![]() |
NMR Restraints Grid |
![]() |
Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
![]() |
6014 |
1icl ![]() ![]() |
cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H SER 1 1H SER 1 21.275 20.955 -10.104 2 2H SER 1 2H SER 1 22.927 20.975 -10.143 3 3H SER 1 3H SER 1 22.081 20.235 -11.354 4 HA SER 1 HA SER 1 22.146 19.401 -8.521 5 1HB SER 1 1HB SER 1 20.784 17.462 -9.170 6 2HB SER 1 2HB SER 1 19.951 18.980 -9.548 7 HG SER 1 HG SER 1 19.896 17.489 -11.261 8 H LYS 2 H LYS 2 23.343 18.490 -11.766 9 HA LYS 2 HA LYS 2 25.801 17.342 -10.491 10 1HB LYS 2 2HB LYS 2 25.912 15.215 -11.542 11 2HB LYS 2 1HB LYS 2 24.569 15.336 -10.425 12 1HG LYS 2 2HG LYS 2 22.950 15.465 -12.373 13 2HG LYS 2 1HG LYS 2 24.300 15.343 -13.499 14 1HD LYS 2 2HD LYS 2 24.882 13.079 -12.580 15 2HD LYS 2 1HD LYS 2 23.563 13.168 -11.424 16 1HE LYS 2 1HE LYS 2 23.108 13.262 -14.492 17 2HE LYS 2 2HE LYS 2 23.221 11.772 -13.570 18 1HZ LYS 2 1HZ LYS 2 21.312 12.459 -12.237 19 2HZ LYS 2 2HZ LYS 2 20.928 12.430 -13.844 20 3HZ LYS 2 3HZ LYS 2 21.176 13.873 -13.080 21 H TYR 3 H TYR 3 26.805 19.037 -11.376 22 HA TYR 3 HA TYR 3 26.637 19.741 -14.278 23 1HB TYR 3 1HB TYR 3 27.811 21.733 -13.761 24 2HB TYR 3 2HB TYR 3 26.631 21.494 -12.516 25 HD1 TYR 3 HD1 TYR 3 30.301 21.404 -13.272 26 HD2 TYR 3 HD2 TYR 3 27.368 21.072 -10.137 27 HE1 TYR 3 HE1 TYR 3 32.031 21.574 -11.623 28 HE2 TYR 3 HE2 TYR 3 29.129 21.164 -8.509 29 HH TYR 3 HH TYR 3 31.312 21.384 -8.130 30 H GLU 4 H GLU 4 28.323 19.734 -15.754 31 HA GLU 4 HA GLU 4 30.989 18.379 -15.089 32 1HB GLU 4 2HB GLU 4 29.540 16.696 -16.226 33 2HB GLU 4 1HB GLU 4 29.243 17.807 -17.559 34 1HG GLU 4 2HG GLU 4 31.711 17.676 -18.150 35 2HG GLU 4 1HG GLU 4 31.958 16.500 -16.875 36 HE2 GLU 4 HE2 GLU 4 30.325 14.778 -16.924 37 H TYR 5 H TYR 5 32.377 20.036 -15.351 38 HA TYR 5 HA TYR 5 32.107 21.827 -17.836 39 1HB TYR 5 2HB TYR 5 32.721 23.795 -16.906 40 2HB TYR 5 1HB TYR 5 31.308 23.140 -16.130 41 HD1 TYR 5 HD1 TYR 5 31.143 23.399 -13.730 42 HD2 TYR 5 HD2 TYR 5 35.012 23.723 -15.584 43 HE1 TYR 5 HE1 TYR 5 32.086 24.224 -11.659 44 HE2 TYR 5 HE2 TYR 5 35.903 24.592 -13.506 45 HH TYR 5 HH TYR 5 33.884 24.965 -10.617 46 H THR 6 H THR 6 33.668 21.324 -19.123 47 HA THR 6 HA THR 6 36.323 20.353 -18.109 48 HB THR 6 HB THR 6 35.311 20.404 -21.012 49 HG1 THR 6 HG1 THR 6 34.528 18.332 -20.612 50 1HG2 THR 6 1HG2 THR 6 36.652 18.313 -21.287 51 2HG2 THR 6 2HG2 THR 6 37.182 18.415 -19.586 52 3HG2 THR 6 3HG2 THR 6 37.703 19.663 -20.754 53 H VAL 7 H VAL 7 37.349 22.099 -17.468 54 HA VAL 7 HA VAL 7 37.941 24.375 -19.445 55 HB VAL 7 HB VAL 7 38.200 24.306 -16.397 56 1HG1 VAL 7 1HG2 VAL 7 39.095 26.716 -18.118 57 2HG1 VAL 7 2HG2 VAL 7 39.078 26.635 -16.328 58 3HG1 VAL 7 3HG2 VAL 7 40.166 25.594 -17.260 59 1HG2 VAL 7 1HG1 VAL 7 36.519 26.145 -16.323 60 2HG2 VAL 7 2HG1 VAL 7 36.500 26.263 -18.109 61 3HG2 VAL 7 3HG1 VAL 7 35.872 24.821 -17.308 62 HA DPR 8 HA PRO 8 42.297 22.839 -19.452 63 1HB DPR 8 1HB PRO 8 42.782 24.136 -21.304 64 2HB DPR 8 2HB PRO 8 42.851 22.567 -22.139 65 1HG DPR 8 2HG PRO 8 41.202 24.454 -23.089 66 2HG DPR 8 1HG PRO 8 40.603 22.766 -22.925 67 1HD DPR 8 2HD PRO 8 40.011 25.144 -21.097 68 2HD DPR 8 1HD PRO 8 38.917 23.828 -21.604 69 H SER 9 H SER 9 43.343 20.915 -20.006 70 HA SER 9 HA SER 9 41.670 18.386 -20.329 71 1HB SER 9 1HB SER 9 44.627 18.753 -19.573 72 2HB SER 9 2HB SER 9 43.823 17.202 -19.825 73 HG SER 9 HG SER 9 43.985 19.316 -21.718 74 H TYR 10 H TYR 10 40.510 19.986 -18.294 75 HA TYR 10 HA TYR 10 40.834 18.170 -15.899 76 1HB TYR 10 2HB TYR 10 41.995 20.797 -15.877 77 2HB TYR 10 1HB TYR 10 40.475 21.068 -15.100 78 HD1 TYR 10 HD1 TYR 10 43.749 19.305 -14.850 79 HD2 TYR 10 HD2 TYR 10 39.974 19.931 -12.861 80 HE1 TYR 10 HE1 TYR 10 44.651 18.384 -12.805 81 HE2 TYR 10 HE2 TYR 10 40.923 18.999 -10.834 82 HH TYR 10 HH TYR 10 42.692 18.126 -9.852 83 H THR 11 H THR 11 39.039 17.322 -16.333 84 HA THR 11 HA THR 11 36.457 18.674 -16.993 85 HB THR 11 HB THR 11 36.868 15.705 -16.379 86 HG1 THR 11 HG1 THR 11 37.116 17.094 -18.834 87 1HG2 THR 11 1HG2 THR 11 34.434 16.349 -16.683 88 2HG2 THR 11 2HG2 THR 11 35.018 15.306 -18.012 89 3HG2 THR 11 3HG2 THR 11 34.833 17.058 -18.266 90 H PHE 12 H PHE 12 35.502 19.835 -15.318 91 HA PHE 12 HA PHE 12 35.902 18.896 -12.451 92 1HB PHE 12 2HB PHE 12 34.712 21.451 -13.546 93 2HB PHE 12 1HB PHE 12 34.817 21.080 -11.850 94 HD1 PHE 12 HD1 PHE 12 36.821 22.089 -14.828 95 HD2 PHE 12 HD2 PHE 12 37.055 21.038 -10.652 96 HE1 PHE 12 HE1 PHE 12 39.039 23.050 -14.683 97 HE2 PHE 12 HE2 PHE 12 39.275 22.010 -10.557 98 HZ PHE 12 HZ PHE 12 40.287 23.021 -12.562 99 H ARG 13 H ARG 13 34.581 17.087 -12.504 100 HA ARG 13 HA ARG 13 31.594 17.428 -12.925 101 1HB ARG 13 2HB ARG 13 33.267 14.880 -12.429 102 2HB ARG 13 1HB ARG 13 31.504 14.879 -12.509 103 1HG ARG 13 2HG ARG 13 31.570 15.731 -14.848 104 2HG ARG 13 1HG ARG 13 33.338 15.722 -14.809 105 1HD ARG 13 1HD ARG 13 33.250 13.176 -14.410 106 2HD ARG 13 2HD ARG 13 31.483 13.264 -14.577 107 HE ARG 13 HE ARG 13 32.488 14.511 -16.932 108 1HH1 ARG 13 1HH1 ARG 13 32.901 11.198 -15.578 109 2HH1 ARG 13 2HH1 ARG 13 33.155 10.561 -17.280 110 1HH2 ARG 13 2HH2 ARG 13 32.791 13.638 -18.760 111 2HH2 ARG 13 1HH2 ARG 13 33.097 11.837 -18.936 112 H GLY 14 H GLY 14 30.295 17.536 -11.192 113 1HA GLY 14 1HA GLY 14 30.641 16.263 -8.586 114 2HA GLY 14 2HA GLY 14 31.219 17.925 -8.457 115 HA PRO 15 HA PRO 15 26.411 18.026 -8.434 116 1HB PRO 15 1HB PRO 15 25.460 17.586 -5.885 117 2HB PRO 15 2HB PRO 15 25.869 16.283 -7.019 118 1HG PRO 15 2HG PRO 15 27.570 17.372 -4.745 119 2HG PRO 15 1HG PRO 15 27.212 15.658 -5.126 120 1HD PRO 15 2HD PRO 15 29.551 16.983 -5.955 121 2HD PRO 15 1HD PRO 15 28.832 15.640 -6.883 122 H GLY 16 H GLY 16 25.201 19.782 -8.000 123 1HA GLY 16 1HA GLY 16 24.507 21.938 -7.118 124 2HA GLY 16 2HA GLY 16 25.840 21.884 -5.974 125 H CYS 17 H CYS 17 24.792 23.196 -8.947 126 HA CYS 17 HA CYS 17 27.279 23.658 -10.306 127 1HB CYS 17 1HB CYS 17 24.729 25.256 -10.718 128 2HB CYS 17 2HB CYS 17 26.037 24.979 -11.882 129 HA PRO 18 HA PRO 18 28.145 27.320 -7.500 130 1HB PRO 18 2HB PRO 18 30.790 27.206 -7.104 131 2HB PRO 18 1HB PRO 18 29.691 25.908 -6.569 132 1HG PRO 18 2HG PRO 18 31.471 25.942 -9.045 133 2HG PRO 18 1HG PRO 18 31.239 24.614 -7.875 134 1HD PRO 18 2HD PRO 18 29.836 24.912 -10.344 135 2HD PRO 18 1HD PRO 18 29.275 23.914 -8.986 136 H THR 19 H THR 19 30.758 27.580 -9.952 137 HA THR 19 HA THR 19 30.017 30.445 -10.482 138 HB THR 19 HB THR 19 32.110 30.343 -11.943 139 HG1 THR 19 HG1 THR 19 32.459 27.875 -10.631 140 1HG2 THR 19 1HG2 THR 19 32.310 31.342 -9.707 141 2HG2 THR 19 2HG2 THR 19 33.796 30.468 -10.173 142 3HG2 THR 19 3HG2 THR 19 32.653 29.737 -9.005 143 H VAL 20 H VAL 20 29.389 31.155 -12.437 144 HA VAL 20 HA VAL 20 28.831 29.260 -14.766 145 HB VAL 20 HB VAL 20 26.748 31.031 -13.669 146 1HG1 VAL 20 1HG2 VAL 20 25.053 30.016 -15.311 147 2HG1 VAL 20 2HG2 VAL 20 26.334 28.927 -15.927 148 3HG1 VAL 20 3HG2 VAL 20 26.462 30.680 -16.150 149 1HG2 VAL 20 1HG1 VAL 20 26.882 29.031 -12.133 150 2HG2 VAL 20 2HG1 VAL 20 26.573 27.922 -13.478 151 3HG2 VAL 20 3HG1 VAL 20 25.295 29.046 -12.921 152 H LYS 21 H LYS 21 30.605 30.716 -14.627 153 HA LYS 21 HA LYS 21 30.737 33.449 -15.618 154 1HB LYS 21 2HB LYS 21 32.899 31.302 -16.017 155 2HB LYS 21 1HB LYS 21 33.179 32.982 -16.385 156 1HG LYS 21 2HG LYS 21 32.546 31.951 -13.557 157 2HG LYS 21 1HG LYS 21 34.165 32.101 -14.220 158 1HD LYS 21 1HD LYS 21 33.859 34.569 -14.487 159 2HD LYS 21 2HD LYS 21 32.237 34.466 -13.821 160 1HE LYS 21 1HE LYS 21 34.752 33.617 -12.215 161 2HE LYS 21 2HE LYS 21 34.150 35.267 -12.262 162 1HZ LYS 21 1HZ LYS 21 32.572 32.949 -11.272 163 2HZ LYS 21 2HZ LYS 21 33.295 34.106 -10.341 164 3HZ LYS 21 3HZ LYS 21 32.037 34.511 -11.331 165 HA PRO 22 HA PRO 22 29.414 33.415 -19.724 166 1HB PRO 22 1HB PRO 22 31.165 35.689 -20.613 167 2HB PRO 22 2HB PRO 22 29.395 35.581 -20.464 168 1HG PRO 22 1HG PRO 22 30.802 36.966 -18.563 169 2HG PRO 22 2HG PRO 22 29.496 35.865 -18.031 170 1HD PRO 22 2HD PRO 22 32.499 35.195 -18.198 171 2HD PRO 22 1HD PRO 22 31.410 35.151 -16.789 172 H DAL 23 H ALA 23 29.990 31.513 -20.570 173 HA DAL 23 HA ALA 23 32.528 31.199 -22.253 174 1HB DAL 23 1HB ALA 23 29.693 30.416 -23.157 175 2HB DAL 23 2HB ALA 23 31.194 30.213 -24.100 176 3HB DAL 23 3HB ALA 23 30.595 31.845 -23.727 177 H ILE 24 H ILE 24 30.329 29.399 -20.103 178 HA ILE 24 HA ILE 24 31.937 26.903 -20.589 179 HB ILE 24 HB ILE 24 29.841 27.264 -18.452 180 1HG1 ILE 24 2HG1 ILE 24 32.900 27.431 -17.870 181 2HG1 ILE 24 1HG1 ILE 24 31.928 28.857 -18.135 182 1HG2 ILE 24 1HG2 ILE 24 30.155 24.930 -18.892 183 2HG2 ILE 24 2HG2 ILE 24 31.017 25.219 -17.363 184 3HG2 ILE 24 3HG2 ILE 24 31.942 25.063 -18.874 185 1HD1 ILE 24 1HD1 ILE 24 32.181 28.503 -15.725 186 2HD1 ILE 24 2HD1 ILE 24 30.446 28.315 -16.215 187 3HD1 ILE 24 3HD1 ILE 24 31.438 26.874 -15.884 188 H SER 25 H SER 25 30.973 25.198 -21.231 189 HA SER 25 HA SER 25 28.169 25.086 -22.509 190 1HB SER 25 2HB SER 25 30.074 24.624 -24.071 191 2HB SER 25 1HB SER 25 30.687 23.364 -22.981 192 HG SER 25 HG SER 25 29.364 22.537 -24.641 193 H LEU 26 H LEU 26 27.489 25.120 -20.292 194 HA LEU 26 HA LEU 26 28.513 23.208 -18.292 195 1HB LEU 26 2HB LEU 26 27.771 25.738 -17.999 196 2HB LEU 26 1HB LEU 26 26.156 25.106 -17.950 197 HG LEU 26 HG LEU 26 26.968 23.715 -15.791 198 1HD1 LEU 26 1HD2 LEU 26 29.402 23.852 -16.229 199 2HD1 LEU 26 2HD2 LEU 26 28.998 24.428 -14.599 200 3HD1 LEU 26 3HD2 LEU 26 29.418 25.591 -15.890 201 1HD2 LEU 26 1HD1 LEU 26 26.750 25.739 -14.292 202 2HD2 LEU 26 2HD1 LEU 26 25.604 25.859 -15.641 203 3HD2 LEU 26 3HD1 LEU 26 27.099 26.813 -15.673 204 H ARG 27 H ARG 27 27.359 21.638 -17.187 205 HA ARG 27 HA ARG 27 24.786 20.558 -18.484 206 1HB ARG 27 1HB ARG 27 27.292 18.901 -17.791 207 2HB ARG 27 2HB ARG 27 25.706 18.174 -17.964 208 1HG ARG 27 2HG ARG 27 25.522 18.945 -20.331 209 2HG ARG 27 1HG ARG 27 27.099 19.724 -20.218 210 1HD ARG 27 2HD ARG 27 28.191 17.476 -19.797 211 2HD ARG 27 1HD ARG 27 26.606 16.688 -19.908 212 HE ARG 27 HE ARG 27 27.083 18.316 -22.312 213 1HH1 ARG 27 1HH2 ARG 27 28.091 15.131 -20.964 214 2HH1 ARG 27 2HH2 ARG 27 28.428 14.543 -22.669 215 1HH2 ARG 27 1HH1 ARG 27 27.507 17.504 -24.144 216 2HH2 ARG 27 2HH1 ARG 27 28.122 15.784 -24.324 217 H CYS 28 H CYS 28 24.839 22.187 -16.504 218 HA CYS 28 HA CYS 28 24.610 21.346 -13.941 219 1HB CYS 28 2HB CYS 28 24.486 23.723 -14.651 220 2HB CYS 28 1HB CYS 28 22.779 23.499 -15.113 221 H GLU 29 H GLU 29 21.671 21.173 -16.062 222 HA GLU 29 HA GLU 29 20.483 19.103 -14.142 223 1HB GLU 29 1HB GLU 29 19.453 21.519 -13.855 224 2HB GLU 29 2HB GLU 29 18.849 21.332 -15.486 225 1HG GLU 29 2HG GLU 29 17.008 