135 67.402 67.402 66.211 1.191 18387 15684 1 19 . 1 1 135 135 THR CB C 135 68.111 68.111 68.849 -0.738 18387 15685 1 19 . 1 1 135 135 THR H H 135 8.265 8.265 8.294 -0.029 18387 15686 1 19 . 1 1 136 136 VAL N N 136 121.207 121.207 122.386 -1.179 18387 15687 1 19 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.730 -0.715 18387 15688 1 19 . 1 1 136 136 VAL C C 136 176.457 176.457 176.558 -0.101 18387 15689 1 19 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.176 2.096 18387 15690 1 19 . 1 1 136 136 VAL CB C 136 30.941 30.941 31.376 -0.435 18387 15691 1 19 . 1 1 136 136 VAL H H 136 7.595 7.595 8.001 -0.406 18387 15692 1 19 . 1 1 137 137 GLU N N 137 118.266 118.266 120.060 -1.794 18387 15693 1 19 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.169 -1.487 18387 15694 1 19 . 1 1 137 137 GLU C C 137 177.482 177.482 178.080 -0.598 18387 15695 1 19 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.670 0.260 18387 15696 1 19 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.142 0.640 18387 15697 1 19 . 1 1 137 137 GLU H H 137 8.114 8.114 8.480 -0.366 18387 15698 1 19 . 1 1 138 138 LYS N N 138 116.431 116.431 119.434 -3.003 18387 15699 1 19 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.884 -0.116 18387 15700 1 19 . 1 1 138 138 LYS C C 138 179.193 179.193 179.041 0.152 18387 15701 1 19 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.305 -0.265 18387 15702 1 19 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.008 0.150 18387 15703 1 19 . 1 1 138 138 LYS H H 138 7.133 7.133 7.370 -0.237 18387 15704 1 19 . 1 1 139 139 PHE N N 139 116.336 116.336 116.686 -0.350 18387 15705 1 19 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.346 -0.336 18387 15706 1 19 . 1 1 139 139 PHE C C 139 177.855 177.855 178.093 -0.238 18387 15707 1 19 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.533 1.851 18387 15708 1 19 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.310 0.042 18387 15709 1 19 . 1 1 139 139 PHE H H 139 7.338 7.338 7.349 -0.011 18387 15710 1 19 . 1 1 140 140 VAL N N 140 116.491 116.491 117.597 -1.106 18387 15711 1 19 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.612 -0.088 18387 15712 1 19 . 1 1 140 140 VAL C C 140 177.747 177.747 176.430 1.317 18387 15713 1 19 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.637 0.605 18387 15714 1 19 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.965 -0.575 18387 15715 1 19 . 1 1 140 140 VAL H H 140 8.332 8.332 8.412 -0.080 18387 15716 1 19 . 1 1 141 141 ASN N N 141 116.956 116.956 115.562 1.394 18387 15717 1 19 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.704 0.122 18387 15718 1 19 . 1 1 141 141 ASN C C 141 176.997 176.997 175.367 1.630 18387 15719 1 19 . 1 1 141 141 ASN CA C 141 53.677 53.677 53.751 -0.074 18387 15720 1 19 . 1 1 141 141 ASN CB C 141 38.448 38.448 41.080 -2.632 18387 15721 1 19 . 1 1 141 141 ASN H H 141 7.862 7.862 7.900 -0.038 18387 15722 1 19 . 1 1 142 142 GLY N N 142 107.938 107.938 108.819 -0.881 18387 15723 1 19 . 1 1 142 142 GLY C C 142 174.336 174.336 173.063 1.273 18387 15724 1 19 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.076 0.909 18387 15725 1 19 . 1 1 142 142 GLY H H 142 7.466 7.466 8.044 -0.578 18387 15726 1 19 . 1 1 143 143 ALA N N 143 123.441 123.441 122.890 0.551 18387 15727 1 19 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.416 -0.075 18387 15728 1 19 . 1 1 143 143 ALA C C 143 178.212 178.212 177.236 0.976 18387 15729 1 19 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.104 0.722 18387 15730 1 19 . 1 1 143 143 ALA CB C 143 19.244 19.244 19.556 -0.312 18387 15731 1 19 . 1 1 143 143 ALA H H 143 7.950 7.950 8.234 -0.284 18387 15732 1 19 . 1 1 144 144 LYS N N 144 120.149 120.149 121.697 -1.548 18387 15733 1 19 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.570 -0.275 18387 15734 1 19 . 1 1 144 144 LYS C C 144 176.945 176.945 176.106 0.839 18387 15735 1 19 . 1 1 144 144 LYS CA C 144 56.519 56.519 55.226 1.293 18387 15736 1 19 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.954 0.076 18387 15737 1 19 . 1 1 144 144 LYS H H 144 8.187 8.187 8.227 -0.040 18387 15738 1 19 . 1 1 145 145 GLU N N 145 120.992 120.992 122.313 -1.321 18387 15739 1 19 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.370 -0.075 18387 15740 1 19 . 1 1 145 145 GLU C C 145 177.116 177.116 175.817 1.299 18387 15741 1 19 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.884 1.019 18387 15742 1 19 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.959 -0.717 18387 15743 1 19 . 1 1 145 145 GLU H H 145 8.363 8.363 8.574 -0.211 18387 15744 1 19 . 1 1 146 146 GLY N N 146 109.467 109.467 112.397 -2.930 18387 15745 1 19 . 1 1 146 146 GLY C C 146 174.108 174.108 173.586 0.522 18387 15746 1 19 . 1 1 146 146 GLY CA C 146 45.401 45.401 45.135 0.266 18387 15747 1 19 . 1 1 146 146 GLY H H 146 8.371 8.371 8.013 0.358 18387 15748 1 19 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.123 0.486 18387 15749 1 19 . 1 1 151 151 HIS C C 151 174.258 174.258 173.490 0.768 18387 15750 1 19 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.847 -0.682 18387 15751 1 19 . 1 1 151 151 HIS CB C 151 30.833 30.833 29.256 1.577 18387 15752 1 20 . 1 1 2 2 SER HA H 2 3.992 3.992 5.019 -1.027 18387 15753 1 20 . 1 1 2 2 SER CA C 2 57.555 57.555 57.236 0.319 18387 15754 1 20 . 1 1 2 2 SER CB C 2 64.977 64.977 65.919 -0.942 18387 15755 1 20 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.246 0.193 18387 15756 1 20 . 1 1 3 3 LEU C C 3 176.631 176.631 177.338 -0.707 18387 15757 1 20 . 1 1 3 3 LEU CA C 3 54.564 54.564 55.436 -0.872 18387 15758 1 20 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.438 0.286 18387 15759 1 20 . 1 1 4 4 ALA N N 4 125.483 125.483 122.409 3.074 18387 15760 1 20 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.332 0.047 18387 15761 1 20 . 1 1 4 4 ALA C C 4 179.642 179.642 176.472 3.170 18387 15762 1 20 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.919 -0.184 18387 15763 1 20 . 1 1 4 4 ALA CB C 4 19.752 19.752 19.570 0.182 18387 15764 1 20 . 1 1 4 4 ALA H H 4 8.483 8.483 8.285 0.198 18387 15765 1 20 . 1 1 5 5 THR HA H 5 3.845 3.845 4.829 -0.984 18387 15766 1 20 . 1 1 5 5 THR C C 5 175.487 175.487 175.540 -0.053 18387 15767 1 20 . 1 1 5 5 THR CA C 5 64.531 64.531 60.755 3.776 18387 15768 1 20 . 1 1 5 5 THR CB C 5 68.108 68.108 69.710 -1.602 18387 15769 1 20 . 1 1 6 6 GLY N N 6 114.298 114.298 114.771 -0.473 18387 15770 1 20 . 1 1 6 6 GLY C C 6 174.324 174.324 174.287 0.037 18387 15771 1 20 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.135 -0.300 18387 15772 1 20 . 1 1 6 6 GLY H H 6 9.511 9.511 8.959 0.552 18387 15773 1 20 . 1 1 7 7 SER N N 7 115.270 115.270 116.250 -0.980 18387 15774 1 20 . 1 1 7 7 SER HA H 7 4.500 4.500 4.440 0.060 18387 15775 1 20 . 1 1 7 7 SER C C 7 173.315 173.315 174.683 -1.368 18387 15776 1 20 . 1 1 7 7 SER CA C 7 58.915 58.915 57.848 1.067 18387 15777 1 20 . 1 1 7 7 SER CB C 7 64.308 64.308 64.036 0.272 18387 15778 1 20 . 1 1 7 7 SER H H 7 7.736 7.736 7.711 0.025 18387 15779 1 20 . 1 1 8 8 VAL N N 8 123.708 123.708 125.273 -1.565 18387 15780 1 20 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.193 -0.361 18387 15781 1 20 . 1 1 8 8 VAL C C 8 176.673 176.673 176.753 -0.080 18387 15782 1 20 . 1 1 8 8 VAL CA C 8 63.673 63.673 63.635 0.038 18387 15783 1 20 . 1 1 8 8 VAL CB C 8 32.222 32.222 31.974 0.248 18387 15784 1 20 . 1 1 8 8 VAL H H 8 8.632 8.632 8.437 0.195 18387 15785 1 20 . 1 1 9 9 ALA N N 9 133.040 133.040 132.069 0.971 18387 15786 1 20 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.701 -0.438 18387 15787 1 20 . 1 1 9 9 ALA C C 9 175.404 175.404 175.811 -0.407 18387 15788 1 20 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.952 1.003 18387 15789 1 20 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.511 -0.481 18387 15790 1 20 . 1 1 9 9 ALA H H 9 8.448 8.448 8.518 -0.070 18387 15791 1 20 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.359 -0.028 18387 15792 1 20 . 1 1 10 10 PRO C C 10 175.071 175.071 175.933 -0.862 18387 15793 1 20 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.376 0.265 18387 15794 1 20 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.155 0.169 18387 15795 1 20 . 1 1 11 11 ALA N N 11 124.172 124.172 124.298 -0.126 18387 15796 1 20 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.413 -0.169 18387 15797 1 20 . 1 1 11 11 ALA C C 11 177.688 177.688 177.502 0.186 18387 15798 1 20 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.093 2.528 18387 15799 1 20 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.081 0.246 18387 15800 1 20 . 1 1 11 11 ALA H H 11 8.221 8.221 8.240 -0.019 18387 15801 1 20 . 1 1 12 12 ILE N N 12 117.815 117.815 124.041 -6.226 18387 15802 1 20 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.008 0.320 18387 15803 1 20 . 1 1 12 12 ILE C C 12 175.013 175.013 176.091 -1.078 18387 15804 1 20 . 1 1 12 12 ILE CA C 12 62.166 62.166 62.312 -0.145 18387 15805 1 20 . 1 1 12 12 ILE CB C 12 44.290 44.290 39.007 5.283 18387 15806 1 20 . 1 1 12 12 ILE H H 12 7.693 7.693 8.098 -0.405 18387 15807 1 20 . 1 1 13 13 THR N N 13 121.186 121.186 120.951 0.235 18387 15808 1 20 . 1 1 13 13 THR HA H 13 4.840 4.840 5.361 -0.521 18387 15809 1 20 . 1 1 13 13 THR C C 13 172.625 172.625 174.205 -1.580 18387 15810 1 20 . 1 1 13 13 THR CA C 13 62.297 62.297 60.076 2.221 18387 15811 1 20 . 1 1 13 13 THR CB C 13 71.585 71.585 69.342 2.243 18387 15812 1 20 . 1 1 13 13 THR H H 13 8.363 8.363 8.787 -0.424 18387 15813 1 20 . 1 1 14 14 GLY N N 14 110.785 110.785 113.521 -2.736 18387 15814 1 20 . 1 1 14 14 GLY C C 14 170.040 170.040 172.495 -2.455 18387 15815 1 20 . 1 1 14 14 GLY CA C 14 44.390 44.390 42.804 1.586 18387 15816 1 20 . 1 1 14 14 GLY H H 14 7.993 7.993 8.133 -0.140 18387 15817 1 20 . 1 1 15 15 ILE N N 15 119.088 119.088 121.942 -2.854 18387 15818 1 20 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.638 0.487 18387 15819 1 20 . 1 1 15 15 ILE C C 15 176.359 176.359 176.130 0.229 18387 15820 1 20 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.942 -2.328 18387 15821 1 20 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.544 0.095 18387 15822 1 20 . 1 1 15 15 ILE H H 15 7.973 7.973 8.741 -0.768 18387 15823 1 20 . 1 1 16 16 ASP N N 16 126.633 126.633 127.530 -0.897 18387 15824 1 20 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.076 0.773 18387 15825 1 20 . 1 1 16 16 ASP C C 16 179.190 179.190 177.563 1.627 18387 15826 1 20 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.811 -0.931 18387 15827 1 20 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.501 -0.225 18387 15828 1 20 . 1 1 16 16 ASP H H 16 9.335 9.335 8.939 0.396 18387 15829 1 20 . 1 1 17 17 LEU N N 17 116.648 116.648 118.416 -1.768 18387 15830 1 20 . 1 1 17 17 LEU HA H 17 4.174 4.174 3.991 0.183 18387 15831 1 20 . 1 1 17 17 LEU C C 17 178.432 178.432 179.203 -0.771 18387 15832 1 20 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.635 0.346 18387 15833 1 20 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.613 1.373 18387 15834 1 20 . 1 1 17 17 LEU H H 17 8.071 8.071 8.792 -0.721 18387 15835 1 20 . 1 1 18 18 LYS N N 18 117.401 117.401 117.761 -0.360 18387 15836 1 20 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.185 0.324 18387 15837 1 20 . 1 1 18 18 LYS C C 18 176.793 176.793 177.643 -0.850 18387 15838 1 20 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.758 -2.323 18387 15839 1 20 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.332 -0.269 18387 15840 1 20 . 1 1 18 18 LYS H H 18 8.207 8.207 9.066 -0.859 18387 15841 1 20 . 1 1 19 19 GLY N N 19 108.061 108.061 106.230 1.831 18387 15842 1 20 . 1 1 19 19 GLY C C 19 174.649 174.649 173.654 0.995 18387 15843 1 20 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.631 0.966 18387 15844 1 20 . 1 1 19 19 GLY H H 19 8.099 8.099 8.578 -0.479 18387 15845 1 20 . 1 1 20 20 ASN N N 20 121.012 121.012 120.313 0.699 18387 15846 1 20 . 1 1 20 20 ASN HA H 20 4.905 4.905 5.101 -0.196 18387 15847 1 20 . 1 1 20 20 ASN C C 20 174.827 174.827 174.738 0.089 18387 15848 1 20 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.231 0.236 18387 15849 1 20 . 1 1 20 20 ASN CB C 20 39.676 39.676 41.106 -1.430 18387 15850 1 20 . 1 1 20 20 ASN H H 20 8.945 8.945 9.369 -0.424 18387 15851 1 20 . 1 1 21 21 SER N N 21 117.285 117.285 118.364 -1.079 18387 15852 1 20 . 1 1 21 21 SER HA H 21 5.000 5.000 5.015 -0.015 18387 15853 1 20 . 1 1 21 21 SER C C 21 174.911 174.911 174.957 -0.046 18387 15854 1 20 . 1 1 21 21 SER CA C 21 58.730 58.730 58.077 0.653 18387 15855 1 20 . 1 1 21 21 SER CB C 21 63.162 63.162 62.953 0.209 18387 15856 1 20 . 1 1 21 21 SER H H 21 8.740 8.740 8.603 0.137 18387 15857 1 20 . 1 1 22 22 VAL N N 22 128.665 128.665 120.020 8.645 18387 15858 1 20 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.661 -0.281 18387 15859 1 20 . 1 1 22 22 VAL C C 22 176.276 176.276 175.401 0.875 18387 15860 1 20 . 1 1 22 22 VAL CA C 22 62.953 62.953 60.285 2.668 18387 15861 1 20 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.840 0.742 18387 15862 1 20 . 1 1 22 22 VAL H H 22 9.125 9.125 9.115 0.010 18387 15863 1 20 . 1 1 23 23 SER N N 23 127.457 127.457 116.037 11.420 18387 15864 1 20 . 1 1 23 23 SER HA H 23 5.878 5.878 5.745 0.133 18387 15865 1 20 . 1 1 23 23 SER C C 23 174.436 174.436 176.071 -1.635 18387 15866 1 20 . 1 1 23 23 SER CA C 23 57.101 57.101 55.443 1.658 18387 15867 1 20 . 1 1 23 23 SER CB C 23 66.078 66.078 65.871 0.207 18387 15868 1 20 . 1 1 23 23 SER H H 23 8.971 8.971 9.432 -0.461 18387 15869 1 20 . 1 1 24 24 LEU N N 24 126.734 126.734 123.933 2.801 18387 15870 1 20 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.577 -0.110 18387 15871 1 20 . 1 1 24 24 LEU C C 24 179.852 179.852 177.411 2.441 18387 15872 1 20 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.558 0.645 18387 15873 1 20 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.940 0.038 18387 15874 1 20 . 1 1 24 24 LEU H H 24 8.450 8.450 8.662 -0.212 18387 15875 1 20 . 1 1 25 25 ASN N N 25 115.642 115.642 113.957 1.685 18387 15876 1 20 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.436 -0.194 18387 15877 1 20 . 1 1 25 25 ASN C C 25 176.246 176.246 176.133 0.113 18387 15878 1 20 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.220 0.150 18387 15879 1 20 . 1 1 25 25 ASN CB C 25 38.771 38.771 38.343 0.428 18387 15880 1 20 . 1 1 25 25 ASN H H 25 8.505 8.505 8.421 0.084 18387 15881 1 20 . 1 1 26 26 ASP N N 26 119.722 119.722 117.990 1.732 18387 15882 1 20 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.350 -0.145 18387 15883 1 20 . 1 1 26 26 ASP C C 26 176.708 176.708 176.843 -0.135 18387 15884 1 20 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.580 -0.055 18387 15885 1 20 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.817 -1.537 18387 15886 1 20 . 1 1 26 26 ASP H H 26 7.731 7.731 7.788 -0.057 18387 15887 1 20 . 1 1 27 27 PHE N N 27 116.827 116.827 116.406 0.421 18387 15888 1 20 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.433 0.047 18387 15889 1 20 . 1 1 27 27 PHE C C 27 174.227 174.227 176.169 -1.942 18387 15890 1 20 . 1 1 27 27 PHE CA C 27 57.071 57.071 58.406 -1.335 18387 15891 1 20 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.566 0.153 18387 15892 1 20 . 1 1 27 27 PHE H H 27 7.390 7.390 7.424 -0.034 18387 15893 1 20 . 1 1 28 28 LYS N N 28 120.357 120.357 121.508 -1.151 18387 15894 1 20 . 1 1 28 28 LYS HA H 28 4.387 4.387 3.915 0.472 18387 15895 1 20 . 1 1 28 28 LYS C C 28 177.845 177.845 177.157 0.688 18387 15896 1 20 . 1 1 28 28 LYS CA C 28 58.002 58.002 58.099 -0.097 18387 15897 1 20 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.387 0.157 18387 15898 1 20 . 1 1 28 28 LYS H H 28 6.883 6.883 7.402 -0.519 18387 15899 1 20 . 1 1 29 29 GLY N N 29 112.653 112.653 112.875 -0.222 18387 15900 1 20 . 