20.826 -14.103 226 2HG GLU 29 1HG GLU 29 17.546 19.241 -14.648 227 HE2 GLU 29 HE2 GLU 29 17.647 20.390 -10.779 Start of MODEL 2 1 1H SER 1 1H SER 1 20.814 17.473 -9.718 2 2H SER 1 2H SER 1 21.368 18.657 -8.707 3 3H SER 1 3H SER 1 20.123 18.973 -9.747 4 HA SER 1 HA SER 1 21.518 18.705 -11.669 5 1HB SER 1 1HB SER 1 22.895 20.749 -11.379 6 2HB SER 1 2HB SER 1 21.261 20.953 -10.730 7 HG SER 1 HG SER 1 22.119 20.478 -8.657 8 H LYS 2 H LYS 2 23.319 17.746 -12.499 9 HA LYS 2 HA LYS 2 25.663 16.959 -10.743 10 1HB LYS 2 1HB LYS 2 24.035 15.010 -11.017 11 2HB LYS 2 2HB LYS 2 24.216 15.132 -12.767 12 1HG LYS 2 2HG LYS 2 26.674 14.618 -12.518 13 2HG LYS 2 1HG LYS 2 26.473 14.517 -10.763 14 1HD LYS 2 1HD LYS 2 24.895 12.575 -11.054 15 2HD LYS 2 2HD LYS 2 25.055 12.660 -12.802 16 1HE LYS 2 2HE LYS 2 27.467 12.114 -10.925 17 2HE LYS 2 1HE LYS 2 26.400 10.858 -11.530 18 1HZ LYS 2 1HZ LYS 2 28.006 12.650 -13.276 19 2HZ LYS 2 2HZ LYS 2 28.342 11.070 -12.927 20 3HZ LYS 2 3HZ LYS 2 26.996 11.454 -13.806 21 H TYR 3 H TYR 3 26.638 18.720 -11.597 22 HA TYR 3 HA TYR 3 26.730 19.447 -14.446 23 1HB TYR 3 2HB TYR 3 27.937 21.395 -13.789 24 2HB TYR 3 1HB TYR 3 26.663 21.119 -12.646 25 HD1 TYR 3 HD1 TYR 3 27.212 20.952 -10.237 26 HD2 TYR 3 HD2 TYR 3 30.405 20.798 -13.119 27 HE1 TYR 3 HE1 TYR 3 28.846 21.085 -8.474 28 HE2 TYR 3 HE2 TYR 3 32.004 21.044 -11.349 29 HH TYR 3 HH TYR 3 30.997 21.185 -7.929 30 H GLU 4 H GLU 4 28.452 19.485 -15.878 31 HA GLU 4 HA GLU 4 31.147 18.268 -15.162 32 1HB GLU 4 2HB GLU 4 29.840 16.409 -16.160 33 2HB GLU 4 1HB GLU 4 29.483 17.372 -17.590 34 1HG GLU 4 1HG GLU 4 31.931 17.361 -18.191 35 2HG GLU 4 2HG GLU 4 32.301 16.399 -16.775 36 HE2 GLU 4 HE2 GLU 4 31.787 16.338 -19.838 37 H TYR 5 H TYR 5 32.448 19.941 -15.587 38 HA TYR 5 HA TYR 5 32.163 21.416 -18.256 39 1HB TYR 5 1HB TYR 5 32.754 23.539 -17.521 40 2HB TYR 5 2HB TYR 5 31.238 22.956 -16.865 41 HD1 TYR 5 HD1 TYR 5 34.437 24.507 -16.032 42 HD2 TYR 5 HD2 TYR 5 31.032 22.493 -14.349 43 HE1 TYR 5 HE1 TYR 5 34.944 25.428 -13.849 44 HE2 TYR 5 HE2 TYR 5 31.570 23.446 -12.184 45 HH TYR 5 HH TYR 5 32.936 24.714 -11.015 46 H THR 6 H THR 6 33.848 20.879 -19.395 47 HA THR 6 HA THR 6 36.445 20.166 -18.123 48 HB THR 6 HB THR 6 35.721 20.028 -21.116 49 HG1 THR 6 HG1 THR 6 35.239 18.096 -19.108 50 1HG2 THR 6 1HG2 THR 6 37.205 18.028 -21.182 51 2HG2 THR 6 2HG2 THR 6 37.562 18.206 -19.442 52 3HG2 THR 6 3HG2 THR 6 38.122 19.449 -20.597 53 H VAL 7 H VAL 7 37.721 21.773 -17.680 54 HA VAL 7 HA VAL 7 38.248 24.026 -19.709 55 HB VAL 7 HB VAL 7 38.730 24.096 -16.702 56 1HG1 VAL 7 1HG1 VAL 7 40.516 25.388 -17.905 57 2HG1 VAL 7 2HG1 VAL 7 39.293 26.403 -18.691 58 3HG1 VAL 7 3HG1 VAL 7 39.514 26.462 -16.915 59 1HG2 VAL 7 1HG2 VAL 7 36.308 24.453 -17.288 60 2HG2 VAL 7 2HG2 VAL 7 37.002 25.903 -16.545 61 3HG2 VAL 7 3HG2 VAL 7 36.731 25.835 -18.314 62 HA DPR 8 HA PRO 8 42.525 22.494 -19.914 63 1HB DPR 8 2HB PRO 8 42.728 23.301 -22.043 64 2HB DPR 8 1HB PRO 8 42.839 21.587 -22.498 65 1HG DPR 8 2HG PRO 8 40.968 23.097 -23.659 66 2HG DPR 8 1HG PRO 8 40.517 21.469 -23.036 67 1HD DPR 8 1HD PRO 8 39.941 24.188 -21.751 68 2HD DPR 8 2HD PRO 8 38.886 22.751 -21.830 69 H SER 9 H SER 9 43.643 20.634 -19.968 70 HA SER 9 HA SER 9 42.582 17.876 -19.865 71 1HB SER 9 1HB SER 9 45.037 19.114 -18.456 72 2HB SER 9 2HB SER 9 44.728 17.387 -18.587 73 HG SER 9 HG SER 9 44.986 19.186 -20.770 74 H TYR 10 H TYR 10 41.073 20.020 -17.902 75 HA TYR 10 HA TYR 10 41.225 18.279 -15.404 76 1HB TYR 10 1HB TYR 10 42.685 20.566 -15.431 77 2HB TYR 10 2HB TYR 10 41.146 21.323 -15.127 78 HD1 TYR 10 HD1 TYR 10 39.969 20.882 -12.887 79 HD2 TYR 10 HD2 TYR 10 43.768 19.041 -13.768 80 HE1 TYR 10 HE1 TYR 10 40.258 20.289 -10.559 81 HE2 TYR 10 HE2 TYR 10 44.015 18.468 -11.444 82 HH TYR 10 HH TYR 10 41.534 19.326 -9.035 83 H THR 11 H THR 11 39.425 17.474 -15.912 84 HA THR 11 HA THR 11 36.953 18.815 -16.751 85 HB THR 11 HB THR 11 37.117 15.924 -15.758 86 HG1 THR 11 HG1 THR 11 37.604 15.436 -17.904 87 1HG2 THR 11 1HG2 THR 11 35.367 17.091 -18.019 88 2HG2 THR 11 2HG2 THR 11 34.763 16.738 -16.388 89 3HG2 THR 11 3HG2 THR 11 35.356 15.411 -17.427 90 H PHE 12 H PHE 12 35.600 19.984 -15.405 91 HA PHE 12 HA PHE 12 35.800 19.564 -12.397 92 1HB PHE 12 2HB PHE 12 34.635 21.821 -14.102 93 2HB PHE 12 1HB PHE 12 34.404 21.723 -12.383 94 HD1 PHE 12 HD1 PHE 12 36.994 22.280 -15.044 95 HD2 PHE 12 HD2 PHE 12 36.297 22.125 -10.794 96 HE1 PHE 12 HE1 PHE 12 39.122 23.378 -14.618 97 HE2 PHE 12 HE2 PHE 12 38.420 23.239 -10.422 98 HZ PHE 12 HZ PHE 12 39.846 23.874 -12.327 99 H ARG 13 H ARG 13 34.721 17.560 -12.416 100 HA ARG 13 HA ARG 13 31.727 17.577 -12.907 101 1HB ARG 13 1HB ARG 13 33.644 15.252 -12.219 102 2HB ARG 13 2HB ARG 13 31.890 15.060 -12.298 103 1HG ARG 13 1HG ARG 13 31.889 15.752 -14.696 104 2HG ARG 13 2HG ARG 13 33.649 15.911 -14.644 105 1HD ARG 13 2HD ARG 13 33.836 13.429 -14.107 106 2HD ARG 13 1HD ARG 13 32.066 13.299 -14.198 107 HE ARG 13 HE ARG 13 32.955 14.514 -16.670 108 1HH1 ARG 13 1HH2 ARG 13 33.278 11.262 -15.151 109 2HH1 ARG 13 2HH2 ARG 13 33.447 10.525 -16.823 110 1HH2 ARG 13 1HH1 ARG 13 33.159 13.532 -18.456 111 2HH2 ARG 13 2HH1 ARG 13 33.384 11.713 -18.543 112 H GLY 14 H GLY 14 30.357 17.583 -11.197 113 1HA GLY 14 2HA GLY 14 30.866 16.481 -8.535 114 2HA GLY 14 1HA GLY 14 31.111 18.225 -8.460 115 HA PRO 15 HA PRO 15 26.366 17.504 -8.484 116 1HB PRO 15 1HB PRO 15 25.482 16.935 -5.936 117 2HB PRO 15 2HB PRO 15 26.092 15.703 -7.059 118 1HG PRO 15 2HG PRO 15 27.590 17.043 -4.780 119 2HG PRO 15 1HG PRO 15 27.501 15.294 -5.160 120 1HD PRO 15 2HD PRO 15 29.612 16.978 -5.976 121 2HD PRO 15 1HD PRO 15 29.133 15.522 -6.889 122 H GLY 16 H GLY 16 24.903 19.085 -8.034 123 1HA GLY 16 2HA GLY 16 23.954 21.168 -7.217 124 2HA GLY 16 1HA GLY 16 25.259 21.276 -6.045 125 H CYS 17 H CYS 17 24.109 22.509 -8.985 126 HA CYS 17 HA CYS 17 26.564 23.132 -10.384 127 1HB CYS 17 1HB CYS 17 24.332 22.856 -11.398 128 2HB CYS 17 2HB CYS 17 23.902 24.483 -10.763 129 HA PRO 18 HA PRO 18 27.123 26.993 -7.735 130 1HB PRO 18 1HB PRO 18 29.723 26.852 -7.115 131 2HB PRO 18 2HB PRO 18 28.576 25.571 -6.647 132 1HG PRO 18 2HG PRO 18 30.603 25.524 -8.921 133 2HG PRO 18 1HG PRO 18 30.185 24.215 -7.779 134 1HD PRO 18 2HD PRO 18 29.009 24.623 -10.429 135 2HD PRO 18 1HD PRO 18 28.407 23.540 -9.170 136 H THR 19 H THR 19 29.795 26.990 -10.111 137 HA THR 19 HA THR 19 29.579 29.968 -10.428 138 HB THR 19 HB THR 19 31.814 29.634 -11.596 139 HG1 THR 19 HG1 THR 19 31.550 27.010 -10.605 140 1HG2 THR 19 1HG2 THR 19 31.842 28.600 -8.722 141 2HG2 THR 19 2HG2 THR 19 31.879 30.312 -9.223 142 3HG2 THR 19 3HG2 THR 19 33.238 29.233 -9.637 143 H VAL 20 H VAL 20 29.688 30.951 -12.505 144 HA VAL 20 HA VAL 20 29.402 29.545 -14.965 145 HB VAL 20 HB VAL 20 27.317 29.120 -14.455 146 1HG1 VAL 20 1HG1 VAL 20 25.274 30.570 -14.229 147 2HG1 VAL 20 2HG1 VAL 20 26.486 30.998 -13.003 148 3HG1 VAL 20 3HG1 VAL 20 26.288 32.034 -14.438 149 1HG2 VAL 20 1HG2 VAL 20 27.095 31.059 -16.814 150 2HG2 VAL 20 2HG2 VAL 20 27.794 29.427 -16.862 151 3HG2 VAL 20 3HG2 VAL 20 26.063 29.622 -16.535 152 H LYS 21 H LYS 21 30.959 30.546 -14.879 153 HA LYS 21 HA LYS 21 31.581 33.470 -15.410 154 1HB LYS 21 1HB LYS 21 33.216 30.952 -16.136 155 2HB LYS 21 2HB LYS 21 33.778 32.566 -16.525 156 1HG LYS 21 2HG LYS 21 33.919 33.263 -14.181 157 2HG LYS 21 1HG LYS 21 33.209 31.748 -13.623 158 1HD LYS 21 2HD LYS 21 35.113 30.458 -14.501 159 2HD LYS 21 1HD LYS 21 35.879 31.910 -15.149 160 1HE LYS 21 2HE LYS 21 35.319 31.511 -12.121 161 2HE LYS 21 1HE LYS 21 36.776 30.942 -12.921 162 1HZ LYS 21 1HZ LYS 21 35.940 33.794 -12.829 163 2HZ LYS 21 2HZ LYS 21 37.137 33.100 -11.928 164 3HZ LYS 21 3HZ LYS 21 37.303 33.223 -13.567 165 HA PRO 22 HA PRO 22 29.857 34.149 -19.265 166 1HB PRO 22 1HB PRO 22 32.004 35.992 -20.266 167 2HB PRO 22 2HB PRO 22 30.291 36.303 -19.894 168 1HG PRO 22 2HG PRO 22 32.191 37.140 -18.108 169 2HG PRO 22 1HG PRO 22 30.729 36.324 -17.477 170 1HD PRO 22 1HD PRO 22 33.446 35.002 -18.080 171 2HD PRO 22 2HD PRO 22 32.541 35.075 -16.547 172 H DAL 23 H ALA 23 29.927 32.107 -20.119 173 HA DAL 23 HA ALA 23 31.657 31.679 -22.614 174 1HB DAL 23 1HB ALA 23 28.605 31.342 -22.391 175 2HB DAL 23 2HB ALA 23 29.584 31.092 -23.862 176 3HB DAL 23 3HB ALA 23 29.434 32.719 -23.164 177 H ILE 24 H ILE 24 30.243 29.844 -19.911 178 HA ILE 24 HA ILE 24 31.075 27.309 -21.286 179 HB ILE 24 HB ILE 24 30.243 27.406 -18.389 180 1HG1 ILE 24 1HG1 ILE 24 33.257 27.519 -19.179 181 2HG1 ILE 24 2HG1 ILE 24 32.346 28.960 -18.808 182 1HG2 ILE 24 1HG2 ILE 24 30.244 25.158 -19.426 183 2HG2 ILE 24 2HG2 ILE 24 31.575 25.241 -18.247 184 3HG2 ILE 24 3HG2 ILE 24 31.926 25.384 -20.000 185 1HD1 ILE 24 1HD1 ILE 24 32.682 26.657 -16.865 186 2HD1 ILE 24 2HD1 ILE 24 33.567 28.230 -16.812 187 3HD1 ILE 24 3HD1 ILE 24 31.771 28.157 -16.551 188 H SER 25 H SER 25 29.655 25.792 -21.547 189 HA SER 25 HA SER 25 26.621 26.174 -21.195 190 1HB SER 25 2HB SER 25 27.342 26.113 -23.587 191 2HB SER 25 1HB SER 25 28.194 24.580 -23.315 192 HG SER 25 HG SER 25 26.087 24.290 -24.125 193 H LEU 26 H LEU 26 26.715 25.395 -19.077 194 HA LEU 26 HA LEU 26 28.345 23.087 -18.201 195 1HB LEU 26 2HB LEU 26 26.011 24.414 -16.705 196 2HB LEU 26 1HB LEU 26 27.099 23.238 -16.038 197 HG LEU 26 HG LEU 26 27.564 25.215 -15.001 198 1HD1 LEU 26 1HD1 LEU 26 29.955 25.566 -15.185 199 2HD1 LEU 26 2HD1 LEU 26 29.971 24.794 -16.792 200 3HD1 LEU 26 3HD1 LEU 26 29.541 23.846 -15.354 201 1HD2 LEU 26 1HD2 LEU 26 28.222 26.641 -17.666 202 2HD2 LEU 26 2HD2 LEU 26 28.288 27.373 -16.042 203 3HD2 LEU 26 3HD2 LEU 26 26.728 26.889 -16.728 204 H ARG 27 H ARG 27 27.483 21.132 -17.230 205 HA ARG 27 HA ARG 27 24.960 19.999 -18.574 206 1HB ARG 27 1HB ARG 27 27.399 18.521 -17.453 207 2HB ARG 27 2HB ARG 27 25.914 17.685 -17.771 208 1HG ARG 27 1HG ARG 27 27.330 19.299 -19.981 209 2HG ARG 27 2HG ARG 27 27.888 17.702 -19.504 210 1HD ARG 27 1HD ARG 27 25.658 16.699 -20.152 211 2HD ARG 27 2HD ARG 27 25.076 18.307 -20.622 212 HE ARG 27 HE ARG 27 27.604 17.689 -22.011 213 1HH1 ARG 27 2HH2 ARG 27 24.096 16.912 -22.281 214 2HH1 ARG 27 1HH2 ARG 27 24.334 16.570 -24.068 215 1HH2 ARG 27 1HH1 ARG 27 27.695 17.271 -24.014 216 2HH2 ARG 27 2HH1 ARG 27 26.213 16.759 -24.966 217 H CYS 28 H CYS 28 24.984 21.698 -16.649 218 HA CYS 28 HA CYS 28 24.113 20.799 -14.116 219 1HB CYS 28 2HB CYS 28 23.699 23.515 -15.478 220 2HB CYS 28 1HB CYS 28 23.157 23.200 -13.819 221 H GLU 29 H GLU 29 22.191 19.989 -13.438 222 HA GLU 29 HA GLU 29 20.067 19.100 -13.351 223 1HB GLU 29 2HB GLU 29 19.607 21.670 -13.048 224 2HB GLU 29 1HB GLU 29 18.961 21.634 -14.678 225 1HG GLU 29 1HG GLU 29 17.213 19.941 -13.891 226 2HG GLU 29 2HG GLU 29 17.893 