1 1 29 29 GLY C C 29 173.799 173.799 173.548 0.251 18387 15901 1 20 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.021 -0.033 18387 15902 1 20 . 1 1 29 29 GLY H H 29 8.930 8.930 8.370 0.560 18387 15903 1 20 . 1 1 30 30 LYS N N 30 120.516 120.516 117.984 2.532 18387 15904 1 20 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.661 -0.026 18387 15905 1 20 . 1 1 30 30 LYS C C 30 176.505 176.505 175.422 1.083 18387 15906 1 20 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.296 0.884 18387 15907 1 20 . 1 1 30 30 LYS CB C 30 34.857 34.857 36.000 -1.143 18387 15908 1 20 . 1 1 30 30 LYS H H 30 8.098 8.098 7.230 0.868 18387 15909 1 20 . 1 1 31 31 TYR N N 31 117.383 117.383 120.268 -2.885 18387 15910 1 20 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.734 -0.080 18387 15911 1 20 . 1 1 31 31 TYR C C 31 175.551 175.551 175.863 -0.312 18387 15912 1 20 . 1 1 31 31 TYR CA C 31 60.165 60.165 59.021 1.144 18387 15913 1 20 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.185 3.008 18387 15914 1 20 . 1 1 31 31 TYR H H 31 8.263 8.263 9.162 -0.899 18387 15915 1 20 . 1 1 32 32 VAL N N 32 120.900 120.900 125.487 -4.587 18387 15916 1 20 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.720 -0.281 18387 15917 1 20 . 1 1 32 32 VAL C C 32 175.975 175.975 175.010 0.965 18387 15918 1 20 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.663 -0.958 18387 15919 1 20 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.689 2.818 18387 15920 1 20 . 1 1 32 32 VAL H H 32 9.244 9.244 9.274 -0.030 18387 15921 1 20 . 1 1 33 33 LEU N N 33 130.058 130.058 130.884 -0.826 18387 15922 1 20 . 1 1 33 33 LEU HA H 33 5.173 5.173 4.870 0.303 18387 15923 1 20 . 1 1 33 33 LEU C C 33 174.693 174.693 175.288 -0.595 18387 15924 1 20 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.940 -0.592 18387 15925 1 20 . 1 1 33 33 LEU CB C 33 44.321 44.321 43.327 0.994 18387 15926 1 20 . 1 1 33 33 LEU H H 33 8.161 8.161 7.985 0.176 18387 15927 1 20 . 1 1 34 34 VAL N N 34 129.232 129.232 128.245 0.987 18387 15928 1 20 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.621 0.361 18387 15929 1 20 . 1 1 34 34 VAL C C 34 174.285 174.285 174.601 -0.316 18387 15930 1 20 . 1 1 34 34 VAL CA C 34 61.506 61.506 60.533 0.973 18387 15931 1 20 . 1 1 34 34 VAL CB C 34 32.378 32.378 31.531 0.847 18387 15932 1 20 . 1 1 34 34 VAL H H 34 9.296 9.296 8.835 0.461 18387 15933 1 20 . 1 1 35 35 ASP N N 35 123.675 123.675 128.756 -5.081 18387 15934 1 20 . 1 1 35 35 ASP HA H 35 5.349 5.349 4.969 0.380 18387 15935 1 20 . 1 1 35 35 ASP C C 35 174.258 174.258 174.886 -0.628 18387 15936 1 20 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.332 -1.278 18387 15937 1 20 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.084 -1.622 18387 15938 1 20 . 1 1 35 35 ASP H H 35 8.015 8.015 8.202 -0.187 18387 15939 1 20 . 1 1 36 36 PHE N N 36 126.959 126.959 126.785 0.174 18387 15940 1 20 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.336 0.599 18387 15941 1 20 . 1 1 36 36 PHE C C 36 175.432 175.432 175.180 0.252 18387 15942 1 20 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.722 0.373 18387 15943 1 20 . 1 1 36 36 PHE CB C 36 40.030 40.030 39.905 0.125 18387 15944 1 20 . 1 1 36 36 PHE H H 36 9.171 9.171 8.857 0.314 18387 15945 1 20 . 1 1 37 37 TRP N N 37 120.839 120.839 122.427 -1.588 18387 15946 1 20 . 1 1 37 37 TRP HA H 37 5.757 5.757 4.831 0.926 18387 15947 1 20 . 1 1 37 37 TRP C C 37 172.412 172.412 172.987 -0.575 18387 15948 1 20 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.984 -0.076 18387 15949 1 20 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.177 0.503 18387 15950 1 20 . 1 1 37 37 TRP H H 37 9.280 9.280 8.948 0.332 18387 15951 1 20 . 1 1 38 38 PHE N N 38 109.215 109.215 111.784 -2.569 18387 15952 1 20 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.428 -0.495 18387 15953 1 20 . 1 1 38 38 PHE C C 38 176.141 176.141 174.469 1.672 18387 15954 1 20 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.685 0.326 18387 15955 1 20 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.621 -1.002 18387 15956 1 20 . 1 1 38 38 PHE H H 38 7.062 7.062 7.810 -0.748 18387 15957 1 20 . 1 1 39 39 ALA N N 39 125.193 125.193 122.944 2.249 18387 15958 1 20 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.139 -0.074 18387 15959 1 20 . 1 1 39 39 ALA C C 39 179.349 179.349 178.417 0.932 18387 15960 1 20 . 1 1 39 39 ALA CA C 39 56.064 56.064 55.391 0.673 18387 15961 1 20 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.791 1.106 18387 15962 1 20 . 1 1 39 39 ALA H H 39 10.355 10.355 9.560 0.795 18387 15963 1 20 . 1 1 40 40 GLY N N 40 103.437 103.437 105.818 -2.381 18387 15964 1 20 . 1 1 40 40 GLY C C 40 172.732 172.732 174.958 -2.226 18387 15965 1 20 . 1 1 40 40 GLY CA C 40 44.936 44.936 46.556 -1.620 18387 15966 1 20 . 1 1 40 40 GLY H H 40 8.583 8.583 8.734 -0.151 18387 15967 1 20 . 1 1 41 41 CYS N N 41 124.859 124.859 119.614 5.245 18387 15968 1 20 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.513 -0.109 18387 15969 1 20 . 1 1 41 41 CYS C C 41 176.620 176.620 174.961 1.659 18387 15970 1 20 . 1 1 41 41 CYS CA C 41 58.375 58.375 56.912 1.463 18387 15971 1 20 . 1 1 41 41 CYS CB C 41 28.376 28.376 26.496 1.880 18387 15972 1 20 . 1 1 41 41 CYS H H 41 6.946 6.946 6.998 -0.052 18387 15973 1 20 . 1 1 42 42 SER HA H 42 4.040 4.040 4.266 -0.226 18387 15974 1 20 . 1 1 42 42 SER CA C 42 61.552 61.552 60.287 1.265 18387 15975 1 20 . 1 1 42 42 SER CB C 42 62.675 62.675 62.376 0.299 18387 15976 1 20 . 1 1 43 43 TRP N N 43 129.748 129.748 121.358 8.390 18387 15977 1 20 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.524 0.025 18387 15978 1 20 . 1 1 43 43 TRP C C 43 180.400 180.400 178.103 2.297 18387 15979 1 20 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.059 1.190 18387 15980 1 20 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.289 0.303 18387 15981 1 20 . 1 1 44 44 CYS N N 44 124.462 124.462 117.509 6.953 18387 15982 1 20 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.129 0.122 18387 15983 1 20 . 1 1 44 44 CYS C C 44 178.643 178.643 177.220 1.423 18387 15984 1 20 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.407 2.442 18387 15985 1 20 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.142 2.280 18387 15986 1 20 . 1 1 44 44 CYS H H 44 9.591 9.591 7.895 1.696 18387 15987 1 20 . 1 1 45 45 ARG N N 45 117.248 117.248 119.067 -1.819 18387 15988 1 20 . 1 1 45 45 ARG HA H 45 4.176 4.176 3.954 0.222 18387 15989 1 20 . 1 1 45 45 ARG C C 45 180.302 180.302 177.448 2.854 18387 15990 1 20 . 1 1 45 45 ARG CA C 45 56.943 56.943 58.195 -1.252 18387 15991 1 20 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.996 -2.365 18387 15992 1 20 . 1 1 45 45 ARG H H 45 7.955 7.955 7.700 0.255 18387 15993 1 20 . 1 1 46 46 LYS N N 46 120.318 120.318 117.352 2.966 18387 15994 1 20 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.317 -0.045 18387 15995 1 20 . 1 1 46 46 LYS C C 46 177.755 177.755 177.538 0.217 18387 15996 1 20 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.383 1.387 18387 15997 1 20 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.621 0.536 18387 15998 1 20 . 1 1 46 46 LYS H H 46 8.129 8.129 7.486 0.643 18387 15999 1 20 . 1 1 47 47 GLU N N 47 114.278 114.278 118.012 -3.734 18387 16000 1 20 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.621 0.270 18387 16001 1 20 . 1 1 47 47 GLU C C 47 178.701 178.701 178.243 0.458 18387 16002 1 20 . 1 1 47 47 GLU CA C 47 56.554 56.554 58.023 -1.469 18387 16003 1 20 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.890 -0.124 18387 16004 1 20 . 1 1 47 47 GLU H H 47 7.386 7.386 7.801 -0.415 18387 16005 1 20 . 1 1 48 48 THR N N 48 115.665 115.665 117.718 -2.053 18387 16006 1 20 . 1 1 48 48 THR HA H 48 4.048 4.048 4.270 -0.222 18387 16007 1 20 . 1 1 48 48 THR C C 48 172.392 172.392 174.014 -1.622 18387 16008 1 20 . 1 1 48 48 THR CA C 48 69.426 69.426 68.868 0.558 18387 16009 1 20 . 1 1 48 48 THR CB C 48 66.906 66.906 66.755 0.151 18387 16010 1 20 . 1 1 48 48 THR H H 48 7.810 7.810 7.675 0.135 18387 16011 1 20 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.175 0.114 18387 16012 1 20 . 1 1 49 49 PRO C C 49 179.828 179.828 178.559 1.269 18387 16013 1 20 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.675 -0.076 18387 16014 1 20 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.233 -0.199 18387 16015 1 20 . 1 1 50 50 TYR N N 50 116.950 116.950 116.574 0.376 18387 16016 1 20 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.285 -0.147 18387 16017 1 20 . 1 1 50 50 TYR C C 50 179.488 179.488 178.668 0.820 18387 16018 1 20 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.856 -0.721 18387 16019 1 20 . 1 1 50 50 TYR CB C 50 38.301 38.301 38.101 0.200 18387 16020 1 20 . 1 1 50 50 TYR H H 50 7.071 7.071 7.500 -0.429 18387 16021 1 20 . 1 1 51 51 LEU N N 51 123.989 123.989 120.614 3.375 18387 16022 1 20 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.986 -0.316 18387 16023 1 20 . 1 1 51 51 LEU C C 51 178.072 178.072 179.132 -1.060 18387 16024 1 20 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.812 0.864 18387 16025 1 20 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.455 1.162 18387 16026 1 20 . 1 1 51 51 LEU H H 51 8.243 8.243 7.955 0.288 18387 16027 1 20 . 1 1 52 52 LEU N N 52 119.857 119.857 120.799 -0.942 18387 16028 1 20 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.442 -0.115 18387 16029 1 20 . 1 1 52 52 LEU C C 52 178.704 178.704 178.185 0.519 18387 16030 1 20 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.532 0.043 18387 16031 1 20 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.821 0.917 18387 16032 1 20 . 1 1 52 52 LEU H H 52 9.085 9.085 8.832 0.253 18387 16033 1 20 . 1 1 53 53 LYS N N 53 118.658 118.658 119.224 -0.566 18387 16034 1 20 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.011 0.098 18387 16035 1 20 . 1 1 53 53 LYS C C 53 179.786 179.786 179.060 0.726 18387 16036 1 20 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.942 -0.221 18387 16037 1 20 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.289 0.870 18387 16038 1 20 . 1 1 53 53 LYS H H 53 7.807 7.807 8.091 -0.284 18387 16039 1 20 . 1 1 54 54 THR N N 54 116.869 116.869 116.982 -0.113 18387 16040 1 20 . 1 1 54 54 THR HA H 54 3.965 3.965 4.374 -0.409 18387 16041 1 20 . 1 1 54 54 THR C C 54 175.328 175.328 176.625 -1.297 18387 16042 1 20 . 1 1 54 54 THR CA C 54 67.683 67.683 67.235 0.448 18387 16043 1 20 . 1 1 54 54 THR CB C 54 68.452 68.452 69.037 -0.585 18387 16044 1 20 . 1 1 54 54 THR H H 54 7.771 7.771 8.240 -0.469 18387 16045 1 20 . 1 1 55 55 TYR N N 55 122.202 122.202 122.216 -0.014 18387 16046 1 20 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.340 -0.068 18387 16047 1 20 . 1 1 55 55 TYR C C 55 176.809 176.809 177.631 -0.822 18387 16048 1 20 . 1 1 55 55 TYR CA C 55 62.737 62.737 62.182 0.555 18387 16049 1 20 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.723 0.557 18387 16050 1 20 . 1 1 55 55 TYR H H 55 9.145 9.145 8.762 0.383 18387 16051 1 20 . 1 1 56 56 ASN N N 56 113.858 113.858 116.552 -2.694 18387 16052 1 20 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.534 -0.271 18387 16053 1 20 . 1 1 56 56 ASN C C 56 177.427 177.427 177.381 0.046 18387 16054 1 20 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.681 0.249 18387 16055 1 20 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.177 -0.223 18387 16056 1 20 . 1 1 56 56 ASN H H 56 8.850 8.850 8.610 0.240 18387 16057 1 20 . 1 1 57 57 ALA N N 57 118.829 118.829 121.764 -2.935 18387 16058 1 20 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.211 -0.147 18387 16059 1 20 . 1 1 57 57 ALA C C 57 180.445 180.445 176.974 3.471 18387 16060 1 20 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.191 0.160 18387 16061 1 20 . 1 1 57 57 ALA CB C 57 19.194 19.194 19.083 0.111 18387 16062 1 20 . 1 1 57 57 ALA H H 57 7.436 7.436 7.725 -0.289 18387 16063 1 20 . 1 1 58 58 PHE N N 58 112.082 112.082 113.624 -1.542 18387 16064 1 20 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.630 0.291 18387 16065 1 20 . 1 1 58 58 PHE C C 58 176.999 176.999 177.224 -0.225 18387 16066 1 20 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.603 0.464 18387 16067 1 20 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.831 0.659 18387 16068 1 20 . 1 1 58 58 PHE H H 58 7.480 7.480 7.928 -0.448 18387 16069 1 20 . 1 1 59 59 LYS N N 59 120.666 120.666 121.199 -0.533 18387 16070 1 20 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.059 0.744 18387 16071 1 20 . 1 1 59 59 LYS C C 59 177.157 177.157 176.990 0.167 18387 16072 1 20 . 1 1 59 59 LYS CA C 59 59.081 59.081 59.275 -0.194 18387 16073 1 20 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.838 -1.270 18387 16074 1 20 . 1 1 59 59 LYS H H 59 8.411 8.411 7.602 0.809 18387 16075 1 20 . 1 1 60 60 ASP N N 60 118.908 118.908 116.180 2.728 18387 16076 1 20 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.772 0.353 18387 16077 1 20 . 1 1 60 60 ASP C C 60 176.889 176.889 176.700 0.189 18387 16078 1 20 . 1 1 60 60 ASP CA C 60 54.649 54.649 54.648 0.001 18387 16079 1 20 . 1 1 60 60 ASP CB C 60 40.712 40.712 39.832 0.880 18387 16080 1 20 . 1 1 60 60 ASP H H 60 8.574 8.574 8.352 0.222 18387 16081 1 20 . 1 1 61 61 LYS N N 61 121.021 121.021 119.184 1.837 18387 16082 1 20 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.666 0.048 18387 16083 1 20 . 1 1 61 61 LYS C C 61 175.968 175.968 176.256 -0.288 18387 16084 1 20 . 1 1 61 61 LYS CA C 61 55.137 55.137 55.495 -0.358 18387 16085 1 20 . 1 1 61 61 LYS CB C 61 33.078 33.078 32.334 0.744 18387 16086 1 20 . 1 1 61 61 LYS H H 61 8.278 8.278 7.768 0.510 18387 16087 1 20 . 1 1 62 62 GLY C C 62 173.837 173.837 173.514 0.323 18387 16088 1 20 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.739 1.311 18387 16089 1 20 . 1 1 63 63 PHE N N 63 120.476 120.476 120.674 -0.198 18387 16090 1 20 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.605 0.428 18387 16091 1 20 . 1 1 63 63 PHE C C 63 173.613 173.613 173.342 0.271 18387 16092 1 20 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.174 -0.324 18387 16093 1 20 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.689 -0.014 18387 16094 1 20 . 1 1 63 63 PHE H H 63 7.413 7.413 7.676 -0.263 18387 16095 1 20 . 1 1 64 64 THR N N 64 119.903 119.903 122.965 -3.062 18387 16096 1 20 . 1 1 64 64 THR HA H 64 4.097 4.097 4.596 -0.499 18387 16097 1 20 . 1 1 64 64 THR C C 64 170.397 170.397 172.562 -2.165 18387 16098 1 20 . 1 1 64 64 THR CA C 64 60.261 60.261 60.971 -0.710 18387 16099 1 20 . 1 1 64 64 THR CB C 64 69.507 69.507 72.206 -2.699 18387 16100 1 20 . 1 1 64 64 THR H H 64 7.665 7.665 8.558 -0.893 18387 16101 1 20 . 1 1 65 65 ILE N N 65 117.277 117.277 126.280 -9.003 18387 16102 1 20 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.060 0.416 18387 16103 1 20 . 1 1 65 65 ILE C C 65 173.056 173.056 174.189 -1.133 18387 16104 1 20 . 1 1 65 65 ILE CA C 65 59.708 59.708 61.009 -1.301 18387 16105 1 20 . 1 1 65 65 ILE CB C 65 39.845 39.845 38.267 1.578 18387 16106 1 20 . 1 1 65 65 ILE H H 65 7.321 7.321 8.743 -1.422 18387 16107 1 20 . 1 1 66 66 TYR N N 66 131.968 131.968 129.824 2.144 18387 16108 1 20 . 1 1 66 66 TYR HA H 66 5.247 5.247 4.977 0.270 18387 16109 1 20 . 1 1 66 66 TYR C C 66 174.074 174.074 175.143 -1.069 18387 16110 1 20 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.688 -0.723 18387 16111 1 20 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.422 1.695 18387 16112 1 20 . 1 1 66 66 TYR H H 66 9.038 9.038 8.835 0.203 18387 16113 1 20 . 1 1 67 67 GLY N N 67 114.364 114.364 115.866 -1.502 18387 16114 1 20 . 1 1 67 67 GLY C C 67 172.461 172.461 172.570 -0.109 18387 16115 1 20 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.428 0.572 18387 16116 1 20 . 1 1 67 67 GLY H H 67 9.188 9.188 9.120 0.068 18387 16117 1 20 . 1 1 68 68 VAL N N 68 126.938 126.938 120.299 6.639 18387 16118 1 20 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.958 -0.822 18387 16119 1 20 . 1 1 68 68 VAL C C 68 173.822 173.822 173.929 -0.107 18387 16120 1 20 . 1 1 68 68 VAL CA C 68 61.498 61.498 58.654 2.844 18387 16121 1 20 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.376 1.183 18387 16122 1 20 . 1 1 68 68 VAL H H 68 9.309 9.309 9.030 0.279 18387 16123 1 20 . 1 1 69 69 SER N N 69 118.813 118.813 120.975 -2.162 18387 16124 1 20 . 1 1 69 69 SER HA H 69 5.527 5.527 5.268 0.259 18387 16125 1 20 . 1 1 69 69 SER C C 69 175.753 175.753 173.610 2.143 18387 16126 1 20 . 1 1 69 69 SER CA C 69 54.407 54.407 55.682 -1.275 18387 16127 1 20 . 1 1 69 69 SER CB C 69 63.630 63.630 64.725 -1.095 18387 16128 1 20 . 1 1 69 69 SER H H 69 8.124 8.124 8.865 -0.741 18387 16129 1 20 . 1 1 70 70 THR N N 70 113.861 113.861 121.076 -7.215 18387 16130 1 20 . 1 1 70 70 THR HA H 70 4.381 4.381 4.448 -0.067 18387 16131 1 20 . 1 1 70 70 THR C C 70 175.001 175.001 173.933 1.068 18387 16132 1 20 . 1 1 70 70 THR CA C 70 60.259 60.259 59.709 0.550 18387 16133 1 20 . 1 1 70 70 THR CB C 70 67.291 67.291 68.696 -1.405 18387 16134 1 20 . 1 1 70 70 THR H H 70 7.656 7.656 8.048 -0.392 18387 16135 1 20 . 1 1 71 71 ASP N N 71 125.133 125.133 122.484 2.649 18387 16136 1 20 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.446 -0.376 18387 16137 1 20 . 1 1 71 71 ASP C C 71 175.685 175.685 176.729 -1.044 18387 16138 1 20 . 1 1 71 71 ASP CA C 71 57.612 57.612 55.041 2.571 18387 16139 1 20 . 1 1 71 71 ASP CB C 71 42.369 42.369 42.057 0.312 18387 16140 1 20 . 1 1 71 71 ASP H H 71 8.931 8.931 7.458 1.473 18387 16141 1 20 . 1 1 72 72 ARG N N 72 118.814 118.814 120.155 -1.341 18387 16142 1 20 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.064 0.131 18387 16143 1 20 . 1 1 72 72 ARG C C 72 177.300 177.300 176.480 0.820 18387 16144 1 20 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.995 -1.186 18387 16145 1 20 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.430 0.681 18387 16146 1 20 . 1 1 72 72 ARG H H 72 8.057 8.057 8.320 -0.263 18387 16147 1 20 . 1 1 73 73 ARG N N 73 118.174 118.174 118.008 0.166 18387 16148 1 20 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.471 0.283 18387 16149 1 20 . 1 1 73 73 ARG C C 73 176.503 176.503 176.507 -0.004 18387 16150 1 20 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.682 -0.146 18387 16151 1 20 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.527 -1.499 18387 16152 1 20 . 1 1 73 73 ARG H H 73 8.639 8.639 7.719 0.920 18387 16153 1 20 . 1 1 74 74 GLU N N 74 127.609 127.609 122.438 5.171 18387 16154 1 20 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.245 -0.166 18387 16155 1 20 . 1 1 74 74 GLU C C 74 178.107 178.107 178.152 -0.045 18387 16156 1 20 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.038 -0.253 18387 16157 1 20 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.844 0.254 18387 16158 1 20 . 1 1 74 74 GLU H H 74 9.129 9.129 8.914 0.215 18387 16159 1 20 . 1 1 75 75 GLU N N 75 117.874 117.874 119.655 -1.781 18387 16160 1 20 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.056 0.044 18387 16161 1 20 . 1 1 75 75 GLU C C 75 178.993 178.993 178.623 0.370 18387 16162 1 20 . 1 1 75 75 GLU CA C 75 60.127 60.127 60.202 -0.075 18387 16163 1 20 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.654 0.638 18387 16164 1 20 . 1 1 75 75 GLU H H 75 9.745 9.745 8.859 0.886 18387 16165 1 20 . 1 1 76 76 ASP N N 76 119.182 119.182 119.503 -0.321 18387 16166 1 20 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.391 -0.025 18387 16167 1 20 . 1 1 76 76 ASP C C 76 178.107 178.107 178.268 -0.161 18387 16168 1 20 . 1 1 76 76 ASP CA C 76 56.973 56.973 58.002 -1.029 18387 16169 1 20 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.410 0.110 18387 16170 1 20 . 1 1 76 76 ASP H H 76 7.004 7.004 8.482 -1.478 18387 16171 1 20 . 1 1 77 77 TRP N N 77 123.008 123.008 122.789 0.219 18387 16172 1 20 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.345 -0.196 18387 16173 1 20 . 1 1 77 77 TRP C C 77 176.236 176.236 178.220 -1.984 18387 16174 1 20 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.246 0.237 18387 16175 1 20 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.010 -0.475 18387 16176 1 20 . 1 1 77 77 TRP H H 77 7.112 7.112 7.979 -0.867 18387 16177 1 20 . 1 1 78 78 LYS N N 78 115.727 115.727 118.322 -2.595 18387 16178 1 20 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.458 -0.213 18387 16179 1 20 . 1 1 78 78 LYS C C 78 179.426 179.426 178.934 0.492 18387 16180 1 20 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.186 1.246 18387 16181 1 20 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.827 0.918 18387 16182 1 20 . 1 1 78 78 LYS H H 78 8.431 8.431 8.340 0.091 18387 16183 1 20 . 1 1 79 79 LYS N N 79 118.321 118.321 119.801 -1.480 18387 16184 1 20 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.966 0.054 18387 16185 1 20 . 1 1 79 79 LYS C C 79 178.239 178.239 178.552 -0.313 18387 16186 1 20 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.431 -0.364 18387 16187 1 20 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.510 -0.047 18387 16188 1 20 . 1 1 79 79 LYS H H 79 7.690 7.690 8.131 -0.441 18387 16189 1 20 . 1 1 80 80 ALA N N 80 120.679 120.679 121.997 -1.318 18387 16190 1 20 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.234 -0.079 18387 16191 1 20 . 1 1 80 80 ALA C C 80 178.811 178.811 179.780 -0.969 18387 16192 1 20 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.237 -0.150 18387 16193 1 20 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.538 0.220 18387 16194 1 20 . 1 1 80 80 ALA H H 80 7.560 7.560 8.240 -0.680 18387 16195 1 20 . 1 1 81 81 ILE N N 81 118.019 118.019 119.038 -1.019 18387 16196 1 20 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.694 -0.292 18387 16197 1 20 . 1 1 81 81 ILE C C 81 178.113 178.113 178.342 -0.229 18387 16198 1 20 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.499 0.021 18387 16199 1 20 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.736 0.468 18387 16200 1 20 . 1 1 81 81 ILE H H 81 7.514 7.514 7.916 -0.402 18387 16201 1 20 . 1 1 82 82 GLU N N 82 117.252 117.252 120.039 -2.787 18387 16202 1 20 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.855 0.239 18387 16203 1 20 . 1 1 82 82 GLU C C 82 179.558 179.558 178.406 1.152 18387 16204 1 20 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.715 -0.135 18387 16205 1 20 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.108 0.275 18387 16206 1 20 . 1 1 82 82 GLU H H 82 7.401 7.401 7.611 -0.210 18387 16207 1 20 . 1 1 83 83 GLU N N 83 119.340 119.340 118.272 1.068 18387 16208 1 20 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.050 -0.152 18387 16209 1 20 . 1 1 83 83 GLU C C 83 178.740 178.740 178.055 0.685 18387 16210 1 20 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.728 0.271 18387 16211 1 20 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.827 0.093 18387 16212 1 20 . 1 1 83 83 GLU H H 83 8.191 8.191 8.266 -0.075 18387 16213 1 20 . 1 1 84 84 ASP N N 84 118.449 118.449 115.758 2.691 18387 16214 1 20 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.640 -0.366 18387 16215 1 20 . 1 1 84 84 ASP C C 84 175.597 175.597 175.309 0.288 18387 16216 1 20 . 1 1 84 84 ASP CA C 84 55.047 55.047 53.960 1.087 18387 16217 1 20 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.755 -1.859 18387 16218 1 20 . 1 1 84 84 ASP H H 84 8.252 8.252 7.883 0.369 18387 16219 1 20 . 1 1 85 85 LYS N N 85 116.410 116.410 116.204 0.206 18387 16220 1 20 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.267 -0.094 18387 16221 1 20 . 1 1 85 85 LYS C C 85 176.856 176.856 175.573 1.283 18387 16222 1 20 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.433 -0.460 18387 16223 1 20 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.073 -0.205 18387 16224 1 20 . 1 1 85 85 LYS H H 85 7.890 7.890 7.581 0.309 18387 16225 1 20 . 1 1 86 86 SER N N 86 112.295 112.295 113.667 -1.372 18387 16226 1 20 . 1 1 86 86 SER HA H 86 3.139 3.139 3.523 -0.384 18387 16227 1 20 . 1 1 86 86 SER C C 86 175.805 175.805 172.723 3.082 18387 16228 1 20 . 1 1 86 86 SER CA C 86 53.637 53.637 56.850 -3.213 18387 16229 1 20 . 1 1 86 86 SER CB C 86 60.736 60.736 61.230 -0.494 18387 16230 1 20 . 1 1 86 86 SER H H 86 7.327 7.327 7.338 -0.011 18387 16231 1 20 . 1 1 87 87 TYR N N 87 120.962 120.962 124.540 -3.578 18387 16232 1 20 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.032 0.273 18387 16233 1 20 . 1 1 87 87 TYR C C 87 177.064 177.064 174.157 2.907 18387 16234 1 20 . 1 1 87 87 TYR CA C 87 57.223 57.223 58.232 -1.009 18387 16235 1 20 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.986 -0.633 18387 16236 1 20 . 1 1 87 87 TYR H H 87 6.933 6.933 7.417 -0.484 18387 16237 1 20 . 1 1 88 88 TRP N N 88 118.597 118.597 121.474 -2.877 18387 16238 1 20 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.671 0.180 18387 16239 1 20 . 1 1 88 88 TRP C C 88 175.456 175.456 174.355 1.101 18387 16240 1 20 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.940 1.296 18387 16241 1 20 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.440 -3.713 18387 16242 1 20 . 1 1 88 88 TRP H H 88 6.552 6.552 7.149 -0.597 18387 16243 1 20 . 1 1 89 89 ASN N N 89 118.067 118.067 121.122 -3.055 18387 16244 1 20 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.741 0.308 18387 16245 1 20 . 1 1 89 89 ASN C C 89 173.773 173.773 174.787 -1.014 18387 16246 1 20 . 1 1 89 89 ASN CA C 89 55.456 55.456 54.108 1.348 18387 16247 1 20 . 1 1 89 89 ASN CB C 89 39.197 39.197 38.101 1.096 18387 16248 1 20 . 1 1 89 89 ASN H H 89 7.864 7.864 8.861 -0.997 18387 16249 1 20 . 1 1 90 90 GLN N N 90 125.392 125.392 121.804 3.588 18387 16250 1 20 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.493 0.004 18387 16251 1 20 . 1 1 90 90 GLN C C 90 176.491 176.491 175.261 1.230 18387 16252 1 20 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.763 0.697 18387 16253 1 20 . 1 1 90 90 GLN CB C 90 31.227 31.227 33.373 -2.146 18387 16254 1 20 . 1 1 90 90 GLN H H 90 7.904 7.904 8.243 -0.339 18387 16255 1 20 . 1 1 91 91 VAL N N 91 114.434 114.434 116.274 -1.840 18387 16256 1 20 . 1 1 91 91 VAL HA H 91 5.480 5.480 5.030 0.450 18387 16257 1 20 . 1 1 91 91 VAL C C 91 174.248 174.248 173.022 1.226 18387 16258 1 20 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.706 -0.701 18387 16259 1 20 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.387 1.251 18387 16260 1 20 . 1 1 91 91 VAL H H 91 9.585 9.585 9.086 0.499 18387 16261 1 20 . 1 1 92 92 LEU N N 92 126.910 126.910 124.372 2.538 18387 16262 1 20 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.345 -0.276 18387 16263 1 20 . 1 1 92 92 LEU C C 92 177.696 177.696 175.973 1.723 18387 16264 1 20 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.364 0.480 18387 16265 1 20 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.234 -0.287 18387 16266 1 20 . 1 1 92 92 LEU H H 92 8.941 8.941 8.595 0.346 18387 16267 1 20 . 1 1 93 93 LEU N N 93 125.673 125.673 127.957 -2.284 18387 16268 1 20 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.322 0.078 18387 16269 1 20 . 1 1 93 93 LEU C C 93 177.291 177.291 176.780 0.511 18387 16270 1 20 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.691 -0.739 18387 16271 1 20 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.589 1.590 18387 16272 1 20 . 1 1 93 93 LEU H H 93 8.038 8.038 8.529 -0.491 18387 16273 1 20 . 1 1 94 94 GLN N N 94 122.206 122.206 122.096 0.110 18387 16274 1 20 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.226 0.011 18387 16275 1 20 . 1 1 94 94 GLN C C 94 178.246 178.246 177.211 1.035 18387 16276 1 20 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.431 0.344 18387 16277 1 20 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.730 -0.475 18387 16278 1 20 . 1 1 94 94 GLN H H 94 9.298 9.298 8.291 1.007 18387 16279 1 20 . 1 1 95 95 LYS N N 95 122.668 122.668 121.687 0.981 18387 16280 1 20 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.935 0.031 18387 16281 1 20 . 1 1 95 95 LYS C C 95 178.787 178.787 178.691 0.096 18387 16282 1 20 . 1 1 95 95 LYS CA C 95 60.072 60.072 60.045 0.027 18387 16283 1 20 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.720 0.745 18387 16284 1 20 . 1 1 95 95 LYS H H 95 8.645 8.645 8.794 -0.149 18387 16285 1 20 . 1 1 96 96 ASP N N 96 116.775 116.775 117.930 -1.155 18387 16286 1 20 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.498 0.082 18387 16287 1 20 . 1 1 96 96 ASP C C 96 176.220 176.220 178.122 -1.902 18387 16288 1 20 . 1 1 96 96 ASP CA C 96 56.346 56.346 57.024 -0.678 18387 16289 1 20 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.600 -0.043 18387 16290 1 20 . 1 1 96 96 ASP H H 96 8.606 8.606 8.447 0.159 18387 16291 1 20 . 1 1 97 97 ASP N N 97 118.213 118.213 121.738 -3.525 18387 16292 1 20 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.428 0.499 18387 16293 1 20 . 1 1 97 97 ASP C C 97 176.954 176.954 178.408 -1.454 18387 16294 1 20 . 1 1 97 97 ASP CA C 97 55.359 55.359 57.142 -1.783 18387 16295 1 20 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.874 1.450 18387 16296 1 20 . 1 1 97 97 ASP H H 97 7.988 7.988 8.086 -0.098 18387 16297 1 20 . 1 1 98 98 VAL N N 98 118.907 118.907 119.827 -0.920 18387 16298 1 20 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.551 -0.135 18387 16299 1 20 . 1 1 98 98 VAL C C 98 176.470 176.470 177.573 -1.103 18387 16300 1 20 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.968 0.810 18387 16301 1 20 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.549 0.842 18387 16302 1 20 . 1 1 98 98 VAL H H 98 7.098 7.098 8.595 -1.497 18387 16303 1 20 . 1 1 99 99 LYS N N 99 117.909 117.909 119.676 -1.767 18387 16304 1 20 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.922 0.021 18387 16305 1 20 . 1 1 99 99 LYS C C 99 178.762 178.762 178.588 0.174 18387 16306 1 20 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.822 0.323 18387 16307 1 20 . 1 1 99 99 LYS CB C 99 32.012 32.012 32.250 -0.238 18387 16308 1 20 . 1 1 99 99 LYS H H 99 8.304 8.304 7.737 0.567 18387 16309 1 20 . 1 1 100 100 ASP N N 100 117.843 117.843 120.286 -2.443 18387 16310 1 20 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.358 0.120 18387 16311 1 20 . 1 1 100 100 ASP C C 100 179.694 179.694 179.149 0.545 18387 16312 1 20 . 1 1 100 100 ASP CA C 100 57.526 57.526 58.471 -0.945 18387 16313 1 20 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.757 0.071 18387 16314 1 20 . 1 1 100 100 ASP H H 100 8.024 8.024 8.361 -0.337 18387 16315 1 20 . 1 1 101 101 VAL N N 101 122.202 122.202 120.153 2.049 18387 16316 1 20 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.748 0.247 18387 16317 1 20 . 1 1 101 101 VAL C C 101 178.533 178.533 177.643 0.890 18387 16318 1 20 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.859 0.143 18387 16319 1 20 . 1 1 101 101 VAL CB C 101 32.037 32.037 32.020 0.017 18387 16320 1 20 . 1 1 101 101 VAL H H 101 8.205 8.205 8.170 0.035 18387 16321 1 20 . 1 1 102 102 LEU N N 102 118.798 118.798 119.622 -0.824 18387 16322 1 20 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.950 -0.170 18387 16323 1 20 . 1 1 102 102 LEU C C 102 180.254 180.254 179.029 1.225 18387 16324 1 20 . 1 1 102 102 LEU CA C 102 58.941 58.941 58.137 0.804 18387 16325 1 20 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.364 -0.925 18387 16326 1 20 . 1 1 102 102 LEU H H 102 8.422 8.422 7.748 0.674 18387 16327 1 20 . 1 1 103 103 GLU N N 103 116.915 116.915 120.173 -3.258 18387 16328 1 20 . 1 1 103 103 GLU HA H 103 4.135 4.135 4.015 0.120 18387 16329 1 20 . 1 1 103 103 GLU C C 103 180.910 180.910 179.705 1.205 18387 16330 1 20 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.095 0.308 18387 16331 1 20 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.234 0.497 18387 16332 1 20 . 