20.028 -12.260 227 HE2 GLU 29 HE2 GLU 29 16.696 23.206 -11.539 Start of MODEL 3 1 1H SER 1 1H SER 1 19.812 18.535 -9.621 2 2H SER 1 2H SER 1 20.974 17.998 -8.576 3 3H SER 1 3H SER 1 20.565 17.090 -9.894 4 HA SER 1 HA SER 1 21.390 18.785 -11.410 5 1HB SER 1 2HB SER 1 22.199 20.180 -8.790 6 2HB SER 1 1HB SER 1 22.728 20.687 -10.403 7 HG SER 1 HG SER 1 20.526 20.896 -10.977 8 H LYS 2 H LYS 2 23.262 18.065 -12.236 9 HA LYS 2 HA LYS 2 25.607 17.238 -10.568 10 1HB LYS 2 2HB LYS 2 26.028 15.075 -11.460 11 2HB LYS 2 1HB LYS 2 24.556 15.133 -10.512 12 1HG LYS 2 1HG LYS 2 23.176 15.012 -12.631 13 2HG LYS 2 2HG LYS 2 24.658 14.951 -13.588 14 1HD LYS 2 1HD LYS 2 25.316 12.783 -12.435 15 2HD LYS 2 2HD LYS 2 23.833 12.843 -11.477 16 1HE LYS 2 1HE LYS 2 22.452 12.682 -13.598 17 2HE LYS 2 2HE LYS 2 23.941 12.622 -14.560 18 1HZ LYS 2 1HZ LYS 2 24.567 10.594 -13.352 19 2HZ LYS 2 2HZ LYS 2 23.100 10.404 -14.088 20 3HZ LYS 2 3HZ LYS 2 23.180 10.650 -12.456 21 H TYR 3 H TYR 3 26.601 18.920 -11.441 22 HA TYR 3 HA TYR 3 26.597 19.619 -14.309 23 1HB TYR 3 2HB TYR 3 27.749 21.606 -13.702 24 2HB TYR 3 1HB TYR 3 26.536 21.321 -12.498 25 HD1 TYR 3 HD1 TYR 3 30.218 21.212 -13.169 26 HD2 TYR 3 HD2 TYR 3 27.219 20.915 -10.107 27 HE1 TYR 3 HE1 TYR 3 31.933 21.287 -11.466 28 HE2 TYR 3 HE2 TYR 3 28.952 20.963 -8.434 29 HH TYR 3 HH TYR 3 31.123 21.098 -8.004 30 H GLU 4 H GLU 4 28.359 19.776 -15.729 31 HA GLU 4 HA GLU 4 31.009 18.396 -15.080 32 1HB GLU 4 2HB GLU 4 29.585 16.748 -16.328 33 2HB GLU 4 1HB GLU 4 29.334 17.914 -17.620 34 1HG GLU 4 2HG GLU 4 31.827 17.797 -18.130 35 2HG GLU 4 1HG GLU 4 32.021 16.568 -16.894 36 HE2 GLU 4 HE2 GLU 4 30.426 14.848 -17.064 37 H TYR 5 H TYR 5 32.436 20.062 -15.309 38 HA TYR 5 HA TYR 5 32.178 21.877 -17.753 39 1HB TYR 5 2HB TYR 5 32.470 23.865 -16.865 40 2HB TYR 5 1HB TYR 5 31.277 23.099 -15.841 41 HD1 TYR 5 HD1 TYR 5 32.087 22.253 -13.456 42 HD2 TYR 5 HD2 TYR 5 34.105 25.237 -15.786 43 HE1 TYR 5 HE1 TYR 5 32.967 23.278 -11.426 44 HE2 TYR 5 HE2 TYR 5 35.014 26.191 -13.750 45 HH TYR 5 HH TYR 5 34.226 24.855 -10.560 46 H THR 6 H THR 6 33.809 21.403 -18.973 47 HA THR 6 HA THR 6 36.433 20.521 -17.834 48 HB THR 6 HB THR 6 35.605 20.569 -20.797 49 HG1 THR 6 HG1 THR 6 35.076 18.554 -18.883 50 1HG2 THR 6 1HG2 THR 6 37.983 19.848 -20.379 51 2HG2 THR 6 2HG2 THR 6 36.982 18.489 -20.982 52 3HG2 THR 6 3HG2 THR 6 37.395 18.595 -19.250 53 H VAL 7 H VAL 7 37.497 22.206 -17.179 54 HA VAL 7 HA VAL 7 38.004 24.609 -19.011 55 HB VAL 7 HB VAL 7 38.646 24.419 -16.031 56 1HG1 VAL 7 1HG1 VAL 7 39.187 26.868 -16.070 57 2HG1 VAL 7 2HG1 VAL 7 40.201 25.994 -17.229 58 3HG1 VAL 7 3HG1 VAL 7 38.829 26.946 -17.822 59 1HG2 VAL 7 1HG2 VAL 7 36.371 26.092 -17.316 60 2HG2 VAL 7 2HG2 VAL 7 36.781 26.031 -15.573 61 3HG2 VAL 7 3HG2 VAL 7 36.169 24.589 -16.399 62 HA DPR 8 HA PRO 8 42.367 23.042 -19.277 63 1HB DPR 8 1HB PRO 8 42.786 24.409 -21.097 64 2HB DPR 8 2HB PRO 8 42.800 22.874 -21.997 65 1HG DPR 8 1HG PRO 8 41.134 24.813 -22.794 66 2HG DPR 8 2HG PRO 8 40.523 23.126 -22.671 67 1HD DPR 8 1HD PRO 8 40.036 25.436 -20.727 68 2HD DPR 8 2HD PRO 8 38.906 24.151 -21.235 69 H SER 9 H SER 9 43.360 21.142 -19.919 70 HA SER 9 HA SER 9 41.675 18.632 -20.303 71 1HB SER 9 1HB SER 9 44.639 18.965 -19.552 72 2HB SER 9 2HB SER 9 43.830 17.425 -19.854 73 HG SER 9 HG SER 9 44.844 18.256 -21.708 74 H TYR 10 H TYR 10 40.550 20.160 -18.191 75 HA TYR 10 HA TYR 10 40.893 18.254 -15.869 76 1HB TYR 10 2HB TYR 10 42.051 20.875 -15.768 77 2HB TYR 10 1HB TYR 10 40.535 21.127 -14.976 78 HD1 TYR 10 HD1 TYR 10 40.041 19.922 -12.771 79 HD2 TYR 10 HD2 TYR 10 43.804 19.345 -14.796 80 HE1 TYR 10 HE1 TYR 10 40.991 18.913 -10.783 81 HE2 TYR 10 HE2 TYR 10 44.708 18.345 -12.791 82 HH TYR 10 HH TYR 10 42.758 17.992 -9.840 83 H THR 11 H THR 11 39.102 17.416 -16.303 84 HA THR 11 HA THR 11 36.512 18.735 -16.936 85 HB THR 11 HB THR 11 36.919 15.779 -16.272 86 HG1 THR 11 HG1 THR 11 38.381 16.504 -17.844 87 1HG2 THR 11 1HG2 THR 11 34.493 16.444 -16.638 88 2HG2 THR 11 2HG2 THR 11 35.096 15.352 -17.920 89 3HG2 THR 11 3HG2 THR 11 34.934 17.096 -18.235 90 H PHE 12 H PHE 12 35.493 19.899 -15.268 91 HA PHE 12 HA PHE 12 35.880 18.954 -12.393 92 1HB PHE 12 2HB PHE 12 34.945 21.593 -13.611 93 2HB PHE 12 1HB PHE 12 34.714 21.236 -11.925 94 HD1 PHE 12 HD1 PHE 12 37.279 22.025 -14.513 95 HD2 PHE 12 HD2 PHE 12 36.681 21.073 -10.350 96 HE1 PHE 12 HE1 PHE 12 39.484 22.863 -13.976 97 HE2 PHE 12 HE2 PHE 12 38.894 21.914 -9.860 98 HZ PHE 12 HZ PHE 12 40.322 22.813 -11.660 99 H ARG 13 H ARG 13 34.564 17.188 -12.437 100 HA ARG 13 HA ARG 13 31.578 17.521 -12.898 101 1HB ARG 13 2HB ARG 13 33.270 14.984 -12.413 102 2HB ARG 13 1HB ARG 13 31.508 14.967 -12.513 103 1HG ARG 13 1HG ARG 13 31.595 15.847 -14.846 104 2HG ARG 13 2HG ARG 13 33.362 15.846 -14.782 105 1HD ARG 13 2HD ARG 13 33.296 13.303 -14.419 106 2HD ARG 13 1HD ARG 13 31.528 13.369 -14.584 107 HE ARG 13 HE ARG 13 32.723 14.665 -16.908 108 1HH1 ARG 13 1HH1 ARG 13 32.364 11.301 -15.667 109 2HH1 ARG 13 2HH1 ARG 13 32.489 10.679 -17.388 110 1HH2 ARG 13 1HH2 ARG 13 32.844 13.806 -18.763 111 2HH2 ARG 13 2HH2 ARG 13 32.739 11.989 -18.999 112 H GLY 14 H GLY 14 30.229 17.546 -11.190 113 1HA GLY 14 2HA GLY 14 30.566 16.176 -8.642 114 2HA GLY 14 1HA GLY 14 31.067 17.849 -8.408 115 HA PRO 15 HA PRO 15 26.261 17.800 -8.399 116 1HB PRO 15 2HB PRO 15 25.383 17.387 -5.823 117 2HB PRO 15 1HB PRO 15 25.807 16.073 -6.939 118 1HG PRO 15 2HG PRO 15 27.519 17.253 -4.722 119 2HG PRO 15 1HG PRO 15 27.203 15.522 -5.066 120 1HD PRO 15 2HD PRO 15 29.485 16.908 -5.965 121 2HD PRO 15 1HD PRO 15 28.798 15.517 -6.845 122 H GLY 16 H GLY 16 25.029 19.557 -7.964 123 1HA GLY 16 1HA GLY 16 24.324 21.725 -7.135 124 2HA GLY 16 2HA GLY 16 25.634 21.675 -5.965 125 H CYS 17 H CYS 17 24.632 23.006 -8.943 126 HA CYS 17 HA CYS 17 27.134 23.473 -10.264 127 1HB CYS 17 1HB CYS 17 24.589 25.071 -10.699 128 2HB CYS 17 2HB CYS 17 25.915 24.810 -11.847 129 HA PRO 18 HA PRO 18 28.014 27.184 -7.528 130 1HB PRO 18 1HB PRO 18 30.653 27.038 -7.099 131 2HB PRO 18 2HB PRO 18 29.526 25.778 -6.533 132 1HG PRO 18 2HG PRO 18 31.345 25.694 -8.978 133 2HG PRO 18 1HG PRO 18 31.054 24.407 -7.775 134 1HD PRO 18 1HD PRO 18 29.704 24.690 -10.285 135 2HD PRO 18 2HD PRO 18 29.113 23.712 -8.925 136 H THR 19 H THR 19 30.590 27.257 -10.038 137 HA THR 19 HA THR 19 30.063 30.166 -10.553 138 HB THR 19 HB THR 19 32.065 29.890 -12.116 139 HG1 THR 19 HG1 THR 19 33.325 28.063 -11.811 140 1HG2 THR 19 1HG2 THR 19 32.465 30.852 -9.891 141 2HG2 THR 19 2HG2 THR 19 32.701 29.219 -9.211 142 3HG2 THR 19 3HG2 THR 19 33.841 29.854 -10.434 143 H VAL 20 H VAL 20 29.418 30.942 -12.481 144 HA VAL 20 HA VAL 20 28.625 29.151 -14.806 145 HB VAL 20 HB VAL 20 26.683 30.987 -13.585 146 1HG1 VAL 20 1HG1 VAL 20 26.289 30.730 -16.060 147 2HG1 VAL 20 2HG1 VAL 20 26.068 28.980 -15.883 148 3HG1 VAL 20 3HG1 VAL 20 24.874 30.120 -15.191 149 1HG2 VAL 20 1HG2 VAL 20 26.330 27.890 -13.475 150 2HG2 VAL 20 2HG2 VAL 20 26.757 28.937 -12.111 151 3HG2 VAL 20 3HG2 VAL 20 25.146 29.071 -12.835 152 H LYS 21 H LYS 21 30.492 30.492 -14.756 153 HA LYS 21 HA LYS 21 30.753 33.244 -15.533 154 1HB LYS 21 1HB LYS 21 32.479 31.495 -14.625 155 2HB LYS 21 2HB LYS 21 32.658 30.931 -16.287 156 1HG LYS 21 2HG LYS 21 33.577 33.184 -16.933 157 2HG LYS 21 1HG LYS 21 33.282 33.790 -15.299 158 1HD LYS 21 1HD LYS 21 34.854 32.073 -14.346 159 2HD LYS 21 2HD LYS 21 35.152 31.417 -15.960 160 1HE LYS 21 1HE LYS 21 36.155 33.647 -16.677 161 2HE LYS 21 2HE LYS 21 35.860 34.297 -15.052 162 1HZ LYS 21 1HZ LYS 21 37.296 32.539 -14.154 163 2HZ LYS 21 2HZ LYS 21 37.572 31.934 -15.667 164 3HZ LYS 21 3HZ LYS 21 38.114 33.443 -15.269 165 HA PRO 22 HA PRO 22 29.200 33.491 -19.601 166 1HB PRO 22 2HB PRO 22 30.952 35.795 -20.402 167 2HB PRO 22 1HB PRO 22 29.184 35.694 -20.213 168 1HG PRO 22 1HG PRO 22 30.647 36.939 -18.255 169 2HG PRO 22 2HG PRO 22 29.352 35.806 -17.762 170 1HD PRO 22 1HD PRO 22 32.344 35.148 -18.063 171 2HD PRO 22 2HD PRO 22 31.294 35.012 -16.632 172 H DAL 23 H ALA 23 29.755 31.606 -20.503 173 HA DAL 23 HA ALA 23 32.197 31.352 -22.328 174 1HB DAL 23 1HB ALA 23 30.777 30.410 -24.134 175 2HB DAL 23 2HB ALA 23 29.323 30.583 -23.115 176 3HB DAL 23 3HB ALA 23 30.193 32.030 -23.689 177 H ILE 24 H ILE 24 30.104 29.504 -20.119 178 HA ILE 24 HA ILE 24 31.705 27.029 -20.709 179 HB ILE 24 HB ILE 24 29.690 27.331 -18.485 180 1HG1 ILE 24 2HG1 ILE 24 32.763 27.558 -18.023 181 2HG1 ILE 24 1HG1 ILE 24 31.744 28.963 -18.220 182 1HG2 ILE 24 1HG2 ILE 24 30.044 25.008 -18.994 183 2HG2 ILE 24 2HG2 ILE 24 30.918 25.304 -17.476 184 3HG2 ILE 24 3HG2 ILE 24 31.830 25.185 -19.000 185 1HD1 ILE 24 1HD1 ILE 24 31.406 26.925 -15.986 186 2HD1 ILE 24 2HD1 ILE 24 30.358 28.338 -16.247 187 3HD1 ILE 24 3HD1 ILE 24 32.105 28.573 -15.827 188 H SER 25 H SER 25 30.732 25.314 -21.326 189 HA SER 25 HA SER 25 27.877 25.185 -22.479 190 1HB SER 25 2HB SER 25 29.711 24.780 -24.138 191 2HB SER 25 1HB SER 25 30.394 23.511 -23.102 192 HG SER 25 HG SER 25 27.765 23.558 -24.199 193 H LEU 26 H LEU 26 27.279 25.154 -20.240 194 HA LEU 26 HA LEU 26 28.414 23.212 -18.323 195 1HB LEU 26 2HB LEU 26 27.592 25.732 -17.948 196 2HB LEU 26 1HB LEU 26 26.017 25.024 -17.813 197 HG LEU 26 HG LEU 26 27.028 23.629 -15.738 198 1HD1 LEU 26 1HD2 LEU 26 29.370 25.638 -15.918 199 2HD1 LEU 26 2HD2 LEU 26 29.098 24.385 -14.673 200 3HD1 LEU 26 3HD2 LEU 26 29.444 23.934 -16.362 201 1HD2 LEU 26 1HD1 LEU 26 26.816 25.610 -14.184 202 2HD2 LEU 26 2HD1 LEU 26 25.579 25.698 -15.453 203 3HD2 LEU 26 3HD1 LEU 26 27.020 26.727 -15.562 204 H ARG 27 H ARG 27 27.287 21.605 -17.185 205 HA ARG 27 HA ARG 27 24.749 20.473 -18.505 206 1HB ARG 27 1HB ARG 27 27.301 18.882 -17.812 207 2HB ARG 27 2HB ARG 27 25.738 18.111 -18.004 208 1HG ARG 27 1HG ARG 27 25.547 18.904 -20.364 209 2HG ARG 27 2HG ARG 27 27.101 19.726 -20.231 210 1HD ARG 27 1HD ARG 27 28.253 17.505 -19.828 211 2HD ARG 27 2HD ARG 27 26.692 16.673 -19.959 212 HE ARG 27 HE ARG 27 27.136 18.341 -22.341 213 1HH1 ARG 27 1HH2 ARG 27 28.230 15.171 -21.021 214 2HH1 ARG 27 2HH2 ARG 27 28.593 14.613 -22.731 215 1HH2 ARG 27 2HH1 ARG 27 27.594 17.561 -24.179 216 2HH2 ARG 27 1HH1 ARG 27 28.259 15.863 -24.374 217 H CYS 28 H CYS 28 24.754 22.079 -16.502 218 HA CYS 28 HA CYS 28 24.557 21.218 -13.952 219 1HB CYS 28 1HB CYS 28 24.341 23.593 -14.652 220 2HB CYS 28 2HB CYS 28 22.641 23.309 -15.102 221 H GLU 29 H GLU 29 21.628 20.913 -16.066 222 HA GLU 29 HA GLU 29 20.569 18.720 -14.234 223 1HB GLU 29 1HB GLU 29 18.936 21.217 -15.042 224 2HB GLU 29 2HB GLU 29 18.172 19.718 -14.527 225 1HG GLU 29 2HG GLU 29 19.247 19.862 -12.278 226 2HG GLU 29 1HG GLU 29 20.055 21.364 -12.747 227 HE2 GLU 29 HE2 GLU 29 17.030 