1 1 103 103 GLU H H 103 8.262 8.262 8.356 -0.094 18387 16333 1 20 . 1 1 104 104 SER N N 104 117.866 117.866 116.475 1.391 18387 16334 1 20 . 1 1 104 104 SER HA H 104 4.216 4.216 4.082 0.134 18387 16335 1 20 . 1 1 104 104 SER C C 104 175.455 175.455 176.713 -1.258 18387 16336 1 20 . 1 1 104 104 SER CA C 104 62.019 62.019 62.151 -0.132 18387 16337 1 20 . 1 1 104 104 SER CB C 104 62.891 62.891 63.035 -0.144 18387 16338 1 20 . 1 1 104 104 SER H H 104 8.544 8.544 8.244 0.300 18387 16339 1 20 . 1 1 105 105 TYR N N 105 117.278 117.278 118.854 -1.576 18387 16340 1 20 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.338 -0.066 18387 16341 1 20 . 1 1 105 105 TYR C C 105 174.750 174.750 175.252 -0.502 18387 16342 1 20 . 1 1 105 105 TYR CA C 105 59.859 59.859 59.212 0.647 18387 16343 1 20 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.640 2.071 18387 16344 1 20 . 1 1 105 105 TYR H H 105 7.691 7.691 7.649 0.042 18387 16345 1 20 . 1 1 106 106 CYS N N 106 116.897 116.897 116.317 0.580 18387 16346 1 20 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.100 -0.205 18387 16347 1 20 . 1 1 106 106 CYS C C 106 174.056 174.056 173.350 0.706 18387 16348 1 20 . 1 1 106 106 CYS CA C 106 59.610 59.610 60.220 -0.610 18387 16349 1 20 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.020 0.012 18387 16350 1 20 . 1 1 106 106 CYS H H 106 7.862 7.862 8.424 -0.562 18387 16351 1 20 . 1 1 107 107 ILE N N 107 118.885 118.885 120.954 -2.069 18387 16352 1 20 . 1 1 107 107 ILE HA H 107 3.339 3.339 4.064 -0.725 18387 16353 1 20 . 1 1 107 107 ILE C C 107 176.793 176.793 175.978 0.815 18387 16354 1 20 . 1 1 107 107 ILE CA C 107 62.745 62.745 59.765 2.980 18387 16355 1 20 . 1 1 107 107 ILE CB C 107 38.079 38.079 37.242 0.837 18387 16356 1 20 . 1 1 107 107 ILE H H 107 7.707 7.707 7.776 -0.069 18387 16357 1 20 . 1 1 108 108 VAL N N 108 123.983 123.983 121.033 2.950 18387 16358 1 20 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.313 -0.039 18387 16359 1 20 . 1 1 108 108 VAL C C 108 175.476 175.476 175.310 0.166 18387 16360 1 20 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.598 0.026 18387 16361 1 20 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.819 0.189 18387 16362 1 20 . 1 1 108 108 VAL H H 108 8.656 8.656 8.406 0.250 18387 16363 1 20 . 1 1 109 109 GLY N N 109 110.120 110.120 107.936 2.184 18387 16364 1 20 . 1 1 109 109 GLY C C 109 169.982 169.982 171.661 -1.679 18387 16365 1 20 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.054 -0.451 18387 16366 1 20 . 1 1 109 109 GLY H H 109 7.500 7.500 7.199 0.301 18387 16367 1 20 . 1 1 110 110 PHE N N 110 115.276 115.276 118.585 -3.309 18387 16368 1 20 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.333 -0.559 18387 16369 1 20 . 1 1 110 110 PHE C C 110 174.361 174.361 174.446 -0.085 18387 16370 1 20 . 1 1 110 110 PHE CA C 110 55.687 55.687 54.517 1.170 18387 16371 1 20 . 1 1 110 110 PHE CB C 110 41.951 41.951 40.377 1.574 18387 16372 1 20 . 1 1 110 110 PHE H H 110 8.203 8.203 8.430 -0.227 18387 16373 1 20 . 1 1 111 111 PRO HA H 111 5.359 5.359 4.884 0.475 18387 16374 1 20 . 1 1 111 111 PRO C C 111 175.691 175.691 175.487 0.204 18387 16375 1 20 . 1 1 111 111 PRO CA C 111 63.157 63.157 63.187 -0.030 18387 16376 1 20 . 1 1 111 111 PRO CB C 111 35.304 35.304 32.684 2.620 18387 16377 1 20 . 1 1 112 112 HIS N N 112 123.708 123.708 120.085 3.623 18387 16378 1 20 . 1 1 112 112 HIS HA H 112 4.963 4.963 5.010 -0.047 18387 16379 1 20 . 1 1 112 112 HIS C C 112 173.649 173.649 173.635 0.014 18387 16380 1 20 . 1 1 112 112 HIS CA C 112 57.074 57.074 56.120 0.954 18387 16381 1 20 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.644 -0.447 18387 16382 1 20 . 1 1 112 112 HIS H H 112 8.952 8.952 8.550 0.402 18387 16383 1 20 . 1 1 113 113 ILE N N 113 128.596 128.596 126.729 1.867 18387 16384 1 20 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.003 0.694 18387 16385 1 20 . 1 1 113 113 ILE C C 113 176.130 176.130 174.506 1.624 18387 16386 1 20 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.308 0.687 18387 16387 1 20 . 1 1 113 113 ILE CB C 113 38.055 38.055 39.895 -1.839 18387 16388 1 20 . 1 1 113 113 ILE H H 113 8.808 8.808 8.735 0.073 18387 16389 1 20 . 1 1 114 114 ILE N N 114 119.668 119.668 122.414 -2.746 18387 16390 1 20 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.937 0.036 18387 16391 1 20 . 1 1 114 114 ILE C C 114 173.186 173.186 173.448 -0.262 18387 16392 1 20 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.728 0.001 18387 16393 1 20 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.294 0.246 18387 16394 1 20 . 1 1 114 114 ILE H H 114 8.721 8.721 8.858 -0.137 18387 16395 1 20 . 1 1 115 115 LEU N N 115 122.770 122.770 124.640 -1.870 18387 16396 1 20 . 1 1 115 115 LEU HA H 115 5.275 5.275 4.974 0.301 18387 16397 1 20 . 1 1 115 115 LEU C C 115 173.601 173.601 174.497 -0.896 18387 16398 1 20 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.448 0.334 18387 16399 1 20 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.914 1.220 18387 16400 1 20 . 1 1 115 115 LEU H H 115 8.665 8.665 8.833 -0.168 18387 16401 1 20 . 1 1 116 116 VAL N N 116 130.411 130.411 128.091 2.320 18387 16402 1 20 . 1 1 116 116 VAL HA H 116 4.858 4.858 4.900 -0.042 18387 16403 1 20 . 1 1 116 116 VAL C C 116 174.565 174.565 175.346 -0.781 18387 16404 1 20 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.713 0.091 18387 16405 1 20 . 1 1 116 116 VAL CB C 116 33.915 33.915 33.665 0.250 18387 16406 1 20 . 1 1 116 116 VAL H H 116 9.472 9.472 9.148 0.324 18387 16407 1 20 . 1 1 117 117 ASP N N 117 127.896 127.896 128.233 -0.337 18387 16408 1 20 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.722 -0.330 18387 16409 1 20 . 1 1 117 117 ASP C C 117 176.567 176.567 175.737 0.830 18387 16410 1 20 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.768 -0.168 18387 16411 1 20 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.023 0.561 18387 16412 1 20 . 1 1 117 117 ASP H H 117 9.429 9.429 8.617 0.812 18387 16413 1 20 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.310 -0.116 18387 16414 1 20 . 1 1 118 118 PRO C C 118 177.534 177.534 177.943 -0.409 18387 16415 1 20 . 1 1 118 118 PRO CA C 118 65.165 65.165 64.862 0.303 18387 16416 1 20 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.817 0.996 18387 16417 1 20 . 1 1 119 119 GLU N N 119 114.015 114.015 117.354 -3.339 18387 16418 1 20 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.071 0.268 18387 16419 1 20 . 1 1 119 119 GLU C C 119 176.722 176.722 177.154 -0.432 18387 16420 1 20 . 1 1 119 119 GLU CA C 119 55.639 55.639 58.105 -2.466 18387 16421 1 20 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.342 1.235 18387 16422 1 20 . 1 1 119 119 GLU H H 119 7.733 7.733 7.979 -0.246 18387 16423 1 20 . 1 1 120 120 GLY N N 120 108.218 108.218 105.239 2.979 18387 16424 1 20 . 1 1 120 120 GLY C C 120 174.110 174.110 173.144 0.966 18387 16425 1 20 . 1 1 120 120 GLY CA C 120 45.396 45.396 44.782 0.614 18387 16426 1 20 . 1 1 120 120 GLY H H 120 8.588 8.588 8.315 0.273 18387 16427 1 20 . 1 1 121 121 LYS N N 121 121.778 121.778 119.772 2.006 18387 16428 1 20 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.142 -0.283 18387 16429 1 20 . 1 1 121 121 LYS C C 121 176.458 176.458 175.492 0.966 18387 16430 1 20 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.216 0.746 18387 16431 1 20 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.946 -2.494 18387 16432 1 20 . 1 1 121 121 LYS H H 121 8.600 8.600 8.509 0.091 18387 16433 1 20 . 1 1 122 122 ILE N N 122 122.058 122.058 124.419 -2.361 18387 16434 1 20 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.435 -0.163 18387 16435 1 20 . 1 1 122 122 ILE C C 122 177.084 177.084 176.971 0.113 18387 16436 1 20 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.184 0.635 18387 16437 1 20 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.743 1.905 18387 16438 1 20 . 1 1 122 122 ILE H H 122 9.006 9.006 8.957 0.049 18387 16439 1 20 . 1 1 123 123 VAL N N 123 120.561 120.561 125.876 -5.315 18387 16440 1 20 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.135 0.620 18387 16441 1 20 . 1 1 123 123 VAL C C 123 175.584 175.584 175.283 0.301 18387 16442 1 20 . 1 1 123 123 VAL CA C 123 61.151 61.151 62.694 -1.543 18387 16443 1 20 . 1 1 123 123 VAL CB C 123 33.401 33.401 31.804 1.597 18387 16444 1 20 . 1 1 123 123 VAL H H 123 9.054 9.054 8.089 0.965 18387 16445 1 20 . 1 1 124 124 ALA N N 124 121.102 121.102 122.309 -1.207 18387 16446 1 20 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.798 -0.141 18387 16447 1 20 . 1 1 124 124 ALA C C 124 174.832 174.832 175.020 -0.188 18387 16448 1 20 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.024 1.436 18387 16449 1 20 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.418 1.412 18387 16450 1 20 . 1 1 124 124 ALA H H 124 7.793 7.793 7.373 0.420 18387 16451 1 20 . 1 1 125 125 LYS N N 125 117.637 117.637 120.346 -2.709 18387 16452 1 20 . 1 1 125 125 LYS HA H 125 5.033 5.033 5.024 0.009 18387 16453 1 20 . 1 1 125 125 LYS C C 125 173.417 173.417 175.460 -2.043 18387 16454 1 20 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.513 -0.372 18387 16455 1 20 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.650 1.001 18387 16456 1 20 . 1 1 125 125 LYS H H 125 8.872 8.872 8.229 0.643 18387 16457 1 20 . 1 1 126 126 GLU N N 126 115.236 115.236 114.805 0.431 18387 16458 1 20 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.790 0.208 18387 16459 1 20 . 1 1 126 126 GLU C C 126 175.998 175.998 175.589 0.409 18387 16460 1 20 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.416 -0.454 18387 16461 1 20 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.593 -1.158 18387 16462 1 20 . 1 1 126 126 GLU H H 126 7.941 7.941 8.441 -0.500 18387 16463 1 20 . 1 1 127 127 LEU N N 127 118.584 118.584 119.418 -0.834 18387 16464 1 20 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.090 0.292 18387 16465 1 20 . 1 1 127 127 LEU C C 127 176.766 176.766 176.635 0.131 18387 16466 1 20 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.700 -1.091 18387 16467 1 20 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.178 1.785 18387 16468 1 20 . 1 1 127 127 LEU H H 127 7.300 7.300 7.301 -0.001 18387 16469 1 20 . 1 1 128 128 ARG N N 128 118.625 118.625 120.948 -2.323 18387 16470 1 20 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.832 -0.357 18387 16471 1 20 . 1 1 128 128 ARG C C 128 177.113 177.113 177.854 -0.741 18387 16472 1 20 . 1 1 128 128 ARG CA C 128 53.390 53.390 53.137 0.253 18387 16473 1 20 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.907 1.706 18387 16474 1 20 . 1 1 128 128 ARG H H 128 7.929 7.929 7.900 0.029 18387 16475 1 20 . 1 1 129 129 GLY N N 129 114.010 114.010 111.375 2.635 18387 16476 1 20 . 1 1 129 129 GLY C C 129 175.931 175.931 174.741 1.190 18387 16477 1 20 . 1 1 129 129 GLY CA C 129 45.461 45.461 47.646 -2.185 18387 16478 1 20 . 1 1 129 129 GLY H H 129 10.649 10.649 9.589 1.060 18387 16479 1 20 . 1 1 130 130 ASP N N 130 123.975 123.975 121.164 2.811 18387 16480 1 20 . 1 1 130 130 ASP HA H 130 4.532 4.532 3.738 0.794 18387 16481 1 20 . 1 1 130 130 ASP C C 130 177.507 177.507 178.052 -0.545 18387 16482 1 20 . 1 1 130 130 ASP CA C 130 57.372 57.372 57.372 0.000 18387 16483 1 20 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.375 0.528 18387 16484 1 20 . 1 1 130 130 ASP H H 130 8.540 8.540 8.105 0.435 18387 16485 1 20 . 1 1 131 131 ASP N N 131 116.806 116.806 120.137 -3.331 18387 16486 1 20 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.496 0.074 18387 16487 1 20 . 1 1 131 131 ASP C C 131 179.038 179.038 178.203 0.835 18387 16488 1 20 . 1 1 131 131 ASP CA C 131 56.983 56.983 56.973 0.010 18387 16489 1 20 . 1 1 131 131 ASP CB C 131 40.934 40.934 41.037 -0.103 18387 16490 1 20 . 1 1 131 131 ASP H H 131 7.907 7.907 7.692 0.215 18387 16491 1 20 . 1 1 132 132 LEU N N 132 123.869 123.869 119.226 4.643 18387 16492 1 20 . 1 1 132 132 LEU HA H 132 3.791 3.791 4.019 -0.228 18387 16493 1 20 . 1 1 132 132 LEU C C 132 176.343 176.343 178.214 -1.871 18387 16494 1 20 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.418 1.366 18387 16495 1 20 . 1 1 132 132 LEU CB C 132 41.768 41.768 40.683 1.085 18387 16496 1 20 . 1 1 132 132 LEU H H 132 7.542 7.542 8.544 -1.002 18387 16497 1 20 . 1 1 133 133 TYR N N 133 120.042 120.042 120.508 -0.466 18387 16498 1 20 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.153 -0.157 18387 16499 1 20 . 1 1 133 133 TYR C C 133 177.426 177.426 177.275 0.151 18387 16500 1 20 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.055 0.078 18387 16501 1 20 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.651 -0.075 18387 16502 1 20 . 1 1 133 133 TYR H H 133 7.384 7.384 7.691 -0.307 18387 16503 1 20 . 1 1 134 134 ASN N N 134 114.936 114.936 117.558 -2.622 18387 16504 1 20 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.342 0.061 18387 16505 1 20 . 1 1 134 134 ASN C C 134 178.703 178.703 178.017 0.686 18387 16506 1 20 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.459 -0.651 18387 16507 1 20 . 1 1 134 134 ASN CB C 134 38.208 38.208 37.962 0.246 18387 16508 1 20 . 1 1 134 134 ASN H H 134 8.399 8.399 7.765 0.634 18387 16509 1 20 . 1 1 135 135 THR N N 135 117.387 117.387 117.752 -0.365 18387 16510 1 20 . 1 1 135 135 THR HA H 135 3.920 3.920 3.953 -0.033 18387 16511 1 20 . 1 1 135 135 THR C C 135 175.323 175.323 176.831 -1.508 18387 16512 1 20 . 1 1 135 135 THR CA C 135 67.402 67.402 66.683 0.719 18387 16513 1 20 . 1 1 135 135 THR CB C 135 68.111 68.111 69.032 -0.921 18387 16514 1 20 . 1 1 135 135 THR H H 135 8.265 8.265 8.525 -0.260 18387 16515 1 20 . 1 1 136 136 VAL N N 136 121.207 121.207 121.019 0.188 18387 16516 1 20 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.550 -0.535 18387 16517 1 20 . 1 1 136 136 VAL C C 136 176.457 176.457 177.385 -0.928 18387 16518 1 20 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.088 2.184 18387 16519 1 20 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.608 0.333 18387 16520 1 20 . 1 1 136 136 VAL H H 136 7.595 7.595 8.234 -0.639 18387 16521 1 20 . 1 1 137 137 GLU N N 137 118.266 118.266 120.090 -1.824 18387 16522 1 20 . 1 1 137 137 GLU HA H 137 2.682 2.682 4.125 -1.443 18387 16523 1 20 . 1 1 137 137 GLU C C 137 177.482 177.482 178.318 -0.836 18387 16524 1 20 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.977 -0.047 18387 16525 1 20 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.137 0.645 18387 16526 1 20 . 1 1 137 137 GLU H H 137 8.114 8.114 8.371 -0.257 18387 16527 1 20 . 1 1 138 138 LYS N N 138 116.431 116.431 118.332 -1.901 18387 16528 1 20 . 1 1 138 138 LYS HA H 138 3.768 3.768 4.380 -0.612 18387 16529 1 20 . 1 1 138 138 LYS C C 138 179.193 179.193 177.757 1.436 18387 16530 1 20 . 1 1 138 138 LYS CA C 138 59.040 59.040 58.477 0.562 18387 16531 1 20 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.186 -0.028 18387 16532 1 20 . 1 1 138 138 LYS H H 138 7.133 7.133 7.382 -0.249 18387 16533 1 20 . 1 1 139 139 PHE N N 139 116.336 116.336 116.467 -0.131 18387 16534 1 20 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.370 -0.360 18387 16535 1 20 . 1 1 139 139 PHE C C 139 177.855 177.855 177.325 0.530 18387 16536 1 20 . 1 1 139 139 PHE CA C 139 62.384 62.384 61.080 1.304 18387 16537 1 20 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.747 -0.395 18387 16538 1 20 . 1 1 139 139 PHE H H 139 7.338 7.338 7.402 -0.064 18387 16539 1 20 . 1 1 140 140 VAL N N 140 116.491 116.491 116.524 -0.033 18387 16540 1 20 . 1 1 140 140 VAL HA H 140 3.524 3.524 2.566 0.958 18387 16541 1 20 . 1 1 140 140 VAL C C 140 177.747 177.747 176.923 0.824 18387 16542 1 20 . 1 1 140 140 VAL CA C 140 65.242 65.242 64.944 0.298 18387 16543 1 20 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.563 -0.173 18387 16544 1 20 . 1 1 140 140 VAL H H 140 8.332 8.332 8.468 -0.136 18387 16545 1 20 . 1 1 141 141 ASN N N 141 116.956 116.956 118.247 -1.291 18387 16546 1 20 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.654 0.172 18387 16547 1 20 . 1 1 141 141 ASN C C 141 176.997 176.997 175.803 1.194 18387 16548 1 20 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.506 -0.829 18387 16549 1 20 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.745 -1.296 18387 16550 1 20 . 1 1 141 141 ASN H H 141 7.862 7.862 7.709 0.153 18387 16551 1 20 . 1 1 142 142 GLY N N 142 107.938 107.938 106.040 1.898 18387 16552 1 20 . 1 1 142 142 GLY C C 142 174.336 174.336 172.701 1.635 18387 16553 1 20 . 1 1 142 142 GLY CA C 142 45.985 45.985 44.581 1.404 18387 16554 1 20 . 1 1 142 142 GLY H H 142 7.466 7.466 8.371 -0.905 18387 16555 1 20 . 1 1 143 143 ALA N N 143 123.441 123.441 122.671 0.770 18387 16556 1 20 . 1 1 143 143 ALA HA H 143 4.341 4.341 3.878 0.463 18387 16557 1 20 . 1 1 143 143 ALA C C 143 178.212 178.212 177.225 0.987 18387 16558 1 20 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.743 0.083 18387 16559 1 20 . 1 1 143 143 ALA CB C 143 19.244 19.244 17.513 1.731 18387 16560 1 20 . 1 1 143 143 ALA H H 143 7.950 7.950 8.645 -0.695 18387 16561 1 20 . 1 1 144 144 LYS N N 144 120.149 120.149 118.956 1.193 18387 16562 1 20 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.108 0.187 18387 16563 1 20 . 1 1 144 144 LYS C C 144 176.945 176.945 176.580 0.365 18387 16564 1 20 . 1 1 144 144 LYS CA C 144 56.519 56.519 57.279 -0.760 18387 16565 1 20 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.835 0.195 18387 16566 1 20 . 1 1 144 144 LYS H H 144 8.187 8.187 8.429 -0.242 18387 16567 1 20 . 1 1 145 145 GLU N N 145 120.992 120.992 117.555 3.437 18387 16568 1 20 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.372 -0.077 18387 16569 1 20 . 1 1 145 145 GLU C C 145 177.116 177.116 175.670 1.446 18387 16570 1 20 . 1 1 145 145 GLU CA C 145 56.903 56.903 55.556 1.347 18387 16571 1 20 . 1 1 145 145 GLU CB C 145 30.242 30.242 30.713 -0.471 18387 16572 1 20 . 1 1 145 145 GLU H H 145 8.363 8.363 7.917 0.446 18387 16573 1 20 . 1 1 146 146 GLY N N 146 109.467 109.467 109.432 0.035 18387 16574 1 20 . 1 1 146 146 GLY C C 146 174.108 174.108 173.501 0.607 18387 16575 1 20 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.747 0.654 18387 16576 1 20 . 1 1 146 146 GLY H H 146 8.371 8.371 8.155 0.216 18387 16577 1 20 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.594 0.015 18387 16578 1 20 . 1 1 151 151 HIS C C 151 174.258 174.258 174.471 -0.213 18387 16579 1 20 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.245 -0.079 18387 16580 1 20 . 1 1 151 151 HIS CB C 151 30.833 30.833 31.511 -0.678 18387 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 136 3.019 0.297 3.016 18387 2 1 1 "Average Difference" HA 158 0.376 0.001 0.377 18387 3 1 1 "Average Difference" C 144 1.197 -0.202 1.184 18387 4 1 1 "Average Difference" CA 146 1.079 -0.092 1.078 18387 5 1 1 "Average Difference" CB 134 1.282 -0.282 1.255 18387 6 1 1 "Average Difference" HN 135 0.582 0.049 0.582 18387 7 1 2 "Average Difference" N 136 2.703 0.426 2.679 18387 8 1 2 "Average Difference" HA 158 0.399 0.006 0.400 18387 9 1 2 "Average Difference" C 144 1.229 -0.243 1.208 18387 10 1 2 "Average Difference" CA 146 1.073 -0.271 1.042 18387 11 1 2 "Average Difference" CB 134 1.259 -0.168 1.252 18387 12 1 2 "Average Difference" HN 135 0.551 -0.013 0.552 18387 13 1 3 "Average Difference" N 136 2.990 0.249 2.991 18387 14 1 3 "Average Difference" HA 158 0.376 0.019 0.377 18387 15 1 3 "Average Difference" C 144 1.195 -0.195 1.183 18387 16 1 3 "Average Difference" CA 146 1.079 -0.237 1.056 18387 17 1 3 "Average Difference" CB 134 1.317 -0.211 1.305 18387 18 1 3 "Average Difference" HN 135 0.604 0.017 0.606 18387 19 1 4 "Average Difference" N 136 3.358 0.229 3.363 18387 20 1 4 "Average Difference" HA 158 0.378 0.006 0.380 18387 21 1 4 "Average Difference" C 144 1.205 -0.161 1.198 18387 22 1 4 "Average Difference" CA 146 1.144 -0.261 1.117 18387 23 1 4 "Average Difference" CB 134 1.286 -0.293 1.257 18387 24 1 4 "Average Difference" HN 135 0.555 -0.010 0.557 18387 25 1 5 "Average Difference" N 136 2.770 0.352 2.757 18387 26 1 5 "Average Difference" HA 158 0.340 -0.016 0.341 18387 27 1 5 "Average Difference" C 144 1.139 -0.268 1.111 18387 28 1 5 "Average Difference" CA 146 1.138 -0.254 1.114 18387 29 1 5 "Average Difference" CB 134 1.310 -0.316 1.276 18387 30 1 5 "Average Difference" HN 135 0.550 0.020 0.551 18387 31 1 6 "Average Difference" N 136 2.881 0.473 2.853 18387 32 1 6 "Average Difference" HA 158 0.352 -0.040 0.351 18387 33 1 6 "Average Difference" C 144 1.154 -0.143 1.149 18387 34 1 6 "Average Difference" CA 146 1.098 -0.172 1.089 18387 35 1 6 "Average Difference" CB 134 1.284 -0.319 1.249 18387 36 1 6 "Average Difference" HN 135 0.569 0.088 0.564 18387 37 1 7 "Average Difference" N 136 2.927 0.099 2.936 18387 38 1 7 "Average Difference" HA 158 0.354 0.020 0.354 18387 39 1 7 "Average Difference" C 144 1.231 -0.194 1.220 18387 40 1 7 "Average Difference" CA 146 1.086 -0.231 1.065 18387 41 1 7 "Average Difference" CB 134 1.152 -0.187 1.141 18387 42 1 7 "Average Difference" HN 135 0.578 0.028 0.580 18387 43 1 8 "Average Difference" N 136 2.854 0.498 2.821 18387 44 1 8 "Average Difference" HA 158 0.345 0.013 0.346 18387 45 1 8 "Average Difference" C 144 1.150 -0.173 1.141 18387 46 1 8 "Average Difference" CA 146 1.194 -0.192 1.183 18387 47 1 8 "Average Difference" CB 134 1.222 -0.307 1.187 18387 48 1 8 "Average Difference" HN 135 0.531 0.063 0.529 18387 49 1 9 "Average Difference" N 136 2.655 0.407 2.633 18387 50 1 9 "Average Difference" HA 158 0.367 0.014 0.368 18387 51 1 9 "Average Difference" C 144 1.187 -0.193 1.175 18387 52 1 9 "Average Difference" CA 146 1.065 -0.213 1.047 18387 53 1 9 "Average Difference" CB 134 1.231 -0.245 1.211 18387 54 1 9 "Average Difference" HN 135 0.603 0.002 0.605 18387 55 1 10 "Average Difference" N 136 3.021 0.220 3.024 18387 56 1 10 "Average Difference" HA 158 0.375 0.018 0.376 18387 57 1 10 "Average Difference" C 144 1.121 -0.191 1.108 18387 58 1 10 "Average Difference" CA 146 1.219 -0.243 1.199 18387 59 1 10 "Average Difference" CB 134 1.250 -0.177 1.242 18387 60 1 10 "Average Difference" HN 135 0.567 0.022 0.569 18387 61 1 11 "Average Difference" N 136 2.852 0.236 2.853 18387 62 1 11 "Average Difference" HA 158 0.370 0.002 0.372 18387 63 1 11 "Average Difference" C 144 1.233 -0.199 1.222 18387 64 1 11 "Average Difference" CA 146 1.144 -0.117 1.142 18387 65 1 11 "Average Difference" CB 134 1.366 -0.321 1.332 18387 66 1 11 "Average Difference" HN 135 0.585 0.055 0.585 18387 67 1 12 "Average Difference" N 136 2.987 0.475 2.960 18387 68 1 12 "Average Difference" HA 158 0.363 0.015 0.364 18387 69 1 12 "Average Difference" C 144 1.200 -0.224 1.183 18387 70 1 12 "Average Difference" CA 146 1.178 -0.186 1.168 18387 71 1 12 "Average Difference" CB 134 1.286 -0.225 1.271 18387 72 1 12 "Average Difference" HN 135 0.552 0.042 0.553 18387 73 1 13 "Average Difference" N 136 2.886 0.352 2.875 18387 74 1 13 "Average Difference" HA 158 0.387 0.010 0.388 18387 75 1 13 "Average Difference" C 144 1.206 -0.181 1.196 18387 76 1 13 "Average Difference" CA 146 1.118 -0.283 1.086 18387 77 1 13 "Average Difference" CB 134 1.310 -0.228 1.295 18387 78 1 13 "Average Difference" HN 135 0.636 0.014 0.639 18387 79 1 14 "Average Difference" N 136 2.985 0.225 2.988 18387 80 1 14 "Average Difference" HA 158 0.405 -0.002 0.406 18387 81 1 14 "Average Difference" C 144 1.175 -0.254 1.152 18387 82 1 14 "Average Difference" CA 146 1.101 -0.273 1.070 18387 83 1 14 "Average Difference" CB 134 1.252 -0.226 1.236 18387 84 1 14 "Average Difference" HN 135 0.584 -0.031 0.585 18387 85 1 15 "Average Difference" N 136 2.848 0.429 2.826 18387 86 1 15 "Average Difference" HA 158 0.347 -0.009 0.348 18387 87 1 15 "Average Difference" C 144 1.152 -0.172 1.143 18387 88 1 15 "Average Difference" CA 146 1.133 -0.145 1.127 18387 89 1 15 "Average Difference" CB 134 1.204 -0.234 1.186 18387 90 1 15 "Average Difference" HN 135 0.580 0.054 0.580 18387 91 1 16 "Average Difference" N 136 3.057 0.355 3.048 18387 92 1 16 "Average Difference" HA 158 0.374 0.005 0.375 18387 93 1 16 "Average Difference" C 144 1.143 -0.163 1.135 18387 94 1 16 "Average Difference" CA 146 1.071 -0.087 1.071 18387 95 1 16 "Average Difference" CB 134 1.273 -0.208 1.261 18387 96 1 16 "Average Difference" HN 135 0.559 0.043 0.560 18387 97 1 17 "Average Difference" N 136 2.697 0.259 2.695 18387 98 1 17 "Average Difference" HA 158 0.355 0.007 0.356 18387 99 1 17 "Average Difference" C 144 1.165 -0.206 1.151 18387 100 1 17 "Average Difference" CA 146 1.184 -0.212 1.169 18387 101 1 17 "Average Difference" CB 134 1.268 -0.283 1.240 18387 102 1 17 "Average Difference" HN 135 0.606 0.025 0.608 18387 103 1 18 "Average Difference" N 136 2.989 0.116 2.998 18387 104 1 18 "Average Difference" HA 158 0.378 -0.010 0.379 18387 105 1 18 "Average Difference" C 144 1.218 -0.239 1.199 18387 106 1 18 "Average Difference" CA 146 1.076 -0.212 1.058 18387 107 1 18 "Average Difference" CB 134 1.338 -0.201 1.328 18387 108 1 18 "Average Difference" HN 135 0.589 0.015 0.591 18387 109 1 19 "Average Difference" N 136 2.722 0.192 2.725 18387 110 1 19 "Average Difference" HA 158 0.382 0.009 0.383 18387 111 1 19 "Average Difference" C 144 1.218 -0.287 1.187 18387 112 1 19 "Average Difference" CA 146 1.145 -0.161 1.138 18387 113 1 19 "Average Difference" CB 134 1.280 -0.152 1.276 18387 114 1 19 "Average Difference" HN 135 0.575 0.012 0.577 18387 115 1 20 "Average Difference" N 136 2.952 0.180 2.958 18387 116 1 20 "Average Difference" HA 158 0.398 0.007 0.399 18387 117 1 20 "Average Difference" C 144 1.164 -0.158 1.157 18387 118 1 20 "Average Difference" CA 146 1.115 -0.187 1.103 18387 119 1 20 "Average Difference" CB 134 1.221 -0.237 1.202 18387 120 1 20 "Average Difference" HN 135 0.543 0.023 0.544 18387 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 18387 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 SER HA H 2 3.992 3.992 4.451 -0.459 18387 2 1 . 1 1 2 2 SER CA C 2 57.555 57.555 58.883 -1.327 18387 3 1 . 1 1 2 2 SER CB C 2 64.977 64.977 63.539 1.438 18387 4 1 . 1 1 3 3 LEU HA H 3 4.439 4.439 4.400 0.039 18387 5 1 . 1 1 3 3 LEU C C 3 176.631 176.631 175.781 0.850 18387 6 1 . 1 1 3 3 LEU CA C 3 54.564 54.564 54.599 -0.035 18387 7 1 . 1 1 3 3 LEU CB C 3 42.724 42.724 42.367 0.357 18387 8 1 . 1 1 4 4 ALA N N 4 125.483 125.483 122.827 2.656 18387 9 1 . 1 1 4 4 ALA HA H 4 4.379 4.379 4.551 -0.172 18387 10 1 . 1 1 4 4 ALA C C 4 179.642 179.642 176.492 3.150 18387 11 1 . 1 1 4 4 ALA CA C 4 51.735 51.735 51.893 -0.158 18387 12 1 . 1 1 4 4 ALA CB C 4 19.752 19.752 20.495 -0.743 18387 13 1 . 1 1 4 4 ALA H H 4 8.483 8.483 8.136 0.347 18387 14 1 . 1 1 5 5 THR HA H 5 3.845 3.845 4.700 -0.855 18387 15 1 . 1 1 5 5 THR C C 5 175.487 175.487 175.636 -0.149 18387 16 1 . 1 1 5 5 THR CA C 5 64.531 64.531 61.770 2.761 18387 17 1 . 1 1 5 5 THR CB C 5 68.108 68.108 69.570 -1.462 18387 18 1 . 1 1 6 6 GLY N N 6 114.298 114.298 114.968 -0.670 18387 19 1 . 1 1 6 6 GLY C C 6 174.324 174.324 174.237 0.087 18387 20 1 . 1 1 6 6 GLY CA C 6 44.835 44.835 45.121 -0.286 18387 21 1 . 1 1 6 6 GLY H H 6 9.511 9.511 9.021 0.490 18387 22 1 . 1 1 7 7 SER N N 7 115.270 115.270 117.305 -2.035 18387 23 1 . 1 1 7 7 SER HA H 7 4.500 4.500 4.534 -0.034 18387 24 1 . 1 1 7 7 SER C C 7 173.315 173.315 174.315 -1.001 18387 25 1 . 1 1 7 7 SER CA C 7 58.915 58.915 58.179 0.736 18387 26 1 . 1 1 7 7 SER CB C 7 64.308 64.308 64.155 0.153 18387 27 1 . 1 1 7 7 SER H H 7 7.736 7.736 7.825 -0.089 18387 28 1 . 1 1 8 8 VAL N N 8 123.708 123.708 125.045 -1.337 18387 29 1 . 1 1 8 8 VAL HA H 8 3.832 3.832 4.118 -0.286 18387 30 1 . 1 1 8 8 VAL C C 8 176.673 176.673 175.956 0.717 18387 31 1 . 1 1 8 8 VAL CA C 8 63.673 63.673 62.627 1.046 18387 32 1 . 1 1 8 8 VAL CB C 8 32.222 32.222 32.272 -0.050 18387 33 1 . 1 1 8 8 VAL H H 8 8.632 8.632 8.486 0.146 18387 34 1 . 1 1 9 9 ALA N N 9 133.040 133.040 131.823 1.217 18387 35 1 . 1 1 9 9 ALA HA H 9 4.263 4.263 4.716 -0.453 18387 36 1 . 1 1 9 9 ALA C C 9 175.404 175.404 175.403 0.001 18387 37 1 . 1 1 9 9 ALA CA C 9 50.955 50.955 49.829 1.126 18387 38 1 . 1 1 9 9 ALA CB C 9 18.030 18.030 18.858 -0.828 18387 39 1 . 1 1 9 9 ALA H H 9 8.448 8.448 8.785 -0.337 18387 40 1 . 1 1 10 10 PRO HA H 10 4.331 4.331 4.371 -0.040 18387 41 1 . 1 1 10 10 PRO C C 10 175.071 175.071 176.043 -0.972 18387 42 1 . 1 1 10 10 PRO CA C 10 62.641 62.641 62.519 0.122 18387 43 1 . 1 1 10 10 PRO CB C 10 32.324 32.324 32.281 0.043 18387 44 1 . 1 1 11 11 ALA N N 11 124.172 124.172 124.427 -0.255 18387 45 1 . 1 1 11 11 ALA HA H 11 4.244 4.244 4.446 -0.202 18387 46 1 . 1 1 11 11 ALA C C 11 177.688 177.688 177.376 0.312 18387 47 1 . 1 1 11 11 ALA CA C 11 53.621 53.621 51.584 2.037 18387 48 1 . 1 1 11 11 ALA CB C 11 19.327 19.327 19.306 0.021 18387 49 1 . 1 1 11 11 ALA H H 11 8.221 8.221 8.296 -0.075 18387 50 1 . 1 1 12 12 ILE N N 12 117.815 117.815 124.798 -6.983 18387 51 1 . 1 1 12 12 ILE HA H 12 4.328 4.328 4.223 0.105 18387 52 1 . 1 1 12 12 ILE C C 12 175.013 175.013 175.729 -0.716 18387 53 1 . 1 1 12 12 ILE CA C 12 62.166 62.166 61.002 1.164 18387 54 1 . 1 1 12 12 ILE CB C 12 44.290 44.290 38.778 5.512 18387 55 1 . 1 1 12 12 ILE H H 12 7.693 7.693 8.322 -0.629 18387 56 1 . 1 1 13 13 THR N N 13 121.186 121.186 122.217 -1.031 18387 57 1 . 1 1 13 13 THR HA H 13 4.840 4.840 5.047 -0.207 18387 58 1 . 1 1 13 13 THR C C 13 172.625 172.625 173.738 -1.113 18387 59 1 . 1 1 13 13 THR CA C 13 62.297 62.297 61.308 0.990 18387 60 1 . 1 1 13 13 THR CB C 13 71.585 71.585 69.769 1.816 18387 61 1 . 1 1 13 13 THR H H 13 8.363 8.363 8.872 -0.509 18387 62 1 . 1 1 14 14 GLY N N 14 110.785 110.785 112.538 -1.753 18387 63 1 . 1 1 14 14 GLY C C 14 170.040 170.040 172.113 -2.073 18387 64 1 . 1 1 14 14 GLY CA C 14 44.390 44.390 43.318 1.072 18387 65 1 . 1 1 14 14 GLY H H 14 7.993 7.993 9.003 -1.010 18387 66 1 . 1 1 15 15 ILE N N 15 119.088 119.088 121.377 -2.289 18387 67 1 . 1 1 15 15 ILE HA H 15 5.125 5.125 4.982 0.143 18387 68 1 . 1 1 15 15 ILE C C 15 176.359 176.359 176.041 0.318 18387 69 1 . 1 1 15 15 ILE CA C 15 58.614 58.614 60.740 -2.126 18387 70 1 . 1 1 15 15 ILE CB C 15 38.639 38.639 38.782 -0.143 18387 71 1 . 1 1 15 15 ILE H H 15 7.973 7.973 8.656 -0.683 18387 72 1 . 1 1 16 16 ASP N N 16 126.633 126.633 127.468 -0.835 18387 73 1 . 1 1 16 16 ASP HA H 16 5.849 5.849 5.263 0.586 18387 74 1 . 1 1 16 16 ASP C C 16 179.190 179.190 177.635 1.555 18387 75 1 . 1 1 16 16 ASP CA C 16 52.880 52.880 53.162 -0.282 18387 76 1 . 1 1 16 16 ASP CB C 16 42.275 42.275 42.568 -0.293 18387 77 1 . 1 1 16 16 ASP H H 16 9.335 9.335 8.902 0.433 18387 78 1 . 1 1 17 17 LEU N N 17 116.648 116.648 118.613 -1.965 18387 79 1 . 1 1 17 17 LEU HA H 17 4.174 4.174 4.100 0.074 18387 80 1 . 1 1 17 17 LEU C C 17 178.432 178.432 178.834 -0.402 18387 81 1 . 1 1 17 17 LEU CA C 17 57.981 57.981 57.542 0.439 18387 82 1 . 1 1 17 17 LEU CB C 17 42.986 42.986 41.693 1.293 18387 83 1 . 1 1 17 17 LEU H H 17 8.071 8.071 8.790 -0.719 18387 84 1 . 1 1 18 18 LYS N N 18 117.401 117.401 117.829 -0.427 18387 85 1 . 1 1 18 18 LYS HA H 18 4.509 4.509 4.222 0.287 18387 86 1 . 1 1 18 18 LYS C C 18 176.793 176.793 177.464 -0.671 18387 87 1 . 1 1 18 18 LYS CA C 18 55.435 55.435 57.546 -2.112 18387 88 1 . 1 1 18 18 LYS CB C 18 33.063 33.063 33.079 -0.016 18387 89 1 . 1 1 18 18 LYS H H 18 8.207 8.207 8.612 -0.405 18387 90 1 . 1 1 19 19 GLY N N 19 108.061 108.061 106.745 1.316 18387 91 1 . 1 1 19 19 GLY C C 19 174.649 174.649 173.896 0.753 18387 92 1 . 1 1 19 19 GLY CA C 19 45.597 45.597 44.681 0.916 18387 93 1 . 