19.819 -12.505 Start of MODEL 4 1 1H SER 1 1H SER 1 23.413 20.623 -9.971 2 2H SER 1 2H SER 1 21.776 20.768 -10.143 3 3H SER 1 3H SER 1 22.690 20.179 -11.387 4 HA SER 1 HA SER 1 22.302 18.892 -8.759 5 1HB SER 1 2HB SER 1 20.229 18.891 -10.080 6 2HB SER 1 1HB SER 1 21.075 18.157 -11.456 7 HG SER 1 HG SER 1 21.575 16.390 -10.112 8 H LYS 2 H LYS 2 23.596 18.109 -12.046 9 HA LYS 2 HA LYS 2 26.035 16.879 -10.748 10 1HB LYS 2 2HB LYS 2 24.241 15.063 -11.245 11 2HB LYS 2 1HB LYS 2 24.383 15.478 -12.953 12 1HG LYS 2 2HG LYS 2 26.824 14.826 -12.862 13 2HG LYS 2 1HG LYS 2 26.636 14.431 -11.144 14 1HD LYS 2 2HD LYS 2 24.895 12.639 -11.806 15 2HD LYS 2 1HD LYS 2 25.191 13.046 -13.488 16 1HE LYS 2 2HE LYS 2 26.467 11.119 -13.199 17 2HE LYS 2 1HE LYS 2 27.702 12.364 -13.106 18 1HZ LYS 2 1HZ LYS 2 26.433 10.972 -10.782 19 2HZ LYS 2 2HZ LYS 2 27.959 10.714 -11.356 20 3HZ LYS 2 3HZ LYS 2 27.577 12.155 -10.642 21 H TYR 3 H TYR 3 27.000 18.819 -11.396 22 HA TYR 3 HA TYR 3 26.906 19.785 -14.234 23 1HB TYR 3 1HB TYR 3 27.975 21.773 -13.543 24 2HB TYR 3 2HB TYR 3 26.739 21.395 -12.397 25 HD1 TYR 3 HD1 TYR 3 30.483 21.341 -12.918 26 HD2 TYR 3 HD2 TYR 3 27.324 21.249 -10.012 27 HE1 TYR 3 HE1 TYR 3 32.064 21.829 -11.176 28 HE2 TYR 3 HE2 TYR 3 28.928 21.751 -8.274 29 HH TYR 3 HH TYR 3 31.063 22.105 -7.765 30 H GLU 4 H GLU 4 28.315 19.167 -15.749 31 HA GLU 4 HA GLU 4 31.148 18.186 -15.033 32 1HB GLU 4 1HB GLU 4 29.737 16.398 -15.995 33 2HB GLU 4 2HB GLU 4 29.359 17.386 -17.402 34 1HG GLU 4 2HG GLU 4 31.771 17.300 -18.102 35 2HG GLU 4 1HG GLU 4 32.170 16.317 -16.706 36 HE2 GLU 4 HE2 GLU 4 31.661 16.248 -19.727 37 H TYR 5 H TYR 5 32.513 19.786 -15.492 38 HA TYR 5 HA TYR 5 32.172 21.367 -18.096 39 1HB TYR 5 1HB TYR 5 32.846 23.418 -17.340 40 2HB TYR 5 2HB TYR 5 31.386 22.863 -16.542 41 HD1 TYR 5 HD1 TYR 5 35.059 23.570 -16.012 42 HD2 TYR 5 HD2 TYR 5 31.242 23.054 -14.094 43 HE1 TYR 5 HE1 TYR 5 35.956 24.452 -13.943 44 HE2 TYR 5 HE2 TYR 5 32.192 23.925 -12.032 45 HH TYR 5 HH TYR 5 35.578 24.952 -11.830 46 H THR 6 H THR 6 33.756 20.790 -19.348 47 HA THR 6 HA THR 6 36.408 19.920 -18.248 48 HB THR 6 HB THR 6 35.406 19.741 -21.151 49 HG1 THR 6 HG1 THR 6 35.016 17.894 -19.043 50 1HG2 THR 6 1HG2 THR 6 37.801 19.042 -20.863 51 2HG2 THR 6 2HG2 THR 6 37.315 17.906 -19.573 52 3HG2 THR 6 3HG2 THR 6 36.763 17.634 -21.248 53 H VAL 7 H VAL 7 37.502 21.652 -17.776 54 HA VAL 7 HA VAL 7 38.077 23.794 -19.908 55 HB VAL 7 HB VAL 7 38.289 23.960 -16.857 56 1HG1 VAL 7 1HG2 VAL 7 39.221 26.235 -18.733 57 2HG1 VAL 7 2HG2 VAL 7 40.273 25.176 -17.776 58 3HG1 VAL 7 3HG2 VAL 7 39.170 26.283 -16.943 59 1HG2 VAL 7 1HG1 VAL 7 35.978 24.406 -17.851 60 2HG2 VAL 7 2HG1 VAL 7 36.610 25.792 -16.946 61 3HG2 VAL 7 3HG1 VAL 7 36.624 25.790 -18.735 62 HA DPR 8 HA PRO 8 42.448 22.333 -19.712 63 1HB DPR 8 1HB PRO 8 42.952 23.504 -21.642 64 2HB DPR 8 2HB PRO 8 43.080 21.880 -22.357 65 1HG DPR 8 1HG PRO 8 41.412 23.646 -23.485 66 2HG DPR 8 2HG PRO 8 40.845 21.963 -23.205 67 1HD DPR 8 1HD PRO 8 40.163 24.459 -21.575 68 2HD DPR 8 2HD PRO 8 39.104 23.089 -22.009 69 H SER 9 H SER 9 43.545 20.410 -20.076 70 HA SER 9 HA SER 9 41.951 17.815 -20.254 71 1HB SER 9 1HB SER 9 44.867 18.334 -19.424 72 2HB SER 9 2HB SER 9 44.117 16.742 -19.568 73 HG SER 9 HG SER 9 43.619 17.246 -21.746 74 H TYR 10 H TYR 10 40.666 19.533 -18.411 75 HA TYR 10 HA TYR 10 40.922 17.925 -15.868 76 1HB TYR 10 2HB TYR 10 42.026 20.573 -16.000 77 2HB TYR 10 1HB TYR 10 40.466 20.867 -15.313 78 HD1 TYR 10 HD1 TYR 10 39.880 19.880 -13.022 79 HD2 TYR 10 HD2 TYR 10 43.765 19.224 -14.776 80 HE1 TYR 10 HE1 TYR 10 40.746 19.114 -10.892 81 HE2 TYR 10 HE2 TYR 10 44.584 18.470 -12.631 82 HH TYR 10 HH TYR 10 44.118 18.083 -10.504 83 H THR 11 H THR 11 39.159 17.003 -16.305 84 HA THR 11 HA THR 11 36.563 18.256 -17.116 85 HB THR 11 HB THR 11 37.014 15.353 -16.274 86 HG1 THR 11 HG1 THR 11 37.335 14.999 -18.472 87 1HG2 THR 11 1HG2 THR 11 34.570 15.906 -16.600 88 2HG2 THR 11 2HG2 THR 11 35.163 14.809 -17.880 89 3HG2 THR 11 3HG2 THR 11 34.930 16.540 -18.222 90 H PHE 12 H PHE 12 35.584 19.541 -15.539 91 HA PHE 12 HA PHE 12 35.898 18.807 -12.606 92 1HB PHE 12 2HB PHE 12 34.734 21.258 -13.971 93 2HB PHE 12 1HB PHE 12 34.672 21.021 -12.251 94 HD1 PHE 12 HD1 PHE 12 36.973 21.803 -15.084 95 HD2 PHE 12 HD2 PHE 12 36.752 21.139 -10.829 96 HE1 PHE 12 HE1 PHE 12 39.141 22.833 -14.783 97 HE2 PHE 12 HE2 PHE 12 38.923 22.171 -10.574 98 HZ PHE 12 HZ PHE 12 40.148 23.020 -12.542 99 H ARG 13 H ARG 13 34.636 16.953 -12.592 100 HA ARG 13 HA ARG 13 31.653 17.209 -13.048 101 1HB ARG 13 2HB ARG 13 33.341 14.737 -12.294 102 2HB ARG 13 1HB ARG 13 31.579 14.722 -12.359 103 1HG ARG 13 1HG ARG 13 31.632 15.342 -14.786 104 2HG ARG 13 2HG ARG 13 33.399 15.339 -14.747 105 1HD ARG 13 2HD ARG 13 33.323 12.849 -14.118 106 2HD ARG 13 1HD ARG 13 31.552 12.913 -14.257 107 HE ARG 13 HE ARG 13 32.432 13.935 -16.739 108 1HH1 ARG 13 1HH1 ARG 13 33.153 10.815 -15.096 109 2HH1 ARG 13 2HH1 ARG 13 33.443 10.043 -16.736 110 1HH2 ARG 13 1HH2 ARG 13 32.790 12.925 -18.486 111 2HH2 ARG 13 2HH2 ARG 13 33.251 11.150 -18.502 112 H GLY 14 H GLY 14 30.425 17.658 -11.357 113 1HA GLY 14 2HA GLY 14 30.847 16.798 -8.540 114 2HA GLY 14 1HA GLY 14 31.261 18.501 -8.763 115 HA PRO 15 HA PRO 15 26.481 17.998 -8.860 116 1HB PRO 15 2HB PRO 15 25.390 17.710 -6.345 117 2HB PRO 15 1HB PRO 15 26.092 16.372 -7.278 118 1HG PRO 15 1HG PRO 15 27.403 17.975 -5.054 119 2HG PRO 15 2HG PRO 15 27.350 16.193 -5.241 120 1HD PRO 15 2HD PRO 15 29.517 17.785 -6.072 121 2HD PRO 15 1HD PRO 15 29.100 16.243 -6.866 122 H GLY 16 H GLY 16 24.987 19.557 -8.763 123 1HA GLY 16 2HA GLY 16 23.922 21.678 -8.504 124 2HA GLY 16 1HA GLY 16 24.700 21.715 -6.931 125 H CYS 17 H CYS 17 24.866 22.896 -10.204 126 HA CYS 17 HA CYS 17 27.528 23.921 -10.291 127 1HB CYS 17 2HB CYS 17 26.826 25.374 -12.179 128 2HB CYS 17 1HB CYS 17 26.501 23.645 -12.330 129 HA PRO 18 HA PRO 18 26.517 27.508 -7.434 130 1HB PRO 18 2HB PRO 18 28.784 27.873 -6.030 131 2HB PRO 18 1HB PRO 18 27.773 26.414 -5.860 132 1HG PRO 18 1HG PRO 18 30.367 26.715 -7.432 133 2HG PRO 18 2HG PRO 18 29.869 25.373 -6.367 134 1HD PRO 18 1HD PRO 18 29.574 25.444 -9.199 135 2HD PRO 18 2HD PRO 18 28.679 24.351 -8.123 136 H THR 19 H THR 19 29.793 28.158 -8.783 137 HA THR 19 HA THR 19 28.920 30.844 -9.834 138 HB THR 19 HB THR 19 31.344 30.880 -10.689 139 HG1 THR 19 HG1 THR 19 31.571 28.672 -8.955 140 1HG2 THR 19 1HG2 THR 19 31.093 30.741 -7.656 141 2HG2 THR 19 2HG2 THR 19 32.431 31.486 -8.584 142 3HG2 THR 19 3HG2 THR 19 30.785 32.171 -8.679 143 H VAL 20 H VAL 20 28.979 31.331 -12.161 144 HA VAL 20 HA VAL 20 29.301 29.328 -14.143 145 HB VAL 20 HB VAL 20 27.280 29.488 -15.157 146 1HG1 VAL 20 1HG1 VAL 20 26.861 27.887 -12.555 147 2HG1 VAL 20 2HG1 VAL 20 26.086 27.510 -14.120 148 3HG1 VAL 20 3HG1 VAL 20 27.844 27.371 -13.939 149 1HG2 VAL 20 1HG2 VAL 20 25.922 31.316 -14.058 150 2HG2 VAL 20 2HG2 VAL 20 25.689 30.293 -12.627 151 3HG2 VAL 20 3HG2 VAL 20 24.954 29.842 -14.191 152 H LYS 21 H LYS 21 30.670 30.849 -14.326 153 HA LYS 21 HA LYS 21 30.242 33.669 -15.240 154 1HB LYS 21 2HB LYS 21 32.751 31.882 -15.452 155 2HB LYS 21 1HB LYS 21 32.738 33.543 -16.018 156 1HG LYS 21 1HG LYS 21 32.256 34.447 -13.778 157 2HG LYS 21 2HG LYS 21 32.147 32.822 -13.096 158 1HD LYS 21 1HD LYS 21 34.536 32.372 -13.679 159 2HD LYS 21 2HD LYS 21 34.683 33.983 -14.405 160 1HE LYS 21 1HE LYS 21 34.218 35.038 -12.141 161 2HE LYS 21 2HE LYS 21 34.089 33.421 -11.421 162 1HZ LYS 21 1HZ LYS 21 36.390 32.993 -12.129 163 2HZ LYS 21 2HZ LYS 21 36.506 34.501 -12.794 164 3HZ LYS 21 3HZ LYS 21 36.317 34.331 -11.162 165 HA PRO 22 HA PRO 22 29.002 33.126 -19.355 166 1HB PRO 22 2HB PRO 22 30.277 35.688 -20.344 167 2HB PRO 22 1HB PRO 22 28.564 35.233 -20.199 168 1HG PRO 22 1HG PRO 22 29.646 36.962 -18.370 169 2HG PRO 22 2HG PRO 22 28.567 35.660 -17.788 170 1HD PRO 22 2HD PRO 22 31.649 35.566 -17.897 171 2HD PRO 22 1HD PRO 22 30.566 35.397 -16.494 172 H DAL 23 H ALA 23 29.678 31.711 -20.831 173 HA DAL 23 HA ALA 23 32.537 31.223 -21.394 174 1HB DAL 23 1HB ALA 23 30.801 31.847 -23.862 175 2HB DAL 23 2HB ALA 23 32.137 32.853 -23.240 176 3HB DAL 23 3HB ALA 23 32.472 31.221 -23.879 177 H ILE 24 H ILE 24 31.488 29.610 -19.914 178 HA ILE 24 HA ILE 24 31.430 27.115 -21.258 179 HB ILE 24 HB ILE 24 30.549 27.352 -18.404 180 1HG1 ILE 24 2HG1 ILE 24 33.598 26.997 -18.962 181 2HG1 ILE 24 1HG1 ILE 24 32.910 28.587 -18.870 182 1HG2 ILE 24 1HG2 ILE 24 31.605 25.047 -18.117 183 2HG2 ILE 24 2HG2 ILE 24 30.359 25.048 -19.382 184 3HG2 ILE 24 3HG2 ILE 24 32.088 25.074 -19.838 185 1HD1 ILE 24 1HD1 ILE 24 32.659 26.579 -16.621 186 2HD1 ILE 24 2HD1 ILE 24 32.013 28.241 -16.625 187 3HD1 ILE 24 3HD1 ILE 24 33.804 27.975 -16.688 188 H SER 25 H SER 25 29.889 25.684 -21.516 189 HA SER 25 HA SER 25 26.891 26.341 -21.292 190 1HB SER 25 2HB SER 25 27.695 26.166 -23.654 191 2HB SER 25 1HB SER 25 28.399 24.572 -23.320 192 HG SER 25 HG SER 25 25.661 25.306 -23.042 193 H LEU 26 H LEU 26 26.787 25.576 -19.184 194 HA LEU 26 HA LEU 26 28.275 23.240 -18.179 195 1HB LEU 26 1HB LEU 26 26.015 24.833 -16.855 196 2HB LEU 26 2HB LEU 26 26.854 23.537 -16.065 197 HG LEU 26 HG LEU 26 27.591 25.473 -15.096 198 1HD1 LEU 26 1HD2 LEU 26 30.021 25.421 -15.163 199 2HD1 LEU 26 2HD2 LEU 26 29.338 23.781 -15.263 200 3HD1 LEU 26 3HD2 LEU 26 29.971 24.563 -16.727 201 1HD2 LEU 26 1HD1 LEU 26 28.740 27.423 -16.210 202 2HD2 LEU 26 2HD1 LEU 26 28.537 26.626 -17.796 203 3HD2 LEU 26 3HD1 LEU 26 27.117 27.177 -16.881 204 H ARG 27 H ARG 27 27.432 21.315 -17.371 205 HA ARG 27 HA ARG 27 24.800 20.283 -18.588 206 1HB ARG 27 1HB ARG 27 27.340 18.690 -17.846 207 2HB ARG 27 2HB ARG 27 25.781 17.915 -18.056 208 1HG ARG 27 2HG ARG 27 25.617 18.650 -20.424 209 2HG ARG 27 1HG ARG 27 27.149 19.512 -20.291 210 1HD ARG 27 2HD ARG 27 28.356 17.339 -19.837 211 2HD ARG 27 1HD ARG 27 26.822 16.457 -19.952 212 HE ARG 27 HE ARG 27 27.070 17.986 -22.389 213 1HH1 ARG 27 2HH2 ARG 27 28.853 15.224 -20.922 214 2HH1 ARG 27 1HH2 ARG 27 29.328 14.663 -22.604 215 1HH2 ARG 27 1HH1 ARG 27 27.686 17.227 -24.195 216 2HH2 ARG 27 2HH1 ARG 27 28.716 15.713 -24.307 217 H CYS 28 H CYS 28 24.936 21.884 -16.548 218 HA CYS 28 HA CYS 28 24.721 20.940 -14.010 219 1HB CYS 28 1HB CYS 28 24.864 23.348 -14.647 220 2HB CYS 28 2HB CYS 28 23.121 23.356 -14.981 221 H GLU 29 H GLU 29 21.683 21.293 -15.981 222 HA GLU 29 HA GLU 29 20.108 19.860 -13.780 223 1HB GLU 29 2HB GLU 29 19.168 21.363 -16.305 224 2HB GLU 29 1HB GLU 29 18.077 20.421 -15.299 225 1HG GLU 29 2HG GLU 29 18.494 21.886 -13.330 226 2HG GLU 29 1HG GLU 29 19.631 22.858 -14.274 227 HE2 GLU 29 HE2 GLU 29 15.631 23.041 -14.945 Start of MODEL 5 1 1H SER 1 1H SER 1 22.785 21.001 -10.583 2 2H SER 1 2H SER 1 21.896 20.076 -11.623 3 3H SER 1 3H SER 1 21.140 20.949 -10.441 4 HA SER 1 HA SER 1 22.151 19.658 -8.713 5 1HB SER 1 2HB SER 1 20.812 17.617 -8.992 6 2HB SER 1 1HB SER 1 19.913 19.046 -9.529 7 HG SER 1 HG SER 1 20.584 18.550 -11.667 8 H LYS 2 H LYS 2 23.199 18.285 -11.871 9 HA LYS 2 HA LYS 2 25.675 17.195 -10.507 10 1HB LYS 2 1HB LYS 2 23.933 15.342 -10.728 11 2HB LYS 2 2HB LYS 2 23.907 15.603 -12.472 12 1HG LYS 2 1HG LYS 2 26.345 14.981 -12.573 13 2HG LYS 2 2HG LYS 2 26.352 14.742 -10.816 14 1HD LYS 2 1HD LYS 2 24.635 12.878 -11.077 15 2HD LYS 2 2HD LYS 2 24.638 13.121 -12.827 16 1HE LYS 2 1HE LYS 2 27.092 12.483 -12.914 17 2HE LYS 2 2HE LYS 2 27.088 12.238 -11.157 18 1HZ LYS 2 1HZ LYS 2 26.716 10.164 -12.342 19 2HZ LYS 2 2HZ LYS 2 25.373 10.760 -13.096 20 3HZ LYS 2 3HZ LYS 2 25.369 10.532 -11.460 21 H TYR 3 H TYR 3 26.647 18.999 -11.343 22 HA TYR 3 HA TYR 3 26.567 19.721 -14.249 23 1HB TYR 3 2HB TYR 3 27.637 21.742 -13.701 24 2HB TYR 3 1HB TYR 3 26.455 21.459 -12.471 25 HD1 TYR 3 HD1 TYR 3 30.132 21.480 -13.193 26 HD2 TYR 3 HD2 TYR 3 27.181 21.121 -10.080 27 HE1 TYR 3 HE1 TYR 3 31.844 21.728 -11.531 28 HE2 TYR 3 HE2 TYR 3 28.925 21.298 -8.437 29 HH TYR 3 HH TYR 3 32.337 21.762 -9.354 30 H GLU 4 H GLU 4 28.282 19.715 -15.676 31 HA GLU 4 HA GLU 4 30.974 18.483 -14.902 32 1HB GLU 4 1HB GLU 4 29.660 16.699 -16.006 33 2HB GLU 4 2HB GLU 4 29.328 17.727 -17.392 34 1HG GLU 4 2HG GLU 4 31.755 17.718 -17.992 35 2HG GLU 4 1HG GLU 4 32.132 16.743 -16.589 36 HE2 GLU 4 HE2 GLU 4 33.056 15.562 -18.125 37 H TYR 5 H TYR 5 32.384 20.070 -15.284 38 HA TYR 5 HA TYR 5 32.075 21.809 -17.796 39 1HB TYR 5 1HB TYR 5 32.742 23.792 -16.934 40 2HB TYR 5 2HB TYR 5 31.325 23.186 -16.130 41 HD1 TYR 5 HD1 TYR 5 35.008 23.858 -15.636 42 HD2 TYR 5 HD2 TYR 5 31.196 23.339 -13.703 43 HE1 TYR 5 HE1 TYR 5 35.889 24.785 -13.580 44 HE2 TYR 5 HE2 TYR 5 32.127 24.239 -11.663 45 HH TYR 5 HH TYR 5 35.506 25.317 -11.480 46 H THR 6 H THR 6 33.569 21.118 -19.076 47 HA THR 6 HA THR 6 36.276 20.259 -18.104 48 HB THR 6 HB THR 6 35.137 20.099 -20.954 49 HG1 THR 6 HG1 THR 6 34.427 18.042 -20.377 50 1HG2 THR 6 1HG2 THR 6 36.512 18.020 -21.158 51 2HG2 THR 6 2HG2 THR 6 37.554 19.427 -20.781 52 3HG2 THR 6 3HG2 THR 6 37.132 18.255 -19.501 53 H VAL 7 H VAL 7 37.267 22.070 -17.606 54 HA VAL 7 HA VAL 7 37.751 24.228 -19.740 55 HB VAL 7 HB VAL 7 38.075 24.374 -16.700 56 1HG1 VAL 7 1HG1 VAL 7 38.808 26.698 -18.608 57 2HG1 VAL 7 2HG1 VAL 7 38.844 26.741 -16.818 58 3HG1 VAL 7 3HG1 VAL 7 39.955 25.689 -17.709 59 1HG2 VAL 7 1HG2 VAL 7 35.704 24.718 -17.566 60 2HG2 VAL 7 2HG2 VAL 7 36.313 26.140 -16.702 61 3HG2 VAL 7 3HG2 VAL 7 36.237 26.125 -18.491 62 HA DPR 8 HA PRO 8 42.154 22.801 -19.687 63 1HB DPR 8 2HB PRO 8 42.611 24.043 -21.588 64 2HB DPR 8 1HB PRO 8 42.710 22.445 -22.363 65 1HG DPR 8 1HG PRO 8 41.024 24.264 -23.381 66 2HG DPR 8 2HG PRO 8 40.459 22.572 -23.154 67 1HD DPR 8 2HD PRO 8 39.815 25.004 -21.420 68 2HD DPR 8 1HD PRO 8 38.752 23.643 -21.869 69 H SER 9 H SER 9 43.231 20.877 -20.176 70 HA SER 9 HA SER 9 41.582 18.316 -20.382 71 1HB SER 9 2HB SER 9 44.548 18.739 -19.697 72 2HB SER 9 1HB SER 9 43.753 17.171 -19.872 73 HG SER 9 HG SER 9 43.151 17.788 -21.992 74 H TYR 10 H TYR 10 40.405 19.947 -18.436 75 HA TYR 10 HA TYR 10 40.774 18.252 -15.961 76 1HB TYR 10 2HB TYR 10 41.798 20.949 -16.057 77 2HB TYR 10 1HB TYR 10 40.275 21.149 -15.267 78 HD1 TYR 10 HD1 TYR 10 39.864 20.041 -12.994 79 HD2 TYR 10 HD2 TYR 10 43.656 19.611 -15.000 80 HE1 TYR 10 HE1 TYR 10 40.888 19.237 -10.949 81 HE2 TYR 10 HE2 TYR 10 44.633 18.811 -12.937 82 HH TYR 10 HH TYR 10 44.314 18.327 -10.806 83 H THR 11 H THR 11 39.023 17.311 -16.362 84 HA THR 11 HA THR 11 36.377 18.503 -17.083 85 HB THR 11 HB THR 11 36.954 15.605 -16.295 86 HG1 THR 11 HG1 THR 11 37.235 15.299 -18.512 87 1HG2 THR 11 1HG2 THR 11 34.803 16.717 -18.211 88 2HG2 THR 11 2HG2 THR 11 34.481 16.095 -16.574 89 3HG2 THR 11 3HG2 THR 11 35.095 15.000 -17.847 90 H PHE 12 H PHE 12 35.471 19.785 -15.435 91 HA PHE 12 HA PHE 12 35.785 18.925 -12.536 92 1HB PHE 12 1HB PHE 12 34.638 21.443 -13.774 93 2HB PHE 12 2HB PHE 12 34.603 21.127 -12.065 94 HD1 PHE 12 HD1 PHE 12 36.847 22.066 -14.884 95 HD2 PHE 12 HD2 PHE 12 36.726 21.126 -10.677 96 HE1 PHE 12 HE1 PHE 12 39.040 23.045 -14.574 97 HE2 PHE 12 HE2 PHE 12 38.923 22.116 -10.418 98 HZ PHE 12 HZ PHE 12 40.099 23.082 -12.354 99 H ARG 13 H ARG 13 34.507 17.061 -12.647 100 HA ARG 13 HA ARG 13 31.511 17.372 -12.990 101 1HB ARG 13 2HB ARG 13 33.194 14.857 -12.360 102 2HB ARG 13 1HB ARG 13 31.432 14.861 -12.379 103 1HG ARG 13 1HG ARG 13 31.447 15.553 -14.807 104 2HG ARG 13 2HG ARG 13 33.210 15.478 -14.803 105 1HD ARG 13 1HD ARG 13 33.089 13.001 -14.226 106 2HD ARG 13 2HD ARG 13 31.316 13.101 -14.259 107 HE ARG 13 HE ARG 13 32.226 14.142 -16.784 108 1HH1 ARG 13 1HH2 ARG 13 32.344 10.910 -15.195 109 2HH1 ARG 13 2HH2 ARG 13 32.384 10.124 -16.852 110 1HH2 ARG 13 2HH1 ARG 13 32.276 13.106 -18.551 111 2HH2 ARG 13 1HH1 ARG 13 32.348 11.273 -18.599 112 H GLY 14 H GLY 14 30.257 17.590 -11.228 113 1HA GLY 14 2HA GLY 14 30.776 16.538 -8.525 114 2HA GLY 14 1HA GLY 14 31.200 18.250 -8.579 115 HA PRO 15 HA PRO 15 26.395 17.912 -8.482 116 1HB PRO 15 1HB PRO 15 25.468 17.390 -5.935 117 2HB PRO 15 2HB PRO 15 25.973 16.129 -7.078 118 1HG PRO 15 1HG PRO 15 27.588 17.321 -4.791 119 2HG PRO 15 2HG PRO 15 27.355 15.589 -5.185 120 1HD PRO 15 2HD PRO 15 29.594 17.078 -5.999 121 2HD PRO 15 1HD PRO 15 28.970 15.700 -6.944 122 H GLY 16 H GLY 16 25.020 19.568 -8.001 123 1HA GLY 16 1HA GLY 16 24.191 21.674 -7.162 124 2HA GLY 16 2HA GLY 16 25.496 21.692 -5.987 125 H CYS 17 H CYS 17 24.438 22.962 -8.988 126 HA CYS 17 HA CYS 17 26.927 23.644 -10.246 127 1HB CYS 17 1HB CYS 17 24.298 25.079 -10.750 128 2HB CYS 17 2HB CYS 17 25.658 24.861 -11.864 129 HA PRO 18 HA PRO 18 27.365 27.296 -7.328 130 1HB PRO 18 2HB PRO 18 29.975 27.307 -6.732 131 2HB PRO 18 1HB PRO 18 28.912 25.936 -6.323 132 1HG PRO 18 2HG PRO 18 30.891 26.140 -8.630 133 2HG PRO 18 1HG PRO 18 30.609 24.758 -7.536 134 1HD PRO 18 1HD PRO 18 29.417 25.143 -10.120 135 2HD PRO 18 2HD PRO 18 28.827 24.006 -8.891 136 H THR 19 H THR 19 30.094 27.724 -9.582 137 HA THR 19 HA THR 19 29.126 30.544 -10.182 138 HB THR 19 HB THR 19 31.321 30.594 -9.426 139 HG1 THR 19 HG1 THR 19 32.168 31.726 -11.160 140 1HG2 THR 19 1HG2 THR 19 32.436 28.425 -10.137 141 2HG2 THR 19 2HG2 THR 19 33.363 29.853 -10.674 142 3HG2 THR 19 3HG2 THR 19 32.352 28.956 -11.839 143 H VAL 20 H VAL 20 29.197 31.282 -12.325 144 HA VAL 20 HA VAL 20 28.890 29.393 -14.630 145 HB VAL 20 HB VAL 20 26.571 31.084 -14.004 146 1HG1 VAL 20 1HG2 VAL 20 26.705 28.919 -16.233 147 2HG1 VAL 20 2HG2 VAL 20 26.814 30.670 -16.479 148 3HG1 VAL 20 3HG2 VAL 20 25.285 29.966 -15.930 149 1HG2 VAL 20 1HG1 VAL 20 26.465 27.988 -13.744 150 2HG2 VAL 20 2HG1 VAL 20 26.439 29.147 -12.409 151 3HG2 VAL 20 3HG1 VAL 20 25.055 29.069 -13.514 152 H LYS 21 H LYS 21 30.550 30.738 -14.490 153 HA LYS 21 HA LYS 21 30.833 33.540 -15.419 154 1HB LYS 21 2HB LYS 21 32.891 31.248 -15.632 155 2HB LYS 21 1HB LYS 21 33.271 32.881 -16.144 156 1HG LYS 21 1HG LYS 21 32.947 33.824 -13.903 157 2HG LYS 21 2HG LYS 21 32.418 32.266 -13.265 158 1HD LYS 21 1HD LYS 21 34.645 31.252 -13.768 159 2HD LYS 21 2HD LYS 21 35.214 32.789 -14.446 160 1HE LYS 21 2HE LYS 21 34.927 33.892 -12.180 161 2HE LYS 21 1HE LYS 21 34.363 32.352 -11.503 162 1HZ LYS 21 1HZ LYS 21 36.732 32.669 -11.129 163 2HZ LYS 21 2HZ LYS 21 36.510 31.365 -12.118 164 3HZ LYS 21 3HZ LYS 21 37.036 32.799 -12.748 165 HA PRO 22 HA PRO 22 29.623 33.519 -19.549 166 1HB PRO 22 1HB PRO 22 31.498 35.701 -20.420 167 2HB PRO 22 2HB PRO 22 29.722 35.680 -20.299 168 1HG PRO 22 2HG PRO 22 31.170 37.012 -18.391 169 2HG PRO 22 1HG PRO 22 29.798 35.988 -17.872 170 1HD PRO 22 2HD PRO 22 32.765 35.153 -17.975 171 2HD PRO 22 1HD PRO 22 31.651 35.184 -16.586 172 H DAL 23 H ALA 23 30.082 31.634 -20.484 173 HA DAL 23 HA ALA 23 32.636 31.246 -22.136 174 1HB DAL 23 1HB ALA 23 29.766 30.601 -23.033 175 2HB DAL 23 2HB ALA 23 31.249 30.366 -23.997 176 3HB DAL 23 3HB ALA 23 30.722 32.009 -23.569 177 H ILE 24 H ILE 24 30.385 29.446 -20.038 178 HA ILE 24 HA ILE 24 31.977 26.950 -20.543 179 HB ILE 24 HB ILE 24 29.836 27.277 -18.448 180 1HG1 ILE 24 1HG1 ILE 24 32.880 27.455 -17.798 181 2HG1 ILE 24 2HG1 ILE 24 31.905 28.878 -18.066 182 1HG2 ILE 24 1HG2 ILE 24 31.961 25.095 -18.851 183 2HG2 ILE 24 2HG2 ILE 24 30.177 24.948 -18.909 184 3HG2 ILE 24 3HG2 ILE 24 31.003 25.226 -17.359 185 1HD1 ILE 24 1HD1 ILE 24 32.109 28.496 -15.656 186 2HD1 ILE 24 2HD1 ILE 24 30.385 28.304 -16.186 187 3HD1 ILE 24 3HD1 ILE 24 31.377 26.865 -15.851 188 H SER 25 H SER 25 31.037 25.250 -21.224 189 HA SER 25 HA SER 25 28.256 25.133 -22.551 190 1HB SER 25 2HB SER 25 30.187 24.719 -24.096 191 2HB SER 25 1HB SER 25 30.800 23.448 -23.020 192 HG SER 25 HG SER 25 29.509 22.634 -24.711 193 H LEU 26 H LEU 26 27.523 25.104 -20.362 194 HA LEU 26 HA LEU 26 28.570 23.200 -18.361 195 1HB LEU 26 2HB LEU 26 27.777 25.706 -18.051 196 2HB LEU 26 1HB LEU 26 26.171 25.046 -18.048 197 HG LEU 26 HG LEU 26 26.947 23.648 -15.888 198 1HD1 LEU 26 1HD2 LEU 26 29.380 25.549 -15.907 199 2HD1 LEU 26 2HD2 LEU 26 28.942 24.369 -14.638 200 3HD1 LEU 26 3HD2 LEU 26 29.390 23.813 -16.264 201 1HD2 LEU 26 1HD1 LEU 26 26.672 25.648 -14.370 202 2HD2 LEU 26 2HD1 LEU 26 27.043 26.743 -15.728 203 3HD2 LEU 26 3HD1 LEU 26 25.557 25.773 -15.744 204 H ARG 27 H ARG 27 27.411 21.618 -17.247 205 HA ARG 27 HA ARG 27 24.900 20.474 -18.595 206 1HB ARG 27 1HB ARG 27 27.454 18.877 -17.922 207 2HB ARG 27 2HB ARG 27 25.890 18.107 -18.112 208 1HG ARG 27 2HG ARG 27 25.686 18.922 -20.463 209 2HG ARG 27 1HG ARG 27 27.241 19.742 -20.331 210 1HD ARG 27 1HD ARG 27 28.394 17.515 -19.954 211 2HD ARG 27 2HD ARG 27 26.832 16.687 -20.086 212 HE ARG 27 HE ARG 27 27.071 18.273 -22.470 213 1HH1 ARG 27 1HH2 ARG 27 28.923 15.491 -21.123 214 2HH1 ARG 27 2HH2 ARG 27 29.399 15.014 -22.830 215 1HH2 ARG 27 2HH1 ARG 27 27.693 17.604 -24.303 216 2HH2 ARG 27 1HH1 ARG 27 28.755 16.119 -24.485 217 H CYS 28 H CYS 28 24.874 22.068 -16.579 218 HA CYS 28 HA CYS 28 24.588 21.151 -14.042 219 1HB CYS 28 2HB CYS 28 24.429 23.532 -14.674 220 2HB CYS 28 1HB CYS 28 22.774 23.280 -15.281 221 H GLU 29 H GLU 29 21.724 20.971 -16.272 222 HA GLU 29 HA GLU 29 20.609 18.671 -14.610 223 1HB GLU 29 2HB GLU 29 19.012 21.226 -15.297 224 2HB GLU 29 1HB GLU 29 18.226 19.704 -14.896 225 1HG GLU 29 1HG GLU 29 19.246 19.697 -12.618 226 2HG GLU 29 2HG GLU 29 20.078 21.218 -12.971 227 HE2 GLU 29 HE2 GLU 29 17.301 23.244 -12.728 Start of MODEL 6 1 1H SER 1 1H SER 1 22.405 20.567 -10.789 2 2H SER 1 2H SER 1 20.795 