1 1 19 19 GLY H H 19 8.099 8.099 8.346 -0.247 18387 94 1 . 1 1 20 20 ASN N N 20 121.012 121.012 119.925 1.087 18387 95 1 . 1 1 20 20 ASN HA H 20 4.905 4.905 4.995 -0.090 18387 96 1 . 1 1 20 20 ASN C C 20 174.827 174.827 174.684 0.143 18387 97 1 . 1 1 20 20 ASN CA C 20 52.467 52.467 52.445 0.022 18387 98 1 . 1 1 20 20 ASN CB C 20 39.676 39.676 40.933 -1.257 18387 99 1 . 1 1 20 20 ASN H H 20 8.945 8.945 9.003 -0.058 18387 100 1 . 1 1 21 21 SER N N 21 117.285 117.285 117.907 -0.622 18387 101 1 . 1 1 21 21 SER HA H 21 5.000 5.000 4.870 0.130 18387 102 1 . 1 1 21 21 SER C C 21 174.911 174.911 174.460 0.451 18387 103 1 . 1 1 21 21 SER CA C 21 58.730 58.730 58.327 0.403 18387 104 1 . 1 1 21 21 SER CB C 21 63.162 63.162 62.781 0.381 18387 105 1 . 1 1 21 21 SER H H 21 8.740 8.740 8.683 0.057 18387 106 1 . 1 1 22 22 VAL N N 22 128.665 128.665 126.688 1.977 18387 107 1 . 1 1 22 22 VAL HA H 22 4.380 4.380 4.378 0.002 18387 108 1 . 1 1 22 22 VAL C C 22 176.276 176.276 175.157 1.119 18387 109 1 . 1 1 22 22 VAL CA C 22 62.953 62.953 61.395 1.558 18387 110 1 . 1 1 22 22 VAL CB C 22 35.582 35.582 34.238 1.344 18387 111 1 . 1 1 22 22 VAL H H 22 9.125 9.125 9.002 0.123 18387 112 1 . 1 1 23 23 SER N N 23 127.457 127.457 119.758 7.699 18387 113 1 . 1 1 23 23 SER HA H 23 5.878 5.878 5.593 0.285 18387 114 1 . 1 1 23 23 SER C C 23 174.436 174.436 175.802 -1.366 18387 115 1 . 1 1 23 23 SER CA C 23 57.101 57.101 56.599 0.502 18387 116 1 . 1 1 23 23 SER CB C 23 66.078 66.078 65.281 0.797 18387 117 1 . 1 1 23 23 SER H H 23 8.971 8.971 9.019 -0.048 18387 118 1 . 1 1 24 24 LEU N N 24 126.734 126.734 122.910 3.824 18387 119 1 . 1 1 24 24 LEU HA H 24 3.467 3.467 3.881 -0.414 18387 120 1 . 1 1 24 24 LEU C C 24 179.852 179.852 177.672 2.180 18387 121 1 . 1 1 24 24 LEU CA C 24 58.203 58.203 57.067 1.136 18387 122 1 . 1 1 24 24 LEU CB C 24 41.978 41.978 41.881 0.097 18387 123 1 . 1 1 24 24 LEU H H 24 8.450 8.450 8.605 -0.155 18387 124 1 . 1 1 25 25 ASN N N 25 115.642 115.642 116.338 -0.696 18387 125 1 . 1 1 25 25 ASN HA H 25 4.242 4.242 4.437 -0.195 18387 126 1 . 1 1 25 25 ASN C C 25 176.246 176.246 176.513 -0.267 18387 127 1 . 1 1 25 25 ASN CA C 25 55.370 55.370 55.630 -0.260 18387 128 1 . 1 1 25 25 ASN CB C 25 38.771 38.771 37.866 0.905 18387 129 1 . 1 1 25 25 ASN H H 25 8.505 8.505 8.667 -0.162 18387 130 1 . 1 1 26 26 ASP N N 26 119.722 119.722 119.904 -0.182 18387 131 1 . 1 1 26 26 ASP HA H 26 4.205 4.205 4.355 -0.150 18387 132 1 . 1 1 26 26 ASP C C 26 176.708 176.708 176.438 0.270 18387 133 1 . 1 1 26 26 ASP CA C 26 56.525 56.525 56.295 0.230 18387 134 1 . 1 1 26 26 ASP CB C 26 39.280 39.280 40.424 -1.144 18387 135 1 . 1 1 26 26 ASP H H 26 7.731 7.731 7.816 -0.085 18387 136 1 . 1 1 27 27 PHE N N 27 116.827 116.827 116.350 0.476 18387 137 1 . 1 1 27 27 PHE HA H 27 4.480 4.480 4.594 -0.114 18387 138 1 . 1 1 27 27 PHE C C 27 174.227 174.227 175.416 -1.189 18387 139 1 . 1 1 27 27 PHE CA C 27 57.071 57.071 57.259 -0.188 18387 140 1 . 1 1 27 27 PHE CB C 27 39.719 39.719 39.596 0.123 18387 141 1 . 1 1 27 27 PHE H H 27 7.390 7.390 7.384 0.006 18387 142 1 . 1 1 28 28 LYS N N 28 120.357 120.357 121.569 -1.212 18387 143 1 . 1 1 28 28 LYS HA H 28 4.387 4.387 4.154 0.233 18387 144 1 . 1 1 28 28 LYS C C 28 177.845 177.845 176.947 0.898 18387 145 1 . 1 1 28 28 LYS CA C 28 58.002 58.002 57.448 0.554 18387 146 1 . 1 1 28 28 LYS CB C 28 32.544 32.544 32.042 0.502 18387 147 1 . 1 1 28 28 LYS H H 28 6.883 6.883 7.384 -0.501 18387 148 1 . 1 1 29 29 GLY N N 29 112.653 112.653 109.291 3.362 18387 149 1 . 1 1 29 29 GLY C C 29 173.799 173.799 173.522 0.277 18387 150 1 . 1 1 29 29 GLY CA C 29 44.988 44.988 45.139 -0.151 18387 151 1 . 1 1 29 29 GLY H H 29 8.930 8.930 8.394 0.536 18387 152 1 . 1 1 30 30 LYS N N 30 120.516 120.516 118.597 1.919 18387 153 1 . 1 1 30 30 LYS HA H 30 4.635 4.635 4.646 -0.011 18387 154 1 . 1 1 30 30 LYS C C 30 176.505 176.505 174.991 1.514 18387 155 1 . 1 1 30 30 LYS CA C 30 55.180 55.180 54.553 0.627 18387 156 1 . 1 1 30 30 LYS CB C 30 34.857 34.857 35.865 -1.009 18387 157 1 . 1 1 30 30 LYS H H 30 8.098 8.098 7.359 0.739 18387 158 1 . 1 1 31 31 TYR N N 31 117.383 117.383 120.074 -2.691 18387 159 1 . 1 1 31 31 TYR HA H 31 4.654 4.654 4.744 -0.090 18387 160 1 . 1 1 31 31 TYR C C 31 175.551 175.551 175.709 -0.158 18387 161 1 . 1 1 31 31 TYR CA C 31 60.165 60.165 58.928 1.237 18387 162 1 . 1 1 31 31 TYR CB C 31 41.193 41.193 38.662 2.531 18387 163 1 . 1 1 31 31 TYR H H 31 8.263 8.263 8.944 -0.681 18387 164 1 . 1 1 32 32 VAL N N 32 120.900 120.900 125.113 -4.213 18387 165 1 . 1 1 32 32 VAL HA H 32 4.439 4.439 4.611 -0.172 18387 166 1 . 1 1 32 32 VAL C C 32 175.975 175.975 174.864 1.111 18387 167 1 . 1 1 32 32 VAL CA C 32 59.706 59.706 60.877 -1.171 18387 168 1 . 1 1 32 32 VAL CB C 32 35.507 35.507 32.731 2.776 18387 169 1 . 1 1 32 32 VAL H H 32 9.244 9.244 9.142 0.102 18387 170 1 . 1 1 33 33 LEU N N 33 130.058 130.058 130.725 -0.667 18387 171 1 . 1 1 33 33 LEU HA H 33 5.173 5.173 5.008 0.165 18387 172 1 . 1 1 33 33 LEU C C 33 174.693 174.693 175.303 -0.610 18387 173 1 . 1 1 33 33 LEU CA C 33 53.348 53.348 53.541 -0.193 18387 174 1 . 1 1 33 33 LEU CB C 33 44.321 44.321 42.992 1.329 18387 175 1 . 1 1 33 33 LEU H H 33 8.161 8.161 8.536 -0.375 18387 176 1 . 1 1 34 34 VAL N N 34 129.232 129.232 128.783 0.449 18387 177 1 . 1 1 34 34 VAL HA H 34 4.982 4.982 4.653 0.329 18387 178 1 . 1 1 34 34 VAL C C 34 174.285 174.285 174.707 -0.422 18387 179 1 . 1 1 34 34 VAL CA C 34 61.506 61.506 61.358 0.148 18387 180 1 . 1 1 34 34 VAL CB C 34 32.378 32.378 32.253 0.125 18387 181 1 . 1 1 34 34 VAL H H 34 9.296 9.296 9.107 0.189 18387 182 1 . 1 1 35 35 ASP N N 35 123.675 123.675 128.168 -4.493 18387 183 1 . 1 1 35 35 ASP HA H 35 5.349 5.349 5.027 0.322 18387 184 1 . 1 1 35 35 ASP C C 35 174.258 174.258 175.064 -0.806 18387 185 1 . 1 1 35 35 ASP CA C 35 51.054 51.054 52.782 -1.728 18387 186 1 . 1 1 35 35 ASP CB C 35 40.462 40.462 42.378 -1.916 18387 187 1 . 1 1 35 35 ASP H H 35 8.015 8.015 8.435 -0.420 18387 188 1 . 1 1 36 36 PHE N N 36 126.959 126.959 125.035 1.924 18387 189 1 . 1 1 36 36 PHE HA H 36 5.935 5.935 5.532 0.403 18387 190 1 . 1 1 36 36 PHE C C 36 175.432 175.432 175.521 -0.089 18387 191 1 . 1 1 36 36 PHE CA C 36 58.095 58.095 57.722 0.373 18387 192 1 . 1 1 36 36 PHE CB C 36 40.030 40.030 40.269 -0.239 18387 193 1 . 1 1 36 36 PHE H H 36 9.171 9.171 8.803 0.368 18387 194 1 . 1 1 37 37 TRP N N 37 120.839 120.839 122.627 -1.788 18387 195 1 . 1 1 37 37 TRP HA H 37 5.757 5.757 5.291 0.466 18387 196 1 . 1 1 37 37 TRP C C 37 172.412 172.412 173.433 -1.021 18387 197 1 . 1 1 37 37 TRP CA C 37 55.909 55.909 55.746 0.163 18387 198 1 . 1 1 37 37 TRP CB C 37 32.680 32.680 32.798 -0.118 18387 199 1 . 1 1 37 37 TRP H H 37 9.280 9.280 9.090 0.190 18387 200 1 . 1 1 38 38 PHE N N 38 109.215 109.215 112.392 -3.177 18387 201 1 . 1 1 38 38 PHE HA H 38 3.933 3.933 4.495 -0.562 18387 202 1 . 1 1 38 38 PHE C C 38 176.141 176.141 174.384 1.757 18387 203 1 . 1 1 38 38 PHE CA C 38 57.011 57.011 56.539 0.472 18387 204 1 . 1 1 38 38 PHE CB C 38 39.619 39.619 40.611 -0.992 18387 205 1 . 1 1 38 38 PHE H H 38 7.062 7.062 8.055 -0.993 18387 206 1 . 1 1 39 39 ALA N N 39 125.193 125.193 123.352 1.841 18387 207 1 . 1 1 39 39 ALA HA H 39 4.065 4.065 4.271 -0.206 18387 208 1 . 1 1 39 39 ALA C C 39 179.349 179.349 178.167 1.182 18387 209 1 . 1 1 39 39 ALA CA C 39 56.064 56.064 54.217 1.847 18387 210 1 . 1 1 39 39 ALA CB C 39 19.897 19.897 18.629 1.268 18387 211 1 . 1 1 39 39 ALA H H 39 10.355 10.355 9.353 1.002 18387 212 1 . 1 1 40 40 GLY N N 40 103.437 103.437 106.272 -2.835 18387 213 1 . 1 1 40 40 GLY C C 40 172.732 172.732 174.086 -1.354 18387 214 1 . 1 1 40 40 GLY CA C 40 44.936 44.936 45.460 -0.524 18387 215 1 . 1 1 40 40 GLY H H 40 8.583 8.583 8.291 0.292 18387 216 1 . 1 1 41 41 CYS N N 41 124.859 124.859 120.372 4.487 18387 217 1 . 1 1 41 41 CYS HA H 41 4.404 4.404 4.409 -0.005 18387 218 1 . 1 1 41 41 CYS C C 41 176.620 176.620 175.179 1.441 18387 219 1 . 1 1 41 41 CYS CA C 41 58.375 58.375 57.833 0.542 18387 220 1 . 1 1 41 41 CYS CB C 41 28.376 28.376 27.855 0.521 18387 221 1 . 1 1 41 41 CYS H H 41 6.946 6.946 6.946 0.000 18387 222 1 . 1 1 42 42 SER HA H 42 4.040 4.040 4.259 -0.219 18387 223 1 . 1 1 42 42 SER CA C 42 61.552 61.552 60.764 0.788 18387 224 1 . 1 1 42 42 SER CB C 42 62.675 62.675 62.884 -0.210 18387 225 1 . 1 1 43 43 TRP N N 43 129.748 129.748 121.561 8.187 18387 226 1 . 1 1 43 43 TRP HA H 43 4.549 4.549 4.557 -0.008 18387 227 1 . 1 1 43 43 TRP C C 43 180.400 180.400 177.877 2.522 18387 228 1 . 1 1 43 43 TRP CA C 43 60.249 60.249 59.051 1.198 18387 229 1 . 1 1 43 43 TRP CB C 43 29.592 29.592 29.595 -0.003 18387 230 1 . 1 1 44 44 CYS N N 44 124.462 124.462 117.116 7.346 18387 231 1 . 1 1 44 44 CYS HA H 44 4.251 4.251 4.218 0.033 18387 232 1 . 1 1 44 44 CYS C C 44 178.643 178.643 176.881 1.762 18387 233 1 . 1 1 44 44 CYS CA C 44 64.849 64.849 62.531 2.318 18387 234 1 . 1 1 44 44 CYS CB C 44 29.422 29.422 27.072 2.350 18387 235 1 . 1 1 44 44 CYS H H 44 9.591 9.591 7.915 1.676 18387 236 1 . 1 1 45 45 ARG N N 45 117.248 117.248 117.846 -0.598 18387 237 1 . 1 1 45 45 ARG HA H 45 4.176 4.176 4.281 -0.105 18387 238 1 . 1 1 45 45 ARG C C 45 180.302 180.302 177.376 2.926 18387 239 1 . 1 1 45 45 ARG CA C 45 56.943 56.943 57.325 -0.382 18387 240 1 . 1 1 45 45 ARG CB C 45 27.631 27.631 29.669 -2.038 18387 241 1 . 1 1 45 45 ARG H H 45 7.955 7.955 7.705 0.250 18387 242 1 . 1 1 46 46 LYS N N 46 120.318 120.318 118.241 2.077 18387 243 1 . 1 1 46 46 LYS HA H 46 4.272 4.272 4.208 0.064 18387 244 1 . 1 1 46 46 LYS C C 46 177.755 177.755 177.762 -0.007 18387 245 1 . 1 1 46 46 LYS CA C 46 58.769 58.769 57.761 1.008 18387 246 1 . 1 1 46 46 LYS CB C 46 33.157 33.157 32.332 0.825 18387 247 1 . 1 1 46 46 LYS H H 46 8.129 8.129 7.631 0.498 18387 248 1 . 1 1 47 47 GLU N N 47 114.278 114.278 117.725 -3.447 18387 249 1 . 1 1 47 47 GLU HA H 47 4.891 4.891 4.600 0.291 18387 250 1 . 1 1 47 47 GLU C C 47 178.701 178.701 178.198 0.503 18387 251 1 . 1 1 47 47 GLU CA C 47 56.554 56.554 57.895 -1.341 18387 252 1 . 1 1 47 47 GLU CB C 47 29.766 29.766 29.646 0.120 18387 253 1 . 1 1 47 47 GLU H H 47 7.386 7.386 7.651 -0.265 18387 254 1 . 1 1 48 48 THR N N 48 115.665 115.665 117.402 -1.737 18387 255 1 . 1 1 48 48 THR HA H 48 4.048 4.048 4.196 -0.148 18387 256 1 . 1 1 48 48 THR C C 48 172.392 172.392 174.326 -1.934 18387 257 1 . 1 1 48 48 THR CA C 48 69.426 69.426 68.792 0.634 18387 258 1 . 1 1 48 48 THR CB C 48 66.906 66.906 66.582 0.324 18387 259 1 . 1 1 48 48 THR H H 48 7.810 7.810 7.669 0.141 18387 260 1 . 1 1 49 49 PRO HA H 49 4.289 4.289 4.167 0.122 18387 261 1 . 1 1 49 49 PRO C C 49 179.828 179.828 178.648 1.180 18387 262 1 . 1 1 49 49 PRO CA C 49 66.599 66.599 66.299 0.299 18387 263 1 . 1 1 49 49 PRO CB C 49 31.034 31.034 31.009 0.025 18387 264 1 . 1 1 50 50 TYR N N 50 116.950 116.950 116.523 0.427 18387 265 1 . 1 1 50 50 TYR HA H 50 4.138 4.138 4.282 -0.144 18387 266 1 . 1 1 50 50 TYR C C 50 179.488 179.488 178.594 0.894 18387 267 1 . 1 1 50 50 TYR CA C 50 61.135 61.135 61.411 -0.276 18387 268 1 . 1 1 50 50 TYR CB C 50 38.301 38.301 37.773 0.528 18387 269 1 . 1 1 50 50 TYR H H 50 7.071 7.071 7.243 -0.172 18387 270 1 . 1 1 51 51 LEU N N 51 123.989 123.989 120.615 3.374 18387 271 1 . 1 1 51 51 LEU HA H 51 3.670 3.670 3.890 -0.220 18387 272 1 . 1 1 51 51 LEU C C 51 178.072 178.072 178.925 -0.853 18387 273 1 . 1 1 51 51 LEU CA C 51 58.676 58.676 57.894 0.782 18387 274 1 . 1 1 51 51 LEU CB C 51 42.617 42.617 41.392 1.225 18387 275 1 . 1 1 51 51 LEU H H 51 8.243 8.243 8.436 -0.193 18387 276 1 . 1 1 52 52 LEU N N 52 119.857 119.857 120.156 -0.299 18387 277 1 . 1 1 52 52 LEU HA H 52 4.327 4.327 4.231 0.096 18387 278 1 . 1 1 52 52 LEU C C 52 178.704 178.704 178.350 0.354 18387 279 1 . 1 1 52 52 LEU CA C 52 58.575 58.575 58.517 0.058 18387 280 1 . 1 1 52 52 LEU CB C 52 42.738 42.738 41.743 0.995 18387 281 1 . 1 1 52 52 LEU H H 52 9.085 9.085 8.730 0.355 18387 282 1 . 1 1 53 53 LYS N N 53 118.658 118.658 119.055 -0.396 18387 283 1 . 1 1 53 53 LYS HA H 53 4.109 4.109 4.002 0.107 18387 284 1 . 1 1 53 53 LYS C C 53 179.786 179.786 179.001 0.785 18387 285 1 . 1 1 53 53 LYS CA C 53 59.721 59.721 59.854 -0.134 18387 286 1 . 1 1 53 53 LYS CB C 53 33.159 33.159 32.173 0.986 18387 287 1 . 1 1 53 53 LYS H H 53 7.807 7.807 8.119 -0.312 18387 288 1 . 1 1 54 54 THR N N 54 116.869 116.869 116.568 0.301 18387 289 1 . 1 1 54 54 THR HA H 54 3.965 3.965 4.379 -0.414 18387 290 1 . 1 1 54 54 THR C C 54 175.328 175.328 176.657 -1.329 18387 291 1 . 1 1 54 54 THR CA C 54 67.683 67.683 67.211 0.472 18387 292 1 . 1 1 54 54 THR CB C 54 68.452 68.452 68.934 -0.482 18387 293 1 . 1 1 54 54 THR H H 54 7.771 7.771 8.205 -0.434 18387 294 1 . 1 1 55 55 TYR N N 55 122.202 122.202 122.585 -0.383 18387 295 1 . 1 1 55 55 TYR HA H 55 4.272 4.272 4.278 -0.006 18387 296 1 . 1 1 55 55 TYR C C 55 176.809 176.809 177.327 -0.518 18387 297 1 . 1 1 55 55 TYR CA C 55 62.737 62.737 61.874 0.863 18387 298 1 . 1 1 55 55 TYR CB C 55 39.280 39.280 38.521 0.759 18387 299 1 . 1 1 55 55 TYR H H 55 9.145 9.145 8.716 0.429 18387 300 1 . 1 1 56 56 ASN N N 56 113.858 113.858 117.079 -3.221 18387 301 1 . 1 1 56 56 ASN HA H 56 4.263 4.263 4.343 -0.080 18387 302 1 . 1 1 56 56 ASN C C 56 177.427 177.427 176.988 0.439 18387 303 1 . 1 1 56 56 ASN CA C 56 55.930 55.930 55.813 0.117 18387 304 1 . 1 1 56 56 ASN CB C 56 37.954 37.954 38.418 -0.465 18387 305 1 . 1 1 56 56 ASN H H 56 8.850 8.850 8.457 0.393 18387 306 1 . 1 1 57 57 ALA N N 57 118.829 118.829 120.505 -1.676 18387 307 1 . 1 1 57 57 ALA HA H 57 4.064 4.064 4.100 -0.036 18387 308 1 . 1 1 57 57 ALA C C 57 180.445 180.445 178.098 2.347 18387 309 1 . 1 1 57 57 ALA CA C 57 54.351 54.351 54.114 0.237 18387 310 1 . 1 1 57 57 ALA CB C 57 19.194 19.194 18.966 0.228 18387 311 1 . 1 1 57 57 ALA H H 57 7.436 7.436 7.696 -0.260 18387 312 1 . 1 1 58 58 PHE N N 58 112.082 112.082 115.019 -2.937 18387 313 1 . 1 1 58 58 PHE HA H 58 4.921 4.921 4.663 0.258 18387 314 1 . 1 1 58 58 PHE C C 58 176.999 176.999 176.531 0.468 18387 315 1 . 1 1 58 58 PHE CA C 58 58.067 58.067 57.588 0.479 18387 316 1 . 1 1 58 58 PHE CB C 58 40.490 40.490 39.586 0.904 18387 317 1 . 1 1 58 58 PHE H H 58 7.480 7.480 7.829 -0.349 18387 318 1 . 1 1 59 59 LYS N N 59 120.666 120.666 120.857 -0.191 18387 319 1 . 1 1 59 59 LYS HA H 59 4.803 4.803 4.257 0.546 18387 320 1 . 1 1 59 59 LYS C C 59 177.157 177.157 177.308 -0.151 18387 321 1 . 1 1 59 59 LYS CA C 59 59.081 59.081 58.880 0.201 18387 322 1 . 1 1 59 59 LYS CB C 59 30.568 30.568 31.824 -1.256 18387 323 1 . 1 1 59 59 LYS H H 59 8.411 8.411 7.758 0.653 18387 324 1 . 1 1 60 60 ASP N N 60 118.908 118.908 117.737 1.171 18387 325 1 . 1 1 60 60 ASP HA H 60 5.125 5.125 4.576 0.549 18387 326 1 . 1 1 60 60 ASP C C 60 176.889 176.889 176.749 0.140 18387 327 1 . 1 1 60 60 ASP CA C 60 54.649 54.649 55.660 -1.011 18387 328 1 . 1 1 60 60 ASP CB C 60 40.712 40.712 40.129 0.583 18387 329 1 . 1 1 60 60 ASP H H 60 8.574 8.574 8.575 -0.001 18387 330 1 . 1 1 61 61 LYS N N 61 121.021 121.021 119.609 1.412 18387 331 1 . 1 1 61 61 LYS HA H 61 4.714 4.714 4.502 0.212 18387 332 1 . 1 1 61 61 LYS C C 61 175.968 175.968 177.006 -1.038 18387 333 1 . 1 1 61 61 LYS CA C 61 55.137 55.137 56.170 -1.033 18387 334 1 . 1 1 61 61 LYS CB C 61 33.078 33.078 33.193 -0.115 18387 335 1 . 1 1 61 61 LYS H H 61 8.278 8.278 7.847 0.431 18387 336 1 . 1 1 62 62 GLY C C 62 173.837 173.837 173.136 0.701 18387 337 1 . 1 1 62 62 GLY CA C 62 47.050 47.050 45.221 1.829 18387 338 1 . 1 1 63 63 PHE N N 63 120.476 120.476 121.151 -0.675 18387 339 1 . 1 1 63 63 PHE HA H 63 6.033 6.033 5.710 0.323 18387 340 1 . 1 1 63 63 PHE C C 63 173.613 173.613 173.205 0.408 18387 341 1 . 1 1 63 63 PHE CA C 63 55.850 55.850 56.539 -0.689 18387 342 1 . 1 1 63 63 PHE CB C 63 42.675 42.675 42.999 -0.324 18387 343 1 . 