20.385 -10.466 3 3H SER 1 3H SER 1 21.563 19.318 -11.468 4 HA SER 1 HA SER 1 22.091 19.696 -8.584 5 1HB SER 1 1HB SER 1 21.001 17.526 -8.211 6 2HB SER 1 2HB SER 1 19.889 18.656 -9.001 7 HG SER 1 HG SER 1 21.476 16.672 -10.280 8 H LYS 2 H LYS 2 23.217 17.904 -11.465 9 HA LYS 2 HA LYS 2 25.720 17.147 -9.943 10 1HB LYS 2 2HB LYS 2 24.113 15.166 -9.999 11 2HB LYS 2 1HB LYS 2 24.116 15.240 -11.761 12 1HG LYS 2 2HG LYS 2 26.591 14.779 -11.751 13 2HG LYS 2 1HG LYS 2 26.573 14.732 -9.979 14 1HD LYS 2 1HD LYS 2 24.989 12.738 -10.061 15 2HD LYS 2 2HD LYS 2 25.019 12.788 -11.827 16 1HE LYS 2 2HE LYS 2 27.511 12.315 -11.802 17 2HE LYS 2 1HE LYS 2 27.482 12.265 -10.029 18 1HZ LYS 2 1HZ LYS 2 25.889 10.420 -10.167 19 2HZ LYS 2 2HZ LYS 2 27.277 10.052 -10.984 20 3HZ LYS 2 3HZ LYS 2 25.914 10.467 -11.818 21 H TYR 3 H TYR 3 26.615 18.878 -10.942 22 HA TYR 3 HA TYR 3 26.519 19.483 -13.823 23 1HB TYR 3 2HB TYR 3 28.004 21.321 -13.380 24 2HB TYR 3 1HB TYR 3 26.723 21.265 -12.209 25 HD1 TYR 3 HD1 TYR 3 27.295 21.220 -9.804 26 HD2 TYR 3 HD2 TYR 3 30.412 20.523 -12.681 27 HE1 TYR 3 HE1 TYR 3 28.988 21.415 -8.060 28 HE2 TYR 3 HE2 TYR 3 32.065 20.720 -10.919 29 HH TYR 3 HH TYR 3 31.128 21.361 -7.554 30 H GLU 4 H GLU 4 28.111 19.350 -15.389 31 HA GLU 4 HA GLU 4 30.798 18.058 -14.836 32 1HB GLU 4 2HB GLU 4 29.361 16.173 -15.571 33 2HB GLU 4 1HB GLU 4 28.899 17.039 -17.031 34 1HG GLU 4 1HG GLU 4 31.287 16.929 -17.838 35 2HG GLU 4 2HG GLU 4 31.764 16.066 -16.390 36 HE2 GLU 4 HE2 GLU 4 30.372 14.122 -19.487 37 H TYR 5 H TYR 5 31.964 19.812 -15.344 38 HA TYR 5 HA TYR 5 31.444 21.257 -18.013 39 1HB TYR 5 2HB TYR 5 32.035 23.365 -17.285 40 2HB TYR 5 1HB TYR 5 30.620 22.746 -16.475 41 HD1 TYR 5 HD1 TYR 5 33.988 24.162 -15.979 42 HD2 TYR 5 HD2 TYR 5 30.652 22.329 -13.966 43 HE1 TYR 5 HE1 TYR 5 34.743 25.064 -13.861 44 HE2 TYR 5 HE2 TYR 5 31.440 23.269 -11.870 45 HH TYR 5 HH TYR 5 32.967 24.478 -10.848 46 H THR 6 H THR 6 32.991 20.648 -19.290 47 HA THR 6 HA THR 6 35.740 20.010 -18.290 48 HB THR 6 HB THR 6 34.625 19.608 -21.125 49 HG1 THR 6 HG1 THR 6 33.240 18.692 -19.588 50 1HG2 THR 6 1HG2 THR 6 36.679 17.940 -19.543 51 2HG2 THR 6 2HG2 THR 6 36.101 17.598 -21.196 52 3HG2 THR 6 3HG2 THR 6 37.077 19.065 -20.874 53 H VAL 7 H VAL 7 36.769 21.821 -17.977 54 HA VAL 7 HA VAL 7 37.062 23.902 -20.216 55 HB VAL 7 HB VAL 7 37.646 24.170 -17.228 56 1HG1 VAL 7 1HG2 VAL 7 39.366 25.495 -18.487 57 2HG1 VAL 7 2HG2 VAL 7 38.097 26.428 -19.300 58 3HG1 VAL 7 3HG2 VAL 7 38.320 26.555 -17.527 59 1HG2 VAL 7 1HG1 VAL 7 35.570 25.772 -18.890 60 2HG2 VAL 7 2HG1 VAL 7 35.199 24.399 -17.839 61 3HG2 VAL 7 3HG1 VAL 7 35.837 25.889 -17.123 62 HA DPR 8 HA PRO 8 41.476 22.569 -20.459 63 1HB DPR 8 1HB PRO 8 41.710 23.607 -22.509 64 2HB DPR 8 2HB PRO 8 41.802 21.941 -23.126 65 1HG DPR 8 2HG PRO 8 39.958 23.588 -24.153 66 2HG DPR 8 1HG PRO 8 39.484 21.913 -23.701 67 1HD DPR 8 1HD PRO 8 38.914 24.495 -22.164 68 2HD DPR 8 2HD PRO 8 37.859 23.071 -22.379 69 H SER 9 H SER 9 42.588 20.658 -20.808 70 HA SER 9 HA SER 9 41.101 18.005 -20.656 71 1HB SER 9 2HB SER 9 44.054 18.685 -20.127 72 2HB SER 9 1HB SER 9 43.363 17.061 -20.113 73 HG SER 9 HG SER 9 42.655 17.415 -22.262 74 H TYR 10 H TYR 10 39.954 19.827 -18.769 75 HA TYR 10 HA TYR 10 40.529 18.366 -16.184 76 1HB TYR 10 2HB TYR 10 41.528 21.021 -16.580 77 2HB TYR 10 1HB TYR 10 40.032 21.327 -15.768 78 HD1 TYR 10 HD1 TYR 10 39.706 20.506 -13.366 79 HD2 TYR 10 HD2 TYR 10 43.405 19.765 -15.456 80 HE1 TYR 10 HE1 TYR 10 40.797 19.907 -11.286 81 HE2 TYR 10 HE2 TYR 10 44.450 19.175 -13.359 82 HH TYR 10 HH TYR 10 42.654 19.255 -10.292 83 H THR 11 H THR 11 38.774 17.366 -16.387 84 HA THR 11 HA THR 11 36.082 18.449 -17.067 85 HB THR 11 HB THR 11 36.712 15.634 -16.052 86 HG1 THR 11 HG1 THR 11 36.746 16.667 -18.690 87 1HG2 THR 11 1HG2 THR 11 34.808 14.891 -17.489 88 2HG2 THR 11 2HG2 THR 11 34.226 16.098 -16.305 89 3HG2 THR 11 3HG2 THR 11 34.503 16.569 -17.999 90 H PHE 12 H PHE 12 35.087 19.764 -15.533 91 HA PHE 12 HA PHE 12 35.632 19.289 -12.579 92 1HB PHE 12 2HB PHE 12 34.283 21.574 -14.075 93 2HB PHE 12 1HB PHE 12 34.297 21.470 -12.338 94 HD1 PHE 12 HD1 PHE 12 36.442 22.128 -15.318 95 HD2 PHE 12 HD2 PHE 12 36.430 21.785 -11.019 96 HE1 PHE 12 HE1 PHE 12 38.589 23.240 -15.195 97 HE2 PHE 12 HE2 PHE 12 38.576 22.902 -10.946 98 HZ PHE 12 HZ PHE 12 39.679 23.637 -13.024 99 H ARG 13 H ARG 13 34.469 17.417 -12.268 100 HA ARG 13 HA ARG 13 31.458 17.463 -12.623 101 1HB ARG 13 2HB ARG 13 33.350 15.149 -11.852 102 2HB ARG 13 1HB ARG 13 31.591 15.001 -11.833 103 1HG ARG 13 1HG ARG 13 31.487 15.514 -14.271 104 2HG ARG 13 2HG ARG 13 33.251 15.628 -14.325 105 1HD ARG 13 1HD ARG 13 33.399 13.185 -13.604 106 2HD ARG 13 2HD ARG 13 31.624 13.105 -13.602 107 HE ARG 13 HE ARG 13 32.506 14.103 -16.200 108 1HH1 ARG 13 2HH1 ARG 13 32.496 10.953 -14.450 109 2HH1 ARG 13 1HH1 ARG 13 32.522 10.084 -16.066 110 1HH2 ARG 13 1HH2 ARG 13 32.535 12.979 -17.912 111 2HH2 ARG 13 2HH2 ARG 13 32.543 11.145 -17.868 112 H GLY 14 H GLY 14 30.162 17.656 -10.867 113 1HA GLY 14 2HA GLY 14 30.780 16.785 -8.139 114 2HA GLY 14 1HA GLY 14 31.071 18.518 -8.243 115 HA PRO 15 HA PRO 15 26.325 17.904 -7.772 116 1HB PRO 15 2HB PRO 15 25.724 17.919 -5.091 117 2HB PRO 15 1HB PRO 15 26.223 16.467 -5.980 118 1HG PRO 15 1HG PRO 15 27.942 18.246 -4.212 119 2HG PRO 15 2HG PRO 15 27.828 16.457 -4.195 120 1HD PRO 15 1HD PRO 15 29.827 17.886 -5.570 121 2HD PRO 15 2HD PRO 15 29.257 16.282 -6.100 122 H GLY 16 H GLY 16 24.904 19.572 -7.526 123 1HA GLY 16 2HA GLY 16 23.980 21.738 -7.048 124 2HA GLY 16 1HA GLY 16 25.340 22.044 -5.979 125 H CYS 17 H CYS 17 23.921 23.208 -8.690 126 HA CYS 17 HA CYS 17 26.121 23.553 -10.555 127 1HB CYS 17 1HB CYS 17 23.643 25.336 -10.569 128 2HB CYS 17 2HB CYS 17 24.687 24.900 -11.924 129 HA PRO 18 HA PRO 18 27.625 27.164 -7.978 130 1HB PRO 18 1HB PRO 18 30.292 27.051 -8.267 131 2HB PRO 18 2HB PRO 18 29.375 25.711 -7.540 132 1HG PRO 18 2HG PRO 18 30.407 25.937 -10.416 133 2HG PRO 18 1HG PRO 18 30.606 24.559 -9.294 134 1HD PRO 18 1HD PRO 18 28.545 24.741 -11.203 135 2HD PRO 18 2HD PRO 18 28.390 23.822 -9.684 136 H THR 19 H THR 19 30.052 28.576 -9.646 137 HA THR 19 HA THR 19 28.344 30.777 -10.655 138 HB THR 19 HB THR 19 30.320 31.321 -9.440 139 HG1 THR 19 HG1 THR 19 29.452 32.655 -10.986 140 1HG2 THR 19 1HG2 THR 19 32.103 30.415 -11.797 141 2HG2 THR 19 2HG2 THR 19 32.638 31.365 -10.384 142 3HG2 THR 19 3HG2 THR 19 32.110 29.673 -10.175 143 H VAL 20 H VAL 20 29.028 31.833 -12.837 144 HA VAL 20 HA VAL 20 29.519 30.068 -15.056 145 HB VAL 20 HB VAL 20 27.859 30.834 -16.414 146 1HG1 VAL 20 1HG2 VAL 20 26.147 29.025 -16.094 147 2HG1 VAL 20 2HG2 VAL 20 26.558 28.957 -14.357 148 3HG1 VAL 20 3HG2 VAL 20 27.750 28.472 -15.583 149 1HG2 VAL 20 1HG1 VAL 20 26.666 32.710 -15.264 150 2HG2 VAL 20 2HG1 VAL 20 25.875 31.549 -14.174 151 3HG2 VAL 20 3HG1 VAL 20 25.503 31.540 -15.922 152 H LYS 21 H LYS 21 31.114 31.282 -14.541 153 HA LYS 21 HA LYS 21 31.561 34.172 -15.376 154 1HB LYS 21 1HB LYS 21 33.566 31.887 -14.786 155 2HB LYS 21 2HB LYS 21 34.088 33.483 -15.284 156 1HG LYS 21 1HG LYS 21 33.125 34.586 -13.319 157 2HG LYS 21 2HG LYS 21 32.413 33.075 -12.748 158 1HD LYS 21 1HD LYS 21 34.671 32.051 -12.480 159 2HD LYS 21 2HD LYS 21 35.443 33.528 -13.081 160 1HE LYS 21 1HE LYS 21 34.517 34.818 -11.106 161 2HE LYS 21 2HE LYS 21 33.746 33.340 -10.500 162 1HZ LYS 21 1HZ LYS 21 35.903 33.706 -9.465 163 2HZ LYS 21 2HZ LYS 21 35.958 32.316 -10.357 164 3HZ LYS 21 3HZ LYS 21 36.677 33.691 -10.925 165 HA PRO 22 HA PRO 22 31.611 33.999 -19.618 166 1HB PRO 22 1HB PRO 22 34.045 35.774 -20.005 167 2HB PRO 22 2HB PRO 22 32.358 36.003 -20.526 168 1HG PRO 22 2HG PRO 22 33.216 37.357 -18.307 169 2HG PRO 22 1HG PRO 22 31.630 36.532 -18.215 170 1HD PRO 22 1HD PRO 22 34.335 35.429 -17.255 171 2HD PRO 22 2HD PRO 22 32.824 35.692 -16.344 172 H DAL 23 H ALA 23 32.161 32.934 -21.442 173 HA DAL 23 HA ALA 23 34.779 31.465 -21.803 174 1HB DAL 23 1HB ALA 23 32.191 31.372 -23.453 175 2HB DAL 23 2HB ALA 23 33.613 32.394 -23.796 176 3HB DAL 23 3HB ALA 23 33.746 30.623 -23.902 177 H ILE 24 H ILE 24 31.687 30.687 -20.343 178 HA ILE 24 HA ILE 24 32.672 28.015 -19.627 179 HB ILE 24 HB ILE 24 30.782 30.109 -18.667 180 1HG1 ILE 24 1HG1 ILE 24 32.877 29.574 -17.563 181 2HG1 ILE 24 2HG1 ILE 24 31.497 29.715 -16.526 182 1HG2 ILE 24 1HG2 ILE 24 29.142 28.972 -17.289 183 2HG2 ILE 24 2HG2 ILE 24 28.859 28.931 -19.044 184 3HG2 ILE 24 3HG2 ILE 24 29.473 27.483 -18.234 185 1HD1 ILE 24 1HD1 ILE 24 32.512 26.893 -17.262 186 2HD1 ILE 24 2HD1 ILE 24 31.598 27.421 -15.831 187 3HD1 ILE 24 3HD1 ILE 24 33.305 27.851 -15.974 188 H SER 25 H SER 25 31.091 26.426 -19.338 189 HA SER 25 HA SER 25 29.322 25.590 -21.572 190 1HB SER 25 1HB SER 25 31.480 25.024 -22.663 191 2HB SER 25 2HB SER 25 31.956 24.030 -21.275 192 HG SER 25 HG SER 25 29.649 23.650 -22.904 193 H LEU 26 H LEU 26 27.811 25.173 -20.056 194 HA LEU 26 HA LEU 26 28.274 22.922 -18.049 195 1HB LEU 26 1HB LEU 26 27.072 25.696 -17.411 196 2HB LEU 26 2HB LEU 26 26.339 24.303 -16.693 197 HG LEU 26 HG LEU 26 28.670 23.631 -15.756 198 1HD1 LEU 26 1HD2 LEU 26 30.397 25.339 -15.426 199 2HD1 LEU 26 2HD2 LEU 26 29.426 26.596 -16.222 200 3HD1 LEU 26 3HD2 LEU 26 30.083 25.236 -17.163 201 1HD2 LEU 26 1HD1 LEU 26 27.381 26.188 -14.625 202 2HD2 LEU 26 2HD1 LEU 26 26.840 24.520 -14.321 203 3HD2 LEU 26 3HD1 LEU 26 28.423 25.045 -13.728 204 H ARG 27 H ARG 27 26.633 21.605 -17.773 205 HA ARG 27 HA ARG 27 23.929 21.962 -19.000 206 1HB ARG 27 1HB ARG 27 25.748 19.642 -19.930 207 2HB ARG 27 2HB ARG 27 23.998 19.513 -19.947 208 1HG ARG 27 1HG ARG 27 23.795 21.448 -21.477 209 2HG ARG 27 2HG ARG 27 25.535 21.679 -21.492 210 1HD ARG 27 2HD ARG 27 24.193 19.062 -22.487 211 2HD ARG 27 1HD ARG 27 24.452 20.465 -23.511 212 HE ARG 27 HE ARG 27 26.844 20.094 -23.524 213 1HH1 ARG 27 1HH2 ARG 27 25.331 17.587 -21.428 214 2HH1 ARG 27 2HH2 ARG 27 26.890 16.621 -21.498 215 1HH2 ARG 27 2HH1 ARG 27 28.506 18.896 -23.501 216 2HH2 ARG 27 1HH1 ARG 27 28.544 17.309 -22.581 217 H CYS 28 H CYS 28 24.411 22.292 -16.586 218 HA CYS 28 HA CYS 28 24.617 20.230 -14.794 219 1HB CYS 28 1HB CYS 28 25.090 22.640 -14.364 220 2HB CYS 28 2HB CYS 28 23.345 22.960 -14.299 221 H GLU 29 H GLU 29 23.225 18.557 -14.744 222 HA GLU 29 HA GLU 29 20.186 18.940 -14.862 223 1HB GLU 29 2HB GLU 29 21.466 17.446 -16.594 224 2HB GLU 29 1HB GLU 29 21.831 16.361 -15.259 225 1HG GLU 29 2HG GLU 29 19.317 16.008 -14.944 226 2HG GLU 29 1HG GLU 29 19.015 17.093 -16.307 227 HE2 GLU 29 HE2 GLU 29 19.867 16.579 -18.237 Start of MODEL 7 1 1H SER 1 1H SER 1 21.202 20.484 -10.368 2 2H SER 1 2H SER 1 22.116 19.908 -11.618 3 3H SER 1 3H SER 1 22.851 20.505 -10.264 4 HA SER 1 HA SER 1 21.951 18.758 -8.902 5 1HB SER 1 2HB SER 1 19.847 18.483 -10.176 6 2HB SER 1 1HB SER 1 20.734 17.713 -11.505 7 HG SER 1 HG SER 1 20.628 16.827 -8.805 8 H LYS 2 H LYS 2 23.351 18.141 -12.143 9 HA LYS 2 HA LYS 2 25.801 17.023 -10.846 10 1HB LYS 2 1HB LYS 2 26.035 14.939 -11.973 11 2HB LYS 2 2HB LYS 2 24.672 14.962 -10.872 12 1HG LYS 2 2HG LYS 2 23.078 15.098 -12.834 13 2HG LYS 2 1HG LYS 2 24.449 15.070 -13.945 14 1HD LYS 2 1HD LYS 2 25.114 12.778 -13.069 15 2HD LYS 2 2HD LYS 2 23.742 12.805 -11.957 16 1HE LYS 2 2HE LYS 2 22.144 12.901 -13.924 17 2HE LYS 2 1HE LYS 2 23.522 12.874 -15.041 18 1HZ LYS 2 1HZ LYS 2 24.168 10.717 -14.095 19 2HZ LYS 2 2HZ LYS 2 22.884 10.743 -13.055 20 3HZ LYS 2 3HZ LYS 2 22.626 10.656 -14.684 21 H TYR 3 H TYR 3 26.786 18.759 -11.658 22 HA TYR 3 HA TYR 3 26.702 19.514 -14.563 23 1HB TYR 3 2HB TYR 3 27.783 21.546 -13.952 24 2HB TYR 3 1HB TYR 3 26.567 21.248 -12.757 25 HD1 TYR 3 HD1 TYR 3 27.232 20.820 -10.361 26 HD2 TYR 3 HD2 TYR 3 30.268 21.241 -13.380 27 HE1 TYR 3 HE1 TYR 3 28.933 20.889 -8.668 28 HE2 TYR 3 HE2 TYR 3 31.941 21.403 -11.664 29 HH TYR 3 HH TYR 3 32.380 21.315 -9.480 30 H GLU 4 H GLU 4 28.469 19.621 -15.944 31 HA GLU 4 HA GLU 4 31.151 18.409 -15.157 32 1HB GLU 4 1HB GLU 4 29.872 16.583 -16.249 33 2HB GLU 4 2HB GLU 4 29.580 17.580 -17.667 34 1HG GLU 4 2HG GLU 4 32.008 17.572 -18.226 35 2HG GLU 4 1HG GLU 4 32.392 16.681 -16.762 36 HE2 GLU 4 HE2 GLU 4 30.927 16.680 -19.770 37 H TYR 5 H TYR 5 32.440 20.110 -15.461 38 HA TYR 5 HA TYR 5 32.139 21.813 -18.006 39 1HB TYR 5 2HB TYR 5 32.672 23.824 -17.100 40 2HB TYR 5 1HB TYR 5 31.253 23.149 -16.372 41 HD1 TYR 5 HD1 TYR 5 34.871 24.004 -15.728 42 HD2 TYR 5 HD2 TYR 5 31.047 23.206 -13.923 43 HE1 TYR 5 HE1 TYR 5 35.667 24.848 -13.603 44 HE2 TYR 5 HE2 TYR 5 31.900 24.013 -11.805 45 HH TYR 5 HH TYR 5 35.215 25.238 -11.484 46 H THR 6 H THR 6 33.728 21.241 -19.236 47 HA THR 6 HA THR 6 36.414 20.459 -18.148 48 HB THR 6 HB THR 6 35.409 20.295 -21.048 49 HG1 THR 6 HG1 THR 6 34.754 18.205 -20.522 50 1HG2 THR 6 1HG2 THR 6 36.871 18.273 -21.217 51 2HG2 THR 6 2HG2 THR 6 37.406 18.505 -19.531 52 3HG2 THR 6 3HG2 THR 6 37.842 19.711 -20.774 53 H VAL 7 H VAL 7 37.335 22.291 -17.590 54 HA VAL 7 HA VAL 7 37.838 24.490 -19.675 55 HB VAL 7 HB VAL 7 38.051 24.595 -16.624 56 1HG1 VAL 7 1HG2 VAL 7 38.773 26.979 -16.675 57 2HG1 VAL 7 2HG2 VAL 7 39.939 25.965 -17.540 58 3HG1 VAL 7 3HG2 VAL 7 38.806 26.965 -18.466 59 1HG2 VAL 7 1HG1 VAL 7 36.252 26.321 -16.665 60 2HG2 VAL 7 2HG1 VAL 7 35.707 24.904 -17.579 61 3HG2 VAL 7 3HG1 VAL 7 36.246 26.339 -18.455 62 HA DPR 8 HA PRO 8 42.274 23.199 -19.513 63 1HB DPR 8 1HB PRO 8 42.741 24.448 -21.403 64 2HB DPR 8 2HB PRO 8 42.909 22.854 -22.174 65 1HG DPR 8 2HG PRO 8 41.193 24.617 -23.235 66 2HG DPR 8 1HG PRO 8 40.676 22.908 -23.019 67 1HD DPR 8 1HD PRO 8 39.918 25.321 -21.301 68 2HD DPR 8 2HD PRO 8 38.905 23.932 -21.780 69 H SER 9 H SER 9 43.430 21.313 -19.966 70 HA SER 9 HA SER 9 41.883 18.693 -20.213 71 1HB SER 9 2HB SER 9 44.810 19.227 -19.441 72 2HB SER 9 1HB SER 9 44.080 17.630 -19.636 73 HG SER 9 HG SER 9 44.173 19.671 -21.613 74 H TYR 10 H TYR 10 40.602 20.297 -18.288 75 HA TYR 10 HA TYR 10 40.963 18.609 -15.808 76 1HB TYR 10 2HB TYR 10 41.940 21.318 -15.873 77 2HB TYR 10 1HB TYR 10 40.392 21.498 -15.127 78 HD1 TYR 10 HD1 TYR 10 39.933 20.387 -12.863 79 HD2 TYR 10 HD2 TYR 10 43.786 20.008 -14.763 80 HE1 TYR 10 HE1 TYR 10 40.912 19.600 -10.789 81 HE2 TYR 10 HE2 TYR 10 44.716 19.226 -12.673 82 HH TYR 10 HH TYR 10 44.346 18.740 -10.550 83 H THR 11 H THR 11 39.243 17.631 -16.245 84 HA THR 11 HA THR 11 36.598 18.765 -17.050 85 HB THR 11 HB THR 11 37.230 15.875 -16.273 86 HG1 THR 11 HG1 THR 11 37.605 15.605 -18.480 87 1HG2 THR 11 1HG2 THR 11 34.758 16.286 -16.643 88 2HG2 THR 11 2HG2 THR 11 35.123 16.948 -18.257 89 3HG2 THR 11 3HG2 THR 11 35.457 15.235 -17.909 90 H PHE 12 H PHE 12 35.547 19.978 -15.437 91 HA PHE 12 HA PHE 12 35.864 19.139 -12.529 92 1HB PHE 12 1HB PHE 12 34.617 21.602 -13.764 93 2HB PHE 12 2HB PHE 12 34.627 21.286 -12.054 94 HD1 PHE 12 HD1 PHE 12 36.778 21.383 -10.710 95 HD2 PHE 12 HD2 PHE 12 36.777 22.305 -14.922 96 HE1 PHE 12 HE1 PHE 12 38.942 22.460 -10.501 97 HE2 PHE 12 HE2 PHE 12 38.937 23.373 -14.661 98 HZ PHE 12 HZ PHE 12 40.037 23.463 -12.463 99 H ARG 13 H ARG 13 34.646 17.254 -12.603 100 HA ARG 13 HA ARG 13 31.671 17.410 -13.134 101 1HB ARG 13 2HB ARG 13 33.508 15.019 -12.421 102 2HB ARG 13 1HB ARG 13 31.757 14.862 -12.503 103 1HG ARG 13 2HG ARG 13 31.773 15.570 -14.912 104 2HG ARG 13 1HG ARG 13 33.525 15.686 -14.842 105 1HD ARG 13 2HD ARG 13 33.145 13.613 -15.884 106 2HD ARG 13 1HD ARG 13 33.588 13.151 -14.244 107 HE ARG 13 HE ARG 13 30.625 13.381 -14.739 108 1HH1 ARG 13 2HH1 ARG 13 33.355 11.031 -14.711 109 2HH1 ARG 13 1HH1 ARG 13 32.142 9.659 -14.594 110 1HH2 ARG 13 1HH2 ARG 13 29.408 11.737 -14.606 111 2HH2 ARG 13 2HH2 ARG 13 30.085 10.033 -14.540 112 H GLY 14 H GLY 14 30.252 17.501 -11.478 113 1HA GLY 14 2HA GLY 14 30.568 16.371 -8.811 114 2HA GLY 14 1HA GLY 14 30.981 18.080 -8.709 115 HA PRO 15 HA PRO 15 26.202 17.813 -8.760 116 1HB PRO 15 2HB PRO 15 25.308 17.632 -6.169 117 2HB PRO 15 1HB PRO 15 25.857 16.232 -7.112 118 1HG PRO 15 2HG PRO 15 27.418 17.788 -5.020 119 2HG PRO 15 1HG PRO 15 27.248 16.010 -5.172 120 1HD PRO 15 2HD PRO 15 29.427 17.494 -6.194 121 2HD PRO 15 1HD PRO 15 28.903 15.936 -6.886 122 H GLY 16 H GLY 16 24.845 19.517 -8.536 123 1HA GLY 16 1HA GLY 16 23.954 21.680 -7.987 124 2HA GLY 16 2HA GLY 16 25.153 21.799 -6.706 125 H CYS 17 H CYS 17 24.174 23.483 -9.247 126 HA CYS 17 HA CYS 17 26.488 23.836 -10.937 127 1HB CYS 17 2HB CYS 17 24.511 26.142 -10.855 128 2HB CYS 17 1HB CYS 17 25.322 25.364 -12.211 129 HA PRO 18 HA PRO 18 28.324 26.789 -7.769 130 1HB PRO 18 2HB PRO 18 30.915 26.132 -7.747 131 2HB PRO 18 1HB PRO 18 29.638 24.974 -7.296 132 1HG PRO 18 1HG PRO 18 31.177 25.130 -9.917 133 2HG PRO 18 2HG PRO 18 30.736 23.681 -8.975 134 1HD PRO 18 1HD PRO 18 29.278 24.791 -11.192 135 2HD PRO 18 2HD PRO 18 28.629 23.594 -10.053 136 H THR 19 H THR 19 30.746 27.054 -10.400 137 HA THR 19 HA THR 19 30.344 30.043 -10.508 138 HB THR 19 HB THR 19 32.356 29.891 -12.076 139 HG1 THR 19 HG1 THR 19 32.127 27.704 -12.562 140 1HG2 THR 19 1HG2 THR 19 34.111 29.633 -10.389 141 2HG2 THR 19 2HG2 THR 19 32.748 30.597 -9.755 142 3HG2 THR 19 3HG2 THR 19 32.940 28.894 -9.254 143 H VAL 20 H VAL 20 29.724 31.038 -12.338 144 HA VAL 20 HA VAL 20 28.858 29.490 -14.827 145 HB VAL 20 HB VAL 20 27.052 31.354 -13.441 146 1HG1 VAL 20 1HG1 VAL 20 26.279 29.550 -15.860 147 2HG1 VAL 20 2HG1 VAL 20 26.612 31.289 -15.929 148 3HG1 VAL 20 3HG1 VAL 20 25.173 30.718 -15.075 149 1HG2 VAL 20 1HG2 VAL 20 26.493 28.287 -13.538 150 2HG2 VAL 20 2HG2 VAL 20 25.401 29.498 -12.800 151 3HG2 VAL 20 3HG2 VAL 20 27.008 29.205 -12.114 152 H LYS 21 H LYS 21 30.815 30.735 -14.615 153 HA LYS 21 HA LYS 21 31.134 33.540 -15.469 154 1HB LYS 21 2HB LYS 21 33.109 31.196 -15.847 155 2HB LYS 21 1HB LYS 21 33.518 32.839 -16.307 156 1HG LYS 21 2HG LYS 21 33.299 33.686 -14.002 157 2HG LYS 21 1HG LYS 21 32.766 32.109 -13.423 158 1HD LYS 21 1HD LYS 21 34.933 31.090 -14.048 159 2HD LYS 21 2HD LYS 21 35.527 32.620 -14.693 160 1HE LYS 21 2HE LYS 21 34.723 32.252 -11.717 161 2HE LYS 21 1HE LYS 21 36.324 31.889 -12.340 162 1HZ LYS 21 1HZ LYS 21 36.563 34.197 -13.053 163 2HZ LYS 21 2HZ LYS 21 35.059 34.576 -12.484 164 3HZ LYS 21 3HZ LYS 21 36.247 34.112 -11.434 165 HA PRO 22 HA PRO 22 29.755 33.735 -19.535 166 1HB PRO 22 1HB PRO 22 31.700 35.849 -20.412 167 2HB PRO 22 2HB PRO 22 29.931 35.909 -20.231 168 1HG PRO 22 1HG PRO 22 31.496 37.109 -18.328 169 2HG PRO 22 2HG PRO 22 30.100 36.123 -17.794 170 1HD PRO 22 2HD PRO 22 33.024 35.176 -18.033 171 2HD PRO 22 1HD PRO 22 31.959 35.201 -16.605 172 H DAL 23 H ALA 23 30.154 31.778 -20.381 173 HA DAL 23 HA ALA 23 32.565 31.302 -22.207 174 1HB DAL 23 1HB ALA 23 31.058 30.445 -23.983 175 2HB DAL 23 2HB ALA 23 29.633 30.735 -22.949 176 3HB DAL 23 3HB ALA 23 30.598 32.108 -23.552 177 H ILE 24 H ILE 24 30.365 29.614 -19.962 178 HA ILE 24 HA ILE 24 31.802 27.043 -20.545 179 HB ILE 24 HB ILE 24 29.767 27.438 -18.349 180 1HG1 ILE 24 2HG1 ILE 24 32.842 27.528 -17.856 181 2HG1 ILE 24 1HG1 ILE 24 31.868 28.969 -18.019 182 1HG2 ILE 24 1HG2 ILE 24 30.103 25.073 -18.952 183 2HG2 ILE 24 2HG2 ILE 24 30.776 25.348 -17.339 184 3HG2 ILE 24 3HG2 ILE 24 31.873 25.231 -18.745 185 1HD1 ILE 24 1HD1 ILE 24 31.468 26.885 -15.841 186 2HD1 ILE 24 2HD1 ILE 24 32.218 28.505 -15.636 187 3HD1 ILE 24 3HD1 ILE 24 30.462 28.336 -16.060 188 H SER 25 H SER 25 30.751 25.408 -21.206 189 HA SER 25 HA SER 25 27.882 25.423 -22.337 190 1HB SER 25 1HB SER 25 29.680 24.987 -24.036 191 2HB SER 25 2HB SER 25 30.324 23.667 -23.039 192 HG SER 25 HG SER 25 28.884 22.943 -24.648 193 H LEU 26 H LEU 26 27.355 25.381 -20.070 194 HA LEU 26 HA LEU 26 28.430 23.280 -18.248 195 1HB LEU 26 2HB LEU 26 28.139 25.756 -17.701 196 2HB LEU 26 1HB LEU 26 26.413 25.484 -17.725 197 HG LEU 26 HG LEU 26 26.773 23.909 -15.634 198 1HD1 LEU 26 1HD2 LEU 26 28.842 23.993 -14.331 199 2HD1 LEU 26 2HD2 LEU 26 29.161 23.363 -15.956 200 3HD1 LEU 26 3HD2 LEU 26 29.641 25.030 -15.534 201 1HD2 LEU 26 1HD1 LEU 26 27.037 25.855 -14.036 202 2HD2 LEU 26 2HD1 LEU 26 27.722 26.847 -15.350 203 3HD2 LEU 26 3HD1 LEU 26 26.027 26.332 -15.412 204 H ARG 27 H ARG 27 27.347 21.528 -17.547 205 HA ARG 27 HA ARG 27 24.542 20.966 -18.610 206 1HB ARG 27 1HB ARG 27 25.030 18.820 -19.311 207 2HB ARG 27 2HB ARG 27 26.194 19.895 -20.059 208 1HG ARG 27 1HG ARG 27 27.976 19.055 -18.504 209 2HG ARG 27 2HG ARG 27 26.831 17.982 -17.718 210 1HD ARG 27 2HD ARG 27 27.497 17.781 -20.743 211 2HD ARG 27 1HD ARG 27 28.428 16.966 -19.497 212 HE ARG 27 HE ARG 27 25.696 16.180 -19.049 213 1HH1 ARG 27 2HH1 ARG 27 28.140 15.623 -21.637 214 2HH1 ARG 27 1HH1 ARG 27 27.305 14.042 -22.051 215 1HH2 ARG 27 2HH2 ARG 27 24.887 14.392 -19.639 216 2HH2 ARG 27 1HH2 ARG 27 25.609 13.405 -21.007 217 H CYS 28 H CYS 28 24.980 22.016 -16.288 218 HA CYS 28 HA CYS 28 24.812 20.554 -14.014 219 1HB CYS 28 2HB CYS 28 24.846 23.076 -14.187 220 2HB CYS 28 1HB CYS 28 23.087 23.031 -14.432 221 H GLU 29 H GLU 29 21.785 21.104 -15.916 222 HA GLU 29 HA GLU 29 20.511 18.709 -14.522 223 1HB GLU 29 2HB GLU 29 19.206 21.505 -14.695 224 2HB GLU 29 1HB GLU 29 18.264 20.040 -14.452 225 1HG GLU 29 2HG GLU 29 19.424 19.566 -12.294 226 2HG GLU 29 1HG GLU 29 20.415 21.018 -12.493 227 HE2 GLU 29 HE2 GLU 29 17.258 19.807 -12.248 Start of MODEL 8 1 1H SER 1 1H SER 1 19.999 18.865 -9.451 2 2H SER 1 2H SER 1 21.164 18.271 -8.441 3 3H SER 1 3H SER 1 20.685 17.394 -9.757 4 HA SER 1 HA SER 1 21.540 19.072 -11.277 