1 1 63 63 PHE H H 63 7.413 7.413 7.924 -0.511 18387 344 1 . 1 1 64 64 THR N N 64 119.903 119.903 119.124 0.779 18387 345 1 . 1 1 64 64 THR HA H 64 4.097 4.097 4.703 -0.606 18387 346 1 . 1 1 64 64 THR C C 64 170.397 170.397 172.302 -1.905 18387 347 1 . 1 1 64 64 THR CA C 64 60.261 60.261 60.523 -0.262 18387 348 1 . 1 1 64 64 THR CB C 64 69.507 69.507 71.906 -2.399 18387 349 1 . 1 1 64 64 THR H H 64 7.665 7.665 8.430 -0.765 18387 350 1 . 1 1 65 65 ILE N N 65 117.277 117.277 124.742 -7.465 18387 351 1 . 1 1 65 65 ILE HA H 65 4.476 4.476 4.229 0.247 18387 352 1 . 1 1 65 65 ILE C C 65 173.056 173.056 174.188 -1.132 18387 353 1 . 1 1 65 65 ILE CA C 65 59.708 59.708 60.776 -1.068 18387 354 1 . 1 1 65 65 ILE CB C 65 39.845 39.845 39.024 0.821 18387 355 1 . 1 1 65 65 ILE H H 65 7.321 7.321 8.692 -1.371 18387 356 1 . 1 1 66 66 TYR N N 66 131.968 131.968 129.562 2.406 18387 357 1 . 1 1 66 66 TYR HA H 66 5.247 5.247 5.075 0.172 18387 358 1 . 1 1 66 66 TYR C C 66 174.074 174.074 174.944 -0.870 18387 359 1 . 1 1 66 66 TYR CA C 66 54.965 54.965 55.476 -0.511 18387 360 1 . 1 1 66 66 TYR CB C 66 41.117 41.117 39.686 1.431 18387 361 1 . 1 1 66 66 TYR H H 66 9.038 9.038 9.146 -0.108 18387 362 1 . 1 1 67 67 GLY N N 67 114.364 114.364 115.674 -1.310 18387 363 1 . 1 1 67 67 GLY C C 67 172.461 172.461 172.584 -0.123 18387 364 1 . 1 1 67 67 GLY CA C 67 45.000 45.000 44.529 0.471 18387 365 1 . 1 1 67 67 GLY H H 67 9.188 9.188 9.078 0.110 18387 366 1 . 1 1 68 68 VAL N N 68 126.938 126.938 124.143 2.795 18387 367 1 . 1 1 68 68 VAL HA H 68 4.136 4.136 4.755 -0.619 18387 368 1 . 1 1 68 68 VAL C C 68 173.822 173.822 174.299 -0.477 18387 369 1 . 1 1 68 68 VAL CA C 68 61.498 61.498 60.319 1.179 18387 370 1 . 1 1 68 68 VAL CB C 68 33.558 33.558 32.625 0.933 18387 371 1 . 1 1 68 68 VAL H H 68 9.309 9.309 8.960 0.349 18387 372 1 . 1 1 69 69 SER N N 69 118.813 118.813 121.838 -3.025 18387 373 1 . 1 1 69 69 SER HA H 69 5.527 5.527 5.176 0.351 18387 374 1 . 1 1 69 69 SER C C 69 175.753 175.753 173.299 2.454 18387 375 1 . 1 1 69 69 SER CA C 69 54.407 54.407 55.955 -1.548 18387 376 1 . 1 1 69 69 SER CB C 69 63.630 63.630 65.035 -1.405 18387 377 1 . 1 1 69 69 SER H H 69 8.124 8.124 8.787 -0.663 18387 378 1 . 1 1 70 70 THR N N 70 113.861 113.861 119.098 -5.237 18387 379 1 . 1 1 70 70 THR HA H 70 4.381 4.381 4.409 -0.028 18387 380 1 . 1 1 70 70 THR C C 70 175.001 175.001 173.274 1.727 18387 381 1 . 1 1 70 70 THR CA C 70 60.259 60.259 59.905 0.354 18387 382 1 . 1 1 70 70 THR CB C 70 67.291 67.291 68.751 -1.460 18387 383 1 . 1 1 70 70 THR H H 70 7.656 7.656 8.096 -0.440 18387 384 1 . 1 1 71 71 ASP N N 71 125.133 125.133 122.290 2.843 18387 385 1 . 1 1 71 71 ASP HA H 71 4.070 4.070 4.472 -0.402 18387 386 1 . 1 1 71 71 ASP C C 71 175.685 175.685 176.858 -1.173 18387 387 1 . 1 1 71 71 ASP CA C 71 57.612 57.612 54.954 2.658 18387 388 1 . 1 1 71 71 ASP CB C 71 42.369 42.369 41.909 0.460 18387 389 1 . 1 1 71 71 ASP H H 71 8.931 8.931 7.558 1.373 18387 390 1 . 1 1 72 72 ARG N N 72 118.814 118.814 119.237 -0.423 18387 391 1 . 1 1 72 72 ARG HA H 72 4.195 4.195 4.129 0.066 18387 392 1 . 1 1 72 72 ARG C C 72 177.300 177.300 176.610 0.690 18387 393 1 . 1 1 72 72 ARG CA C 72 56.809 56.809 57.609 -0.800 18387 394 1 . 1 1 72 72 ARG CB C 72 31.111 31.111 30.596 0.515 18387 395 1 . 1 1 72 72 ARG H H 72 8.057 8.057 8.499 -0.442 18387 396 1 . 1 1 73 73 ARG N N 73 118.174 118.174 117.854 0.320 18387 397 1 . 1 1 73 73 ARG HA H 73 4.754 4.754 4.569 0.185 18387 398 1 . 1 1 73 73 ARG C C 73 176.503 176.503 175.839 0.664 18387 399 1 . 1 1 73 73 ARG CA C 73 54.536 54.536 54.892 -0.356 18387 400 1 . 1 1 73 73 ARG CB C 73 31.028 31.028 32.527 -1.499 18387 401 1 . 1 1 73 73 ARG H H 73 8.639 8.639 7.713 0.926 18387 402 1 . 1 1 74 74 GLU N N 74 127.609 127.609 123.981 3.628 18387 403 1 . 1 1 74 74 GLU HA H 74 4.079 4.079 4.174 -0.095 18387 404 1 . 1 1 74 74 GLU C C 74 178.107 178.107 177.873 0.234 18387 405 1 . 1 1 74 74 GLU CA C 74 59.785 59.785 60.277 -0.492 18387 406 1 . 1 1 74 74 GLU CB C 74 30.098 30.098 29.885 0.213 18387 407 1 . 1 1 74 74 GLU H H 74 9.129 9.129 8.986 0.143 18387 408 1 . 1 1 75 75 GLU N N 75 117.874 117.874 119.019 -1.145 18387 409 1 . 1 1 75 75 GLU HA H 75 4.100 4.100 4.116 -0.016 18387 410 1 . 1 1 75 75 GLU C C 75 178.993 178.993 178.652 0.341 18387 411 1 . 1 1 75 75 GLU CA C 75 60.127 60.127 59.777 0.350 18387 412 1 . 1 1 75 75 GLU CB C 75 29.291 29.291 28.799 0.492 18387 413 1 . 1 1 75 75 GLU H H 75 9.745 9.745 8.809 0.936 18387 414 1 . 1 1 76 76 ASP N N 76 119.182 119.182 119.790 -0.608 18387 415 1 . 1 1 76 76 ASP HA H 76 4.366 4.366 4.471 -0.105 18387 416 1 . 1 1 76 76 ASP C C 76 178.107 178.107 178.076 0.031 18387 417 1 . 1 1 76 76 ASP CA C 76 56.973 56.973 57.372 -0.399 18387 418 1 . 1 1 76 76 ASP CB C 76 40.520 40.520 40.458 0.062 18387 419 1 . 1 1 76 76 ASP H H 76 7.004 7.004 8.440 -1.436 18387 420 1 . 1 1 77 77 TRP N N 77 123.008 123.008 122.891 0.117 18387 421 1 . 1 1 77 77 TRP HA H 77 4.149 4.149 4.266 -0.117 18387 422 1 . 1 1 77 77 TRP C C 77 176.236 176.236 178.005 -1.769 18387 423 1 . 1 1 77 77 TRP CA C 77 60.483 60.483 60.999 -0.516 18387 424 1 . 1 1 77 77 TRP CB C 77 28.535 28.535 29.237 -0.702 18387 425 1 . 1 1 77 77 TRP H H 77 7.112 7.112 8.134 -1.022 18387 426 1 . 1 1 78 78 LYS N N 78 115.727 115.727 118.395 -2.668 18387 427 1 . 1 1 78 78 LYS HA H 78 3.245 3.245 3.431 -0.186 18387 428 1 . 1 1 78 78 LYS C C 78 179.426 179.426 178.890 0.536 18387 429 1 . 1 1 78 78 LYS CA C 78 60.432 60.432 59.389 1.043 18387 430 1 . 1 1 78 78 LYS CB C 78 32.745 32.745 31.745 1.000 18387 431 1 . 1 1 78 78 LYS H H 78 8.431 8.431 8.482 -0.051 18387 432 1 . 1 1 79 79 LYS N N 79 118.321 118.321 119.602 -1.281 18387 433 1 . 1 1 79 79 LYS HA H 79 4.020 4.020 3.964 0.056 18387 434 1 . 1 1 79 79 LYS C C 79 178.239 178.239 178.575 -0.336 18387 435 1 . 1 1 79 79 LYS CA C 79 59.067 59.067 59.262 -0.195 18387 436 1 . 1 1 79 79 LYS CB C 79 32.463 32.463 32.452 0.011 18387 437 1 . 1 1 79 79 LYS H H 79 7.690 7.690 7.979 -0.289 18387 438 1 . 1 1 80 80 ALA N N 80 120.679 120.679 122.223 -1.544 18387 439 1 . 1 1 80 80 ALA HA H 80 4.155 4.155 4.330 -0.175 18387 440 1 . 1 1 80 80 ALA C C 80 178.811 178.811 179.920 -1.109 18387 441 1 . 1 1 80 80 ALA CA C 80 55.087 55.087 55.010 0.077 18387 442 1 . 1 1 80 80 ALA CB C 80 18.758 18.758 18.487 0.271 18387 443 1 . 1 1 80 80 ALA H H 80 7.560 7.560 8.246 -0.686 18387 444 1 . 1 1 81 81 ILE N N 81 118.019 118.019 118.875 -0.856 18387 445 1 . 1 1 81 81 ILE HA H 81 3.402 3.402 3.583 -0.181 18387 446 1 . 1 1 81 81 ILE C C 81 178.113 178.113 178.162 -0.049 18387 447 1 . 1 1 81 81 ILE CA C 81 64.520 64.520 64.337 0.183 18387 448 1 . 1 1 81 81 ILE CB C 81 38.204 38.204 37.279 0.925 18387 449 1 . 1 1 81 81 ILE H H 81 7.514 7.514 7.977 -0.463 18387 450 1 . 1 1 82 82 GLU N N 82 117.252 117.252 120.002 -2.750 18387 451 1 . 1 1 82 82 GLU HA H 82 4.094 4.094 3.885 0.209 18387 452 1 . 1 1 82 82 GLU C C 82 179.558 179.558 178.550 1.008 18387 453 1 . 1 1 82 82 GLU CA C 82 58.580 58.580 58.890 -0.310 18387 454 1 . 1 1 82 82 GLU CB C 82 29.383 29.383 29.119 0.264 18387 455 1 . 1 1 82 82 GLU H H 82 7.401 7.401 7.687 -0.286 18387 456 1 . 1 1 83 83 GLU N N 83 119.340 119.340 118.913 0.427 18387 457 1 . 1 1 83 83 GLU HA H 83 3.898 3.898 4.026 -0.128 18387 458 1 . 1 1 83 83 GLU C C 83 178.740 178.740 178.557 0.183 18387 459 1 . 1 1 83 83 GLU CA C 83 58.999 58.999 58.855 0.144 18387 460 1 . 1 1 83 83 GLU CB C 83 29.920 29.920 29.759 0.162 18387 461 1 . 1 1 83 83 GLU H H 83 8.191 8.191 7.989 0.202 18387 462 1 . 1 1 84 84 ASP N N 84 118.449 118.449 116.012 2.437 18387 463 1 . 1 1 84 84 ASP HA H 84 4.274 4.274 4.476 -0.202 18387 464 1 . 1 1 84 84 ASP C C 84 175.597 175.597 175.852 -0.255 18387 465 1 . 1 1 84 84 ASP CA C 84 55.047 55.047 54.529 0.518 18387 466 1 . 1 1 84 84 ASP CB C 84 39.896 39.896 41.096 -1.200 18387 467 1 . 1 1 84 84 ASP H H 84 8.252 8.252 7.973 0.279 18387 468 1 . 1 1 85 85 LYS N N 85 116.410 116.410 115.470 0.940 18387 469 1 . 1 1 85 85 LYS HA H 85 3.173 3.173 3.370 -0.197 18387 470 1 . 1 1 85 85 LYS C C 85 176.856 176.856 175.284 1.572 18387 471 1 . 1 1 85 85 LYS CA C 85 55.973 55.973 56.496 -0.523 18387 472 1 . 1 1 85 85 LYS CB C 85 28.868 28.868 29.362 -0.494 18387 473 1 . 1 1 85 85 LYS H H 85 7.890 7.890 7.660 0.230 18387 474 1 . 1 1 86 86 SER N N 86 112.295 112.295 114.271 -1.976 18387 475 1 . 1 1 86 86 SER HA H 86 3.139 3.139 3.618 -0.479 18387 476 1 . 1 1 86 86 SER C C 86 175.805 175.805 172.916 2.889 18387 477 1 . 1 1 86 86 SER CA C 86 53.637 53.637 57.175 -3.538 18387 478 1 . 1 1 86 86 SER CB C 86 60.736 60.736 61.370 -0.634 18387 479 1 . 1 1 86 86 SER H H 86 7.327 7.327 7.410 -0.083 18387 480 1 . 1 1 87 87 TYR N N 87 120.962 120.962 125.634 -4.672 18387 481 1 . 1 1 87 87 TYR HA H 87 4.305 4.305 4.200 0.105 18387 482 1 . 1 1 87 87 TYR C C 87 177.064 177.064 174.499 2.565 18387 483 1 . 1 1 87 87 TYR CA C 87 57.223 57.223 57.736 -0.513 18387 484 1 . 1 1 87 87 TYR CB C 87 36.353 36.353 36.939 -0.586 18387 485 1 . 1 1 87 87 TYR H H 87 6.933 6.933 7.584 -0.651 18387 486 1 . 1 1 88 88 TRP N N 88 118.597 118.597 121.054 -2.457 18387 487 1 . 1 1 88 88 TRP HA H 88 4.851 4.851 4.662 0.189 18387 488 1 . 1 1 88 88 TRP C C 88 175.456 175.456 174.475 0.981 18387 489 1 . 1 1 88 88 TRP CA C 88 56.236 56.236 54.874 1.362 18387 490 1 . 1 1 88 88 TRP CB C 88 25.727 25.727 29.432 -3.705 18387 491 1 . 1 1 88 88 TRP H H 88 6.552 6.552 7.164 -0.612 18387 492 1 . 1 1 89 89 ASN N N 89 118.067 118.067 120.876 -2.809 18387 493 1 . 1 1 89 89 ASN HA H 89 5.049 5.049 4.752 0.297 18387 494 1 . 1 1 89 89 ASN C C 89 173.773 173.773 174.663 -0.890 18387 495 1 . 1 1 89 89 ASN CA C 89 55.456 55.456 53.689 1.767 18387 496 1 . 1 1 89 89 ASN CB C 89 39.197 39.197 37.977 1.221 18387 497 1 . 1 1 89 89 ASN H H 89 7.864 7.864 8.639 -0.775 18387 498 1 . 1 1 90 90 GLN N N 90 125.392 125.392 122.175 3.217 18387 499 1 . 1 1 90 90 GLN HA H 90 5.497 5.497 5.268 0.229 18387 500 1 . 1 1 90 90 GLN C C 90 176.491 176.491 175.204 1.286 18387 501 1 . 1 1 90 90 GLN CA C 90 55.460 55.460 54.840 0.619 18387 502 1 . 1 1 90 90 GLN CB C 90 31.227 31.227 32.123 -0.896 18387 503 1 . 1 1 90 90 GLN H H 90 7.904 7.904 8.266 -0.362 18387 504 1 . 1 1 91 91 VAL N N 91 114.434 114.434 117.522 -3.088 18387 505 1 . 1 1 91 91 VAL HA H 91 5.480 5.480 4.935 0.545 18387 506 1 . 1 1 91 91 VAL C C 91 174.248 174.248 172.964 1.285 18387 507 1 . 1 1 91 91 VAL CA C 91 59.006 59.006 59.444 -0.438 18387 508 1 . 1 1 91 91 VAL CB C 91 36.638 36.638 35.367 1.271 18387 509 1 . 1 1 91 91 VAL H H 91 9.585 9.585 9.129 0.456 18387 510 1 . 1 1 92 92 LEU N N 92 126.910 126.910 124.960 1.950 18387 511 1 . 1 1 92 92 LEU HA H 92 4.069 4.069 4.406 -0.337 18387 512 1 . 1 1 92 92 LEU C C 92 177.696 177.696 175.729 1.967 18387 513 1 . 1 1 92 92 LEU CA C 92 52.844 52.844 52.339 0.505 18387 514 1 . 1 1 92 92 LEU CB C 92 42.947 42.947 43.060 -0.113 18387 515 1 . 1 1 92 92 LEU H H 92 8.941 8.941 8.476 0.465 18387 516 1 . 1 1 93 93 LEU N N 93 125.673 125.673 127.807 -2.134 18387 517 1 . 1 1 93 93 LEU HA H 93 4.400 4.400 4.254 0.146 18387 518 1 . 1 1 93 93 LEU C C 93 177.291 177.291 176.685 0.606 18387 519 1 . 1 1 93 93 LEU CA C 93 54.951 54.951 55.401 -0.450 18387 520 1 . 1 1 93 93 LEU CB C 93 43.179 43.179 41.778 1.401 18387 521 1 . 1 1 93 93 LEU H H 93 8.038 8.038 8.558 -0.520 18387 522 1 . 1 1 94 94 GLN N N 94 122.206 122.206 122.193 0.013 18387 523 1 . 1 1 94 94 GLN HA H 94 4.237 4.237 4.218 0.019 18387 524 1 . 1 1 94 94 GLN C C 94 178.246 178.246 176.805 1.441 18387 525 1 . 1 1 94 94 GLN CA C 94 55.775 55.775 55.765 0.010 18387 526 1 . 1 1 94 94 GLN CB C 94 29.255 29.255 29.625 -0.370 18387 527 1 . 1 1 94 94 GLN H H 94 9.298 9.298 8.375 0.923 18387 528 1 . 1 1 95 95 LYS N N 95 122.668 122.668 121.699 0.969 18387 529 1 . 1 1 95 95 LYS HA H 95 3.966 3.966 3.965 0.001 18387 530 1 . 1 1 95 95 LYS C C 95 178.787 178.787 177.864 0.923 18387 531 1 . 1 1 95 95 LYS CA C 95 60.072 60.072 59.272 0.800 18387 532 1 . 1 1 95 95 LYS CB C 95 32.465 32.465 31.941 0.524 18387 533 1 . 1 1 95 95 LYS H H 95 8.645 8.645 8.759 -0.114 18387 534 1 . 1 1 96 96 ASP N N 96 116.775 116.775 118.065 -1.290 18387 535 1 . 1 1 96 96 ASP HA H 96 4.580 4.580 4.547 0.033 18387 536 1 . 1 1 96 96 ASP C C 96 176.220 176.220 177.914 -1.694 18387 537 1 . 1 1 96 96 ASP CA C 96 56.346 56.346 56.560 -0.214 18387 538 1 . 1 1 96 96 ASP CB C 96 40.557 40.557 40.525 0.032 18387 539 1 . 1 1 96 96 ASP H H 96 8.606 8.606 8.257 0.349 18387 540 1 . 1 1 97 97 ASP N N 97 118.213 118.213 120.810 -2.597 18387 541 1 . 1 1 97 97 ASP HA H 97 4.927 4.927 4.403 0.524 18387 542 1 . 1 1 97 97 ASP C C 97 176.954 176.954 178.194 -1.241 18387 543 1 . 1 1 97 97 ASP CA C 97 55.359 55.359 56.884 -1.525 18387 544 1 . 1 1 97 97 ASP CB C 97 42.324 42.324 40.806 1.518 18387 545 1 . 1 1 97 97 ASP H H 97 7.988 7.988 8.118 -0.130 18387 546 1 . 1 1 98 98 VAL N N 98 118.907 118.907 119.671 -0.764 18387 547 1 . 1 1 98 98 VAL HA H 98 3.416 3.416 3.550 -0.134 18387 548 1 . 1 1 98 98 VAL C C 98 176.470 176.470 177.715 -1.245 18387 549 1 . 1 1 98 98 VAL CA C 98 67.778 67.778 66.502 1.276 18387 550 1 . 1 1 98 98 VAL CB C 98 32.391 32.391 31.439 0.952 18387 551 1 . 1 1 98 98 VAL H H 98 7.098 7.098 8.434 -1.336 18387 552 1 . 1 1 99 99 LYS N N 99 117.909 117.909 119.562 -1.653 18387 553 1 . 1 1 99 99 LYS HA H 99 3.943 3.943 3.909 0.034 18387 554 1 . 1 1 99 99 LYS C C 99 178.762 178.762 178.503 0.259 18387 555 1 . 1 1 99 99 LYS CA C 99 60.145 60.145 59.878 0.267 18387 556 1 . 1 1 99 99 LYS CB C 99 32.012 32.012 31.916 0.096 18387 557 1 . 1 1 99 99 LYS H H 99 8.304 8.304 7.632 0.672 18387 558 1 . 1 1 100 100 ASP N N 100 117.843 117.843 119.152 -1.309 18387 559 1 . 1 1 100 100 ASP HA H 100 4.478 4.478 4.430 0.048 18387 560 1 . 1 1 100 100 ASP C C 100 179.694 179.694 178.816 0.878 18387 561 1 . 1 1 100 100 ASP CA C 100 57.526 57.526 57.337 0.189 18387 562 1 . 1 1 100 100 ASP CB C 100 40.828 40.828 40.662 0.166 18387 563 1 . 1 1 100 100 ASP H H 100 8.024 8.024 7.764 0.260 18387 564 1 . 1 1 101 101 VAL N N 101 122.202 122.202 120.622 1.580 18387 565 1 . 1 1 101 101 VAL HA H 101 3.995 3.995 3.743 0.252 18387 566 1 . 1 1 101 101 VAL C C 101 178.533 178.533 178.073 0.460 18387 567 1 . 1 1 101 101 VAL CA C 101 67.002 67.002 66.580 0.422 18387 568 1 . 1 1 101 101 VAL CB C 101 32.037 32.037 31.726 0.310 18387 569 1 . 1 1 101 101 VAL H H 101 8.205 8.205 7.906 0.299 18387 570 1 . 1 1 102 102 LEU N N 102 118.798 118.798 119.257 -0.459 18387 571 1 . 1 1 102 102 LEU HA H 102 3.780 3.780 3.761 0.019 18387 572 1 . 1 1 102 102 LEU C C 102 180.254 180.254 178.982 1.272 18387 573 1 . 1 1 102 102 LEU CA C 102 58.941 58.941 57.986 0.955 18387 574 1 . 1 1 102 102 LEU CB C 102 40.439 40.439 41.363 -0.924 18387 575 1 . 1 1 102 102 LEU H H 102 8.422 8.422 8.008 0.414 18387 576 1 . 1 1 103 103 GLU N N 103 116.915 116.915 119.697 -2.783 18387 577 1 . 1 1 103 103 GLU HA H 103 4.135 4.135 3.945 0.190 18387 578 1 . 1 1 103 103 GLU C C 103 180.910 180.910 179.355 1.555 18387 579 1 . 1 1 103 103 GLU CA C 103 59.403 59.403 59.173 0.230 18387 580 1 . 1 1 103 103 GLU CB C 103 29.731 29.731 29.400 0.331 18387 581 1 . 1 1 103 103 GLU H H 103 8.262 8.262 7.972 0.290 18387 582 1 . 1 1 104 104 SER N N 104 117.866 117.866 116.088 1.778 18387 583 1 . 1 1 104 104 SER HA H 104 4.216 4.216 4.130 0.086 18387 584 1 . 1 1 104 104 SER C C 104 175.455 175.455 176.351 -0.896 18387 585 1 . 1 1 104 104 SER CA C 104 62.019 62.019 61.568 0.451 18387 586 1 . 1 1 104 104 SER CB C 104 62.891 62.891 63.117 -0.226 18387 587 1 . 1 1 104 104 SER H H 104 8.544 8.544 8.167 0.377 18387 588 1 . 1 1 105 105 TYR N N 105 117.278 117.278 118.443 -1.165 18387 589 1 . 1 1 105 105 TYR HA H 105 4.272 4.272 4.450 -0.178 18387 590 1 . 1 1 105 105 TYR C C 105 174.750 174.750 175.207 -0.457 18387 591 1 . 1 1 105 105 TYR CA C 105 59.859 59.859 58.366 1.493 18387 592 1 . 1 1 105 105 TYR CB C 105 39.711 39.711 37.583 2.128 18387 593 1 . 1 1 105 105 TYR H H 105 7.691 7.691 7.608 0.083 18387 594 1 . 1 1 106 106 CYS N N 106 116.897 116.897 116.738 0.159 18387 595 1 . 1 1 106 106 CYS HA H 106 3.895 3.895 4.060 -0.165 18387 596 1 . 1 1 106 106 CYS C C 106 174.056 174.056 173.583 0.473 18387 597 1 . 1 1 106 106 CYS CA C 106 59.610 59.610 59.969 -0.359 18387 598 1 . 1 1 106 106 CYS CB C 106 25.032 25.032 25.153 -0.121 18387 599 1 . 1 1 106 106 CYS H H 106 7.862 7.862 8.274 -0.412 18387 600 1 . 1 1 107 107 ILE N N 107 118.885 118.885 121.335 -2.450 18387 601 1 . 1 1 107 107 ILE HA H 107 3.339 3.339 3.775 -0.436 18387 602 1 . 1 1 107 107 ILE C C 107 176.793 176.793 175.295 1.498 18387 603 1 . 1 1 107 107 ILE CA C 107 62.745 62.745 60.493 2.252 18387 604 1 . 1 1 107 107 ILE CB C 107 38.079 38.079 36.748 1.331 18387 605 1 . 1 1 107 107 ILE H H 107 7.707 7.707 7.825 -0.118 18387 606 1 . 1 1 108 108 VAL N N 108 123.983 123.983 124.299 -0.316 18387 607 1 . 1 1 108 108 VAL HA H 108 4.274 4.274 4.203 0.071 18387 608 1 . 1 1 108 108 VAL C C 108 175.476 175.476 175.539 -0.063 18387 609 1 . 1 1 108 108 VAL CA C 108 61.624 61.624 61.768 -0.144 18387 610 1 . 1 1 108 108 VAL CB C 108 33.008 33.008 32.531 0.477 18387 611 1 . 1 1 108 108 VAL H H 108 8.656 8.656 8.127 0.529 18387 612 1 . 1 1 109 109 GLY N N 109 110.120 110.120 107.577 2.543 18387 613 1 . 1 1 109 109 GLY C C 109 169.982 169.982 172.197 -2.215 18387 614 1 . 1 1 109 109 GLY CA C 109 44.603 44.603 45.030 -0.427 18387 615 1 . 1 1 109 109 GLY H H 109 7.500 7.500 7.325 0.175 18387 616 1 . 1 1 110 110 PHE N N 110 115.276 115.276 119.017 -3.741 18387 617 1 . 1 1 110 110 PHE HA H 110 4.774 4.774 5.176 -0.402 18387 618 1 . 1 1 110 110 PHE C C 110 174.361 174.361 174.301 0.060 18387 619 1 . 1 1 110 110 PHE CA C 110 55.687 55.687 55.503 0.184 18387 620 1 . 1 1 110 110 PHE CB C 110 41.951 41.951 41.178 0.773 18387 621 1 . 1 1 110 110 PHE H H 110 8.203 8.203 8.400 -0.197 18387 622 1 . 1 1 111 111 PRO HA H 111 5.359 5.359 5.009 0.350 18387 623 1 . 1 1 111 111 PRO C C 111 175.691 175.691 175.596 0.095 18387 624 1 . 1 1 111 111 PRO CA C 111 63.157 63.157 62.856 0.301 18387 625 1 . 1 1 111 111 PRO CB C 111 35.304 35.304 33.268 2.036 18387 626 1 . 1 1 112 112 HIS N N 112 123.708 123.708 119.525 4.183 18387 627 1 . 1 1 112 112 HIS HA H 112 4.963 4.963 4.961 0.002 18387 628 1 . 1 1 112 112 HIS C C 112 173.649 173.649 173.829 -0.180 18387 629 1 . 1 1 112 112 HIS CA C 112 57.074 57.074 55.896 1.178 18387 630 1 . 1 1 112 112 HIS CB C 112 32.197 32.197 32.341 -0.144 18387 631 1 . 1 1 112 112 HIS H H 112 8.952 8.952 8.554 0.398 18387 632 1 . 1 1 113 113 ILE N N 113 128.596 128.596 126.303 2.293 18387 633 1 . 1 1 113 113 ILE HA H 113 5.697 5.697 5.138 0.559 18387 634 1 . 1 1 113 113 ILE C C 113 176.130 176.130 174.536 1.594 18387 635 1 . 1 1 113 113 ILE CA C 113 60.995 60.995 60.166 0.829 18387 636 1 . 1 1 113 113 ILE CB C 113 38.055 38.055 40.255 -2.200 18387 637 1 . 1 1 113 113 ILE H H 113 8.808 8.808 8.526 0.282 18387 638 1 . 1 1 114 114 ILE N N 114 119.668 119.668 121.396 -1.728 18387 639 1 . 1 1 114 114 ILE HA H 114 4.973 4.973 4.924 0.049 18387 640 1 . 1 1 114 114 ILE C C 114 173.186 173.186 173.514 -0.328 18387 641 1 . 1 1 114 114 ILE CA C 114 58.730 58.730 58.816 -0.086 18387 642 1 . 1 1 114 114 ILE CB C 114 42.540 42.540 42.151 0.389 18387 643 1 . 1 1 114 114 ILE H H 114 8.721 8.721 8.888 -0.167 18387 644 1 . 1 1 115 115 LEU N N 115 122.770 122.770 124.851 -2.081 18387 645 1 . 1 1 115 115 LEU HA H 115 5.275 5.275 5.144 0.131 18387 646 1 . 1 1 115 115 LEU C C 115 173.601 173.601 174.842 -1.241 18387 647 1 . 1 1 115 115 LEU CA C 115 53.782 53.782 53.327 0.455 18387 648 1 . 1 1 115 115 LEU CB C 115 46.134 46.134 44.613 1.521 18387 649 1 . 1 1 115 115 LEU H H 115 8.665 8.665 8.947 -0.282 18387 650 1 . 1 1 116 116 VAL N N 116 130.411 130.411 126.292 4.119 18387 651 1 . 1 1 116 116 VAL HA H 116 4.858 4.858 5.011 -0.153 18387 652 1 . 1 1 116 116 VAL C C 116 174.565 174.565 175.446 -0.881 18387 653 1 . 1 1 116 116 VAL CA C 116 60.804 60.804 60.165 0.639 18387 654 1 . 1 1 116 116 VAL CB C 116 33.915 33.915 34.123 -0.208 18387 655 1 . 1 1 116 116 VAL H H 116 9.472 9.472 9.223 0.249 18387 656 1 . 1 1 117 117 ASP N N 117 127.896 127.896 126.480 1.416 18387 657 1 . 1 1 117 117 ASP HA H 117 4.392 4.392 4.697 -0.305 18387 658 1 . 1 1 117 117 ASP C C 117 176.567 176.567 175.915 0.652 18387 659 1 . 1 1 117 117 ASP CA C 117 52.600 52.600 52.393 0.207 18387 660 1 . 1 1 117 117 ASP CB C 117 40.584 40.584 40.507 0.077 18387 661 1 . 1 1 117 117 ASP H H 117 9.429 9.429 8.724 0.705 18387 662 1 . 1 1 118 118 PRO HA H 118 4.194 4.194 4.286 -0.092 18387 663 1 . 1 1 118 118 PRO C C 118 177.534 177.534 177.884 -0.350 18387 664 1 . 1 1 118 118 PRO CA C 118 65.165 65.165 65.126 0.039 18387 665 1 . 1 1 118 118 PRO CB C 118 32.813 32.813 31.839 0.974 18387 666 1 . 1 1 119 119 GLU N N 119 114.015 114.015 116.625 -2.610 18387 667 1 . 1 1 119 119 GLU HA H 119 4.339 4.339 4.182 0.157 18387 668 1 . 1 1 119 119 GLU C C 119 176.722 176.722 177.246 -0.524 18387 669 1 . 1 1 119 119 GLU CA C 119 55.639 55.639 57.189 -1.550 18387 670 1 . 1 1 119 119 GLU CB C 119 30.577 30.577 29.992 0.585 18387 671 1 . 1 1 119 119 GLU H H 119 7.733 7.733 8.383 -0.650 18387 672 1 . 1 1 120 120 GLY N N 120 108.218 108.218 106.895 1.323 18387 673 1 . 1 1 120 120 GLY C C 120 174.110 174.110 173.159 0.951 18387 674 1 . 1 1 120 120 GLY CA C 120 45.396 45.396 45.017 0.379 18387 675 1 . 1 1 120 120 GLY H H 120 8.588 8.588 8.325 0.263 18387 676 1 . 1 1 121 121 LYS N N 121 121.778 121.778 119.802 1.976 18387 677 1 . 1 1 121 121 LYS HA H 121 4.859 4.859 5.079 -0.220 18387 678 1 . 1 1 121 121 LYS C C 121 176.458 176.458 175.731 0.727 18387 679 1 . 1 1 121 121 LYS CA C 121 54.962 54.962 54.283 0.679 18387 680 1 . 1 1 121 121 LYS CB C 121 33.452 33.452 35.380 -1.928 18387 681 1 . 1 1 121 121 LYS H H 121 8.600 8.600 8.570 0.029 18387 682 1 . 1 1 122 122 ILE N N 122 122.058 122.058 124.639 -2.581 18387 683 1 . 1 1 122 122 ILE HA H 122 4.272 4.272 4.331 -0.059 18387 684 1 . 1 1 122 122 ILE C C 122 177.084 177.084 176.722 0.362 18387 685 1 . 1 1 122 122 ILE CA C 122 62.819 62.819 62.392 0.427 18387 686 1 . 1 1 122 122 ILE CB C 122 38.648 38.648 36.929 1.719 18387 687 1 . 1 1 122 122 ILE H H 122 9.006 9.006 8.983 0.023 18387 688 1 . 1 1 123 123 VAL N N 123 120.561 120.561 128.055 -7.494 18387 689 1 . 1 1 123 123 VAL HA H 123 4.755 4.755 4.089 0.666 18387 690 1 . 1 1 123 123 VAL C C 123 175.584 175.584 175.194 0.390 18387 691 1 . 1 1 123 123 VAL CA C 123 61.151 61.151 63.289 -2.138 18387 692 1 . 1 1 123 123 VAL CB C 123 33.401 33.401 32.422 0.979 18387 693 1 . 1 1 123 123 VAL H H 123 9.054 9.054 8.526 0.528 18387 694 1 . 1 1 124 124 ALA N N 124 121.102 121.102 120.858 0.244 18387 695 1 . 1 1 124 124 ALA HA H 124 4.657 4.657 4.714 -0.057 18387 696 1 . 1 1 124 124 ALA C C 124 174.832 174.832 174.798 0.034 18387 697 1 . 1 1 124 124 ALA CA C 124 52.460 52.460 51.454 1.006 18387 698 1 . 1 1 124 124 ALA CB C 124 22.830 22.830 21.322 1.508 18387 699 1 . 1 1 124 124 ALA H H 124 7.793 7.793 7.509 0.284 18387 700 1 . 1 1 125 125 LYS N N 125 117.637 117.637 120.454 -2.817 18387 701 1 . 1 1 125 125 LYS HA H 125 5.033 5.033 4.686 0.347 18387 702 1 . 1 1 125 125 LYS C C 125 173.417 173.417 175.617 -2.200 18387 703 1 . 1 1 125 125 LYS CA C 125 55.141 55.141 55.394 -0.253 18387 704 1 . 1 1 125 125 LYS CB C 125 36.651 36.651 35.399 1.252 18387 705 1 . 1 1 125 125 LYS H H 125 8.872 8.872 8.303 0.569 18387 706 1 . 1 1 126 126 GLU N N 126 115.236 115.236 116.711 -1.475 18387 707 1 . 1 1 126 126 GLU HA H 126 3.998 3.998 3.931 0.067 18387 708 1 . 1 1 126 126 GLU C C 126 175.998 175.998 175.752 0.246 18387 709 1 . 1 1 126 126 GLU CA C 126 56.962 56.962 57.454 -0.491 18387 710 1 . 1 1 126 126 GLU CB C 126 26.435 26.435 27.355 -0.920 18387 711 1 . 1 1 126 126 GLU H H 126 7.941 7.941 8.579 -0.638 18387 712 1 . 1 1 127 127 LEU N N 127 118.584 118.584 119.263 -0.679 18387 713 1 . 1 1 127 127 LEU HA H 127 4.382 4.382 4.262 0.120 18387 714 1 . 1 1 127 127 LEU C C 127 176.766 176.766 176.478 0.288 18387 715 1 . 1 1 127 127 LEU CA C 127 54.609 54.609 55.113 -0.504 18387 716 1 . 1 1 127 127 LEU CB C 127 43.963 43.963 42.578 1.385 18387 717 1 . 1 1 127 127 LEU H H 127 7.300 7.300 7.595 -0.295 18387 718 1 . 1 1 128 128 ARG N N 128 118.625 118.625 120.086 -1.461 18387 719 1 . 1 1 128 128 ARG HA H 128 4.475 4.475 4.659 -0.184 18387 720 1 . 1 1 128 128 ARG C C 128 177.113 177.113 177.221 -0.108 18387 721 1 . 1 1 128 128 ARG CA C 128 53.390 53.390 54.046 -0.656 18387 722 1 . 1 1 128 128 ARG CB C 128 34.612 34.612 32.717 1.895 18387 723 1 . 1 1 128 128 ARG H H 128 7.929 7.929 8.240 -0.311 18387 724 1 . 1 1 129 129 GLY N N 129 114.010 114.010 111.972 2.038 18387 725 1 . 1 1 129 129 GLY C C 129 175.931 175.931 174.894 1.037 18387 726 1 . 1 1 129 129 GLY CA C 129 45.461 45.461 46.850 -1.389 18387 727 1 . 1 1 129 129 GLY H H 129 10.649 10.649 9.196 1.454 18387 728 1 . 1 1 130 130 ASP N N 130 123.975 123.975 121.626 2.349 18387 729 1 . 1 1 130 130 ASP HA H 130 4.532 4.532 4.201 0.331 18387 730 1 . 1 1 130 130 ASP C C 130 177.507 177.507 177.582 -0.075 18387 731 1 . 1 1 130 130 ASP CA C 130 57.372 57.372 56.733 0.639 18387 732 1 . 1 1 130 130 ASP CB C 130 40.903 40.903 40.492 0.411 18387 733 1 . 1 1 130 130 ASP H H 130 8.540 8.540 8.219 0.321 18387 734 1 . 1 1 131 131 ASP N N 131 116.806 116.806 120.807 -4.001 18387 735 1 . 1 1 131 131 ASP HA H 131 4.570 4.570 4.400 0.170 18387 736 1 . 1 1 131 131 ASP C C 131 179.038 179.038 178.304 0.734 18387 737 1 . 1 1 131 131 ASP CA C 131 56.983 56.983 57.016 -0.033 18387 738 1 . 1 1 131 131 ASP CB C 131 40.934 40.934 40.771 0.163 18387 739 1 . 1 1 131 131 ASP H H 131 7.907 7.907 7.919 -0.012 18387 740 1 . 1 1 132 132 LEU N N 132 123.869 123.869 119.606 4.263 18387 741 1 . 1 1 132 132 LEU HA H 132 3.791 3.791 3.963 -0.172 18387 742 1 . 1 1 132 132 LEU C C 132 176.343 176.343 178.453 -2.110 18387 743 1 . 1 1 132 132 LEU CA C 132 59.784 59.784 58.410 1.374 18387 744 1 . 1 1 132 132 LEU CB C 132 41.768 41.768 41.170 0.597 18387 745 1 . 1 1 132 132 LEU H H 132 7.542 7.542 8.019 -0.477 18387 746 1 . 1 1 133 133 TYR N N 133 120.042 120.042 119.724 0.318 18387 747 1 . 1 1 133 133 TYR HA H 133 3.996 3.996 4.081 -0.085 18387 748 1 . 1 1 133 133 TYR C C 133 177.426 177.426 177.447 -0.021 18387 749 1 . 1 1 133 133 TYR CA C 133 62.133 62.133 62.029 0.104 18387 750 1 . 1 1 133 133 TYR CB C 133 38.576 38.576 38.562 0.014 18387 751 1 . 1 1 133 133 TYR H H 133 7.384 7.384 7.689 -0.305 18387 752 1 . 1 1 134 134 ASN N N 134 114.936 114.936 116.906 -1.970 18387 753 1 . 1 1 134 134 ASN HA H 134 4.403 4.403 4.425 -0.022 18387 754 1 . 1 1 134 134 ASN C C 134 178.703 178.703 177.965 0.738 18387 755 1 . 1 1 134 134 ASN CA C 134 55.809 55.809 56.564 -0.755 18387 756 1 . 1 1 134 134 ASN CB C 134 38.208 38.208 38.187 0.021 18387 757 1 . 1 1 134 134 ASN H H 134 8.399 8.399 8.448 -0.049 18387 758 1 . 1 1 135 135 THR N N 135 117.387 117.387 117.270 0.117 18387 759 1 . 1 1 135 135 THR HA H 135 3.920 3.920 3.964 -0.044 18387 760 1 . 1 1 135 135 THR C C 135 175.323 175.323 176.362 -1.039 18387 761 1 . 1 1 135 135 THR CA C 135 67.402 67.402 66.692 0.710 18387 762 1 . 1 1 135 135 THR CB C 135 68.111 68.111 68.830 -0.719 18387 763 1 . 1 1 135 135 THR H H 135 8.265 8.265 8.332 -0.067 18387 764 1 . 1 1 136 136 VAL N N 136 121.207 121.207 121.289 -0.082 18387 765 1 . 1 1 136 136 VAL HA H 136 3.015 3.015 3.406 -0.391 18387 766 1 . 1 1 136 136 VAL C C 136 176.457 176.457 177.133 -0.676 18387 767 1 . 1 1 136 136 VAL CA C 136 68.272 68.272 66.309 1.963 18387 768 1 . 1 1 136 136 VAL CB C 136 30.941 30.941 30.568 0.373 18387 769 1 . 1 1 136 136 VAL H H 136 7.595 7.595 7.717 -0.123 18387 770 1 . 1 1 137 137 GLU N N 137 118.266 118.266 119.628 -1.362 18387 771 1 . 1 1 137 137 GLU HA H 137 2.682 2.682 3.895 -1.213 18387 772 1 . 1 1 137 137 GLU C C 137 177.482 177.482 178.413 -0.931 18387 773 1 . 1 1 137 137 GLU CA C 137 59.930 59.930 59.573 0.357 18387 774 1 . 1 1 137 137 GLU CB C 137 29.782 29.782 29.241 0.541 18387 775 1 . 1 1 137 137 GLU H H 137 8.114 8.114 8.132 -0.018 18387 776 1 . 1 1 138 138 LYS N N 138 116.431 116.431 118.965 -2.534 18387 777 1 . 1 1 138 138 LYS HA H 138 3.768 3.768 3.995 -0.227 18387 778 1 . 1 1 138 138 LYS C C 138 179.193 179.193 178.632 0.561 18387 779 1 . 1 1 138 138 LYS CA C 138 59.040 59.040 59.104 -0.064 18387 780 1 . 1 1 138 138 LYS CB C 138 32.158 32.158 32.225 -0.066 18387 781 1 . 1 1 138 138 LYS H H 138 7.133 7.133 7.642 -0.509 18387 782 1 . 1 1 139 139 PHE N N 139 116.336 116.336 117.447 -1.111 18387 783 1 . 1 1 139 139 PHE HA H 139 4.010 4.010 4.289 -0.279 18387 784 1 . 1 1 139 139 PHE C C 139 177.855 177.855 177.576 0.279 18387 785 1 . 1 1 139 139 PHE CA C 139 62.384 62.384 60.921 1.462 18387 786 1 . 1 1 139 139 PHE CB C 139 39.352 39.352 39.386 -0.034 18387 787 1 . 1 1 139 139 PHE H H 139 7.338 7.338 7.668 -0.330 18387 788 1 . 1 1 140 140 VAL N N 140 116.491 116.491 116.875 -0.384 18387 789 1 . 1 1 140 140 VAL HA H 140 3.524 3.524 3.455 0.069 18387 790 1 . 1 1 140 140 VAL C C 140 177.747 177.747 177.262 0.485 18387 791 1 . 1 1 140 140 VAL CA C 140 65.242 65.242 65.005 0.237 18387 792 1 . 1 1 140 140 VAL CB C 140 31.390 31.390 31.447 -0.057 18387 793 1 . 1 1 140 140 VAL H H 140 8.332 8.332 8.210 0.122 18387 794 1 . 1 1 141 141 ASN N N 141 116.956 116.956 117.349 -0.393 18387 795 1 . 1 1 141 141 ASN HA H 141 4.826 4.826 4.606 0.220 18387 796 1 . 1 1 141 141 ASN C C 141 176.997 176.997 176.089 0.908 18387 797 1 . 1 1 141 141 ASN CA C 141 53.677 53.677 54.331 -0.654 18387 798 1 . 1 1 141 141 ASN CB C 141 38.448 38.448 39.439 -0.991 18387 799 1 . 1 1 141 141 ASN H H 141 7.862 7.862 7.715 0.147 18387 800 1 . 1 1 142 142 GLY N N 142 107.938 107.938 107.107 0.831 18387 801 1 . 1 1 142 142 GLY C C 142 174.336 174.336 173.646 0.690 18387 802 1 . 1 1 142 142 GLY CA C 142 45.985 45.985 45.030 0.955 18387 803 1 . 1 1 142 142 GLY H H 142 7.466 7.466 7.891 -0.425 18387 804 1 . 1 1 143 143 ALA N N 143 123.441 123.441 122.501 0.940 18387 805 1 . 1 1 143 143 ALA HA H 143 4.341 4.341 4.256 0.085 18387 806 1 . 1 1 143 143 ALA C C 143 178.212 178.212 177.173 1.039 18387 807 1 . 1 1 143 143 ALA CA C 143 52.826 52.826 52.857 -0.031 18387 808 1 . 1 1 143 143 ALA CB C 143 19.244 19.244 18.839 0.405 18387 809 1 . 1 1 143 143 ALA H H 143 7.950 7.950 8.116 -0.166 18387 810 1 . 1 1 144 144 LYS N N 144 120.149 120.149 119.204 0.945 18387 811 1 . 1 1 144 144 LYS HA H 144 4.295 4.295 4.350 -0.055 18387 812 1 . 1 1 144 144 LYS C C 144 176.945 176.945 176.603 0.342 18387 813 1 . 1 1 144 144 LYS CA C 144 56.519 56.519 56.430 0.089 18387 814 1 . 1 1 144 144 LYS CB C 144 33.030 33.030 32.876 0.154 18387 815 1 . 1 1 144 144 LYS H H 144 8.187 8.187 8.119 0.068 18387 816 1 . 1 1 145 145 GLU N N 145 120.992 120.992 120.667 0.325 18387 817 1 . 1 1 145 145 GLU HA H 145 4.295 4.295 4.317 -0.022 18387 818 1 . 1 1 145 145 GLU C C 145 177.116 177.116 176.683 0.433 18387 819 1 . 1 1 145 145 GLU CA C 145 56.903 56.903 56.570 0.333 18387 820 1 . 1 1 145 145 GLU CB C 145 30.242 30.242 29.669 0.573 18387 821 1 . 1 1 145 145 GLU H H 145 8.363 8.363 8.410 -0.047 18387 822 1 . 1 1 146 146 GLY N N 146 109.467 109.467 109.390 0.077 18387 823 1 . 1 1 146 146 GLY C C 146 174.108 174.108 174.159 -0.051 18387 824 1 . 1 1 146 146 GLY CA C 146 45.401 45.401 44.929 0.473 18387 825 1 . 1 1 146 146 GLY H H 146 8.371 8.371 8.122 0.249 18387 826 1 . 1 1 151 151 HIS HA H 151 4.609 4.609 4.522 0.087 18387 827 1 . 1 1 151 151 HIS C C 151 174.258 174.258 174.228 0.030 18387 828 1 . 1 1 151 151 HIS CA C 151 56.165 56.165 56.255 -0.090 18387 829 1 . 1 1 151 151 HIS CB C 151 30.833 30.833 30.276 0.557 18387 stop_ save_