5 1HB SER 1 2HB SER 1 22.470 20.404 -8.665 6 2HB SER 1 1HB SER 1 22.978 20.907 -10.287 7 HG SER 1 HG SER 1 20.305 20.763 -9.340 8 H LYS 2 H LYS 2 23.355 18.281 -12.158 9 HA LYS 2 HA LYS 2 25.709 17.341 -10.560 10 1HB LYS 2 2HB LYS 2 26.016 15.174 -11.479 11 2HB LYS 2 1HB LYS 2 24.569 15.284 -10.498 12 1HG LYS 2 1HG LYS 2 23.141 15.244 -12.589 13 2HG LYS 2 2HG LYS 2 24.598 15.128 -13.577 14 1HD LYS 2 1HD LYS 2 25.185 12.923 -12.457 15 2HD LYS 2 2HD LYS 2 23.726 13.037 -11.467 16 1HE LYS 2 1HE LYS 2 22.296 12.957 -13.560 17 2HE LYS 2 2HE LYS 2 23.760 12.842 -14.554 18 1HZ LYS 2 1HZ LYS 2 22.958 10.885 -12.452 19 2HZ LYS 2 2HZ LYS 2 24.323 10.778 -13.377 20 3HZ LYS 2 3HZ LYS 2 22.834 10.658 -14.083 21 H TYR 3 H TYR 3 26.736 19.015 -11.440 22 HA TYR 3 HA TYR 3 26.691 19.692 -14.319 23 1HB TYR 3 1HB TYR 3 27.852 21.684 -13.766 24 2HB TYR 3 2HB TYR 3 26.665 21.424 -12.532 25 HD1 TYR 3 HD1 TYR 3 27.391 20.953 -10.157 26 HD2 TYR 3 HD2 TYR 3 30.338 21.364 -13.269 27 HE1 TYR 3 HE1 TYR 3 29.145 21.014 -8.518 28 HE2 TYR 3 HE2 TYR 3 32.060 21.505 -11.607 29 HH TYR 3 HH TYR 3 32.564 21.434 -9.434 30 H GLU 4 H GLU 4 28.377 19.709 -15.787 31 HA GLU 4 HA GLU 4 31.050 18.364 -15.129 32 1HB GLU 4 1HB GLU 4 29.621 16.682 -16.284 33 2HB GLU 4 2HB GLU 4 29.309 17.801 -17.606 34 1HG GLU 4 2HG GLU 4 31.772 17.700 -18.209 35 2HG GLU 4 1HG GLU 4 32.043 16.522 -16.942 36 HE2 GLU 4 HE2 GLU 4 30.132 13.987 -18.561 37 H TYR 5 H TYR 5 32.437 20.015 -15.389 38 HA TYR 5 HA TYR 5 32.176 21.806 -17.872 39 1HB TYR 5 1HB TYR 5 32.830 23.775 -16.939 40 2HB TYR 5 2HB TYR 5 31.386 23.157 -16.221 41 HD1 TYR 5 HD1 TYR 5 31.154 23.342 -13.798 42 HD2 TYR 5 HD2 TYR 5 35.073 23.684 -15.549 43 HE1 TYR 5 HE1 TYR 5 32.050 24.136 -11.693 44 HE2 TYR 5 HE2 TYR 5 35.915 24.510 -13.435 45 HH TYR 5 HH TYR 5 35.469 25.019 -11.341 46 H THR 6 H THR 6 33.744 21.307 -19.150 47 HA THR 6 HA THR 6 36.402 20.351 -18.130 48 HB THR 6 HB THR 6 35.409 20.415 -21.040 49 HG1 THR 6 HG1 THR 6 33.887 19.390 -19.718 50 1HG2 THR 6 1HG2 THR 6 37.801 19.681 -20.769 51 2HG2 THR 6 2HG2 THR 6 36.760 18.329 -21.315 52 3HG2 THR 6 3HG2 THR 6 37.277 18.427 -19.610 53 H VAL 7 H VAL 7 37.384 22.115 -17.459 54 HA VAL 7 HA VAL 7 37.967 24.412 -19.413 55 HB VAL 7 HB VAL 7 38.177 24.329 -16.361 56 1HG1 VAL 7 1HG2 VAL 7 38.995 26.678 -16.265 57 2HG1 VAL 7 2HG2 VAL 7 39.038 26.772 -18.054 58 3HG1 VAL 7 3HG2 VAL 7 40.124 25.671 -17.187 59 1HG2 VAL 7 1HG1 VAL 7 35.851 24.792 -17.306 60 2HG2 VAL 7 2HG1 VAL 7 36.450 26.124 -16.302 61 3HG2 VAL 7 3HG1 VAL 7 36.455 26.254 -18.087 62 HA DPR 8 HA PRO 8 42.348 22.928 -19.349 63 1HB DPR 8 2HB PRO 8 42.866 24.283 -21.154 64 2HB DPR 8 1HB PRO 8 42.963 22.737 -22.029 65 1HG DPR 8 1HG PRO 8 41.325 24.642 -22.965 66 2HG DPR 8 2HG PRO 8 40.733 22.948 -22.861 67 1HD DPR 8 1HD PRO 8 40.082 25.270 -20.985 68 2HD DPR 8 2HD PRO 8 39.011 23.959 -21.549 69 H SER 9 H SER 9 43.417 21.022 -19.950 70 HA SER 9 HA SER 9 41.751 18.501 -20.368 71 1HB SER 9 2HB SER 9 44.700 18.850 -19.572 72 2HB SER 9 1HB SER 9 43.901 17.306 -19.877 73 HG SER 9 HG SER 9 44.942 18.127 -21.719 74 H TYR 10 H TYR 10 40.560 20.029 -18.307 75 HA TYR 10 HA TYR 10 40.885 18.171 -15.944 76 1HB TYR 10 1HB TYR 10 42.030 20.801 -15.870 77 2HB TYR 10 2HB TYR 10 40.504 21.055 -15.100 78 HD1 TYR 10 HD1 TYR 10 43.783 19.299 -14.856 79 HD2 TYR 10 HD2 TYR 10 39.994 19.883 -12.881 80 HE1 TYR 10 HE1 TYR 10 44.675 18.346 -12.821 81 HE2 TYR 10 HE2 TYR 10 40.933 18.921 -10.863 82 HH TYR 10 HH TYR 10 44.292 17.788 -10.717 83 H THR 11 H THR 11 39.100 17.318 -16.397 84 HA THR 11 HA THR 11 36.507 18.654 -17.040 85 HB THR 11 HB THR 11 36.933 15.683 -16.445 86 HG1 THR 11 HG1 THR 11 37.265 15.503 -18.668 87 1HG2 THR 11 1HG2 THR 11 34.498 16.322 -16.761 88 2HG2 THR 11 2HG2 THR 11 34.905 17.037 -18.340 89 3HG2 THR 11 3HG2 THR 11 35.093 15.285 -18.091 90 H PHE 12 H PHE 12 35.551 19.799 -15.353 91 HA PHE 12 HA PHE 12 35.936 18.824 -12.496 92 1HB PHE 12 2HB PHE 12 34.744 21.388 -13.564 93 2HB PHE 12 1HB PHE 12 34.840 20.997 -11.872 94 HD1 PHE 12 HD1 PHE 12 36.856 22.057 -14.822 95 HD2 PHE 12 HD2 PHE 12 37.073 20.943 -10.662 96 HE1 PHE 12 HE1 PHE 12 39.068 23.027 -14.649 97 HE2 PHE 12 HE2 PHE 12 39.287 21.924 -10.539 98 HZ PHE 12 HZ PHE 12 40.304 22.972 -12.522 99 H ARG 13 H ARG 13 34.617 17.019 -12.563 100 HA ARG 13 HA ARG 13 31.634 17.356 -13.014 101 1HB ARG 13 2HB ARG 13 33.312 14.809 -12.526 102 2HB ARG 13 1HB ARG 13 31.550 14.801 -12.624 103 1HG ARG 13 2HG ARG 13 31.635 15.674 -14.954 104 2HG ARG 13 1HG ARG 13 33.403 15.675 -14.896 105 1HD ARG 13 2HD ARG 13 33.322 13.123 -14.518 106 2HD ARG 13 1HD ARG 13 31.557 13.207 -14.712 107 HE ARG 13 HE ARG 13 32.806 14.486 -17.017 108 1HH1 ARG 13 1HH2 ARG 13 32.387 11.129 -15.775 109 2HH1 ARG 13 2HH2 ARG 13 32.535 10.501 -17.493 110 1HH2 ARG 13 2HH1 ARG 13 32.950 13.620 -18.868 111 2HH2 ARG 13 1HH1 ARG 13 32.828 11.804 -19.102 112 H GLY 14 H GLY 14 30.302 17.420 -11.292 113 1HA GLY 14 2HA GLY 14 30.604 16.089 -8.722 114 2HA GLY 14 1HA GLY 14 31.212 17.732 -8.529 115 HA PRO 15 HA PRO 15 26.407 17.941 -8.498 116 1HB PRO 15 1HB PRO 15 25.479 17.500 -5.941 117 2HB PRO 15 2HB PRO 15 25.843 16.199 -7.092 118 1HG PRO 15 1HG PRO 15 27.597 17.221 -4.827 119 2HG PRO 15 2HG PRO 15 27.193 15.521 -5.224 120 1HD PRO 15 2HD PRO 15 29.552 16.803 -6.065 121 2HD PRO 15 1HD PRO 15 28.794 15.484 -6.997 122 H GLY 16 H GLY 16 25.233 19.728 -8.005 123 1HA GLY 16 2HA GLY 16 24.617 21.885 -7.085 124 2HA GLY 16 1HA GLY 16 25.966 21.777 -5.967 125 H CYS 17 H CYS 17 24.908 23.128 -8.932 126 HA CYS 17 HA CYS 17 27.384 23.580 -10.299 127 1HB CYS 17 1HB CYS 17 24.864 25.237 -10.664 128 2HB CYS 17 2HB CYS 17 26.153 24.945 -11.845 129 HA PRO 18 HA PRO 18 28.365 27.145 -7.415 130 1HB PRO 18 1HB PRO 18 31.033 27.058 -7.158 131 2HB PRO 18 2HB PRO 18 29.976 25.735 -6.597 132 1HG PRO 18 2HG PRO 18 31.601 25.854 -9.178 133 2HG PRO 18 1HG PRO 18 31.484 24.502 -8.018 134 1HD PRO 18 1HD PRO 18 29.917 24.756 -10.371 135 2HD PRO 18 2HD PRO 18 29.432 23.791 -8.959 136 H THR 19 H THR 19 30.878 27.532 -9.954 137 HA THR 19 HA THR 19 30.005 30.374 -10.418 138 HB THR 19 HB THR 19 32.056 30.378 -11.941 139 HG1 THR 19 HG1 THR 19 32.171 28.143 -12.205 140 1HG2 THR 19 1HG2 THR 19 33.785 30.559 -10.220 141 2HG2 THR 19 2HG2 THR 19 32.711 29.766 -9.028 142 3HG2 THR 19 3HG2 THR 19 32.277 31.361 -9.701 143 H VAL 20 H VAL 20 29.274 31.075 -12.331 144 HA VAL 20 HA VAL 20 28.738 29.183 -14.673 145 HB VAL 20 HB VAL 20 26.625 30.884 -13.520 146 1HG1 VAL 20 1HG2 VAL 20 26.292 30.498 -15.996 147 2HG1 VAL 20 2HG2 VAL 20 24.925 29.804 -15.115 148 3HG1 VAL 20 3HG2 VAL 20 26.221 28.745 -15.748 149 1HG2 VAL 20 1HG1 VAL 20 25.247 28.872 -12.721 150 2HG2 VAL 20 2HG1 VAL 20 26.852 28.906 -11.970 151 3HG2 VAL 20 3HG1 VAL 20 26.540 27.775 -13.295 152 H LYS 21 H LYS 21 30.471 30.725 -14.540 153 HA LYS 21 HA LYS 21 30.451 33.460 -15.528 154 1HB LYS 21 1HB LYS 21 32.719 31.428 -15.936 155 2HB LYS 21 2HB LYS 21 32.911 33.117 -16.312 156 1HG LYS 21 1HG LYS 21 32.336 32.059 -13.483 157 2HG LYS 21 2HG LYS 21 33.947 32.276 -14.154 158 1HD LYS 21 1HD LYS 21 33.519 34.754 -14.424 159 2HD LYS 21 2HD LYS 21 31.908 34.543 -13.734 160 1HE LYS 21 2HE LYS 21 32.930 33.748 -11.556 161 2HE LYS 21 1HE LYS 21 34.553 33.953 -12.244 162 1HZ LYS 21 1HZ LYS 21 33.875 35.900 -10.973 163 2HZ LYS 21 2HZ LYS 21 34.053 36.323 -12.560 164 3HZ LYS 21 3HZ LYS 21 32.542 36.132 -11.920 165 HA PRO 22 HA PRO 22 29.112 33.364 -19.628 166 1HB PRO 22 1HB PRO 22 30.743 35.724 -20.522 167 2HB PRO 22 2HB PRO 22 28.981 35.527 -20.367 168 1HG PRO 22 1HG PRO 22 30.322 36.980 -18.468 169 2HG PRO 22 2HG PRO 22 29.075 35.813 -17.933 170 1HD PRO 22 2HD PRO 22 32.109 35.298 -18.111 171 2HD PRO 22 1HD PRO 22 31.028 35.197 -16.698 172 H DAL 23 H ALA 23 29.791 31.487 -20.456 173 HA DAL 23 HA ALA 23 32.343 31.288 -22.132 174 1HB DAL 23 1HB ALA 23 29.554 30.368 -23.055 175 2HB DAL 23 2HB ALA 23 30.391 31.836 -23.625 176 3HB DAL 23 3HB ALA 23 31.071 30.232 -23.986 177 H ILE 24 H ILE 24 30.211 29.404 -19.988 178 HA ILE 24 HA ILE 24 31.910 26.964 -20.468 179 HB ILE 24 HB ILE 24 29.785 27.246 -18.342 180 1HG1 ILE 24 2HG1 ILE 24 32.836 27.530 -17.768 181 2HG1 ILE 24 1HG1 ILE 24 31.784 28.908 -17.984 182 1HG2 ILE 24 1HG2 ILE 24 32.028 25.164 -18.634 183 2HG2 ILE 24 2HG2 ILE 24 30.278 24.899 -18.889 184 3HG2 ILE 24 3HG2 ILE 24 30.886 25.241 -17.262 185 1HD1 ILE 24 1HD1 ILE 24 30.366 28.231 -16.049 186 2HD1 ILE 24 2HD1 ILE 24 32.099 28.507 -15.585 187 3HD1 ILE 24 3HD1 ILE 24 31.447 26.844 -15.777 188 H SER 25 H SER 25 31.009 25.238 -21.130 189 HA SER 25 HA SER 25 28.204 25.027 -22.392 190 1HB SER 25 2HB SER 25 30.114 24.661 -23.978 191 2HB SER 25 1HB SER 25 30.786 23.415 -22.908 192 HG SER 25 HG SER 25 29.485 22.553 -24.565 193 H LEU 26 H LEU 26 27.596 25.040 -20.133 194 HA LEU 26 HA LEU 26 28.664 23.030 -18.219 195 1HB LEU 26 2HB LEU 26 28.225 25.509 -17.761 196 2HB LEU 26 1HB LEU 26 26.517 25.140 -17.854 197 HG LEU 26 HG LEU 26 26.869 23.656 -15.687 198 1HD1 LEU 26 1HD2 LEU 26 29.658 24.939 -15.517 199 2HD1 LEU 26 2HD2 LEU 26 28.864 23.915 -14.299 200 3HD1 LEU 26 3HD2 LEU 26 29.280 23.232 -15.880 201 1HD2 LEU 26 1HD1 LEU 26 26.944 25.673 -14.160 202 2HD2 LEU 26 2HD1 LEU 26 25.976 26.044 -15.597 203 3HD2 LEU 26 3HD1 LEU 26 27.636 26.655 -15.478 204 H ARG 27 H ARG 27 27.465 21.509 -17.134 205 HA ARG 27 HA ARG 27 24.849 20.537 -18.448 206 1HB ARG 27 1HB ARG 27 27.290 18.799 -17.705 207 2HB ARG 27 2HB ARG 27 25.689 18.124 -17.913 208 1HG ARG 27 2HG ARG 27 25.593 18.920 -20.293 209 2HG ARG 27 1HG ARG 27 27.193 19.618 -20.109 210 1HD ARG 27 1HD ARG 27 27.612 17.597 -21.236 211 2HD ARG 27 2HD ARG 27 28.088 17.215 -19.587 212 HE ARG 27 HE ARG 27 25.357 16.371 -19.777 213 1HH1 ARG 27 1HH2 ARG 27 28.326 15.451 -21.597 214 2HH1 ARG 27 2HH2 ARG 27 27.584 13.806 -21.929 215 1HH2 ARG 27 1HH1 ARG 27 24.677 14.494 -20.236 216 2HH2 ARG 27 2HH1 ARG 27 25.680 13.312 -21.217 217 H CYS 28 H CYS 28 24.942 22.162 -16.461 218 HA CYS 28 HA CYS 28 24.652 21.346 -13.902 219 1HB CYS 28 1HB CYS 28 24.595 23.722 -14.626 220 2HB CYS 28 2HB CYS 28 22.884 23.541 -15.093 221 H GLU 29 H GLU 29 21.740 21.201 -16.054 222 HA GLU 29 HA GLU 29 20.181 19.739 -13.851 223 1HB GLU 29 1HB GLU 29 19.259 20.952 -16.536 224 2HB GLU 29 2HB GLU 29 18.224 19.919 -15.561 225 1HG GLU 29 2HG GLU 29 18.280 21.531 -13.659 226 2HG GLU 29 1HG GLU 29 19.340 22.605 -14.583 227 HE2 GLU 29 HE2 GLU 29 18.610 23.753 -16.071 Start of MODEL 9 1 1H SER 1 1H SER 1 20.139 18.184 -9.071 2 2H SER 1 2H SER 1 21.383 17.676 -8.110 3 3H SER 1 3H SER 1 20.916 16.765 -9.406 4 HA SER 1 HA SER 1 21.587 18.496 -10.958 5 1HB SER 1 1HB SER 1 22.525 19.896 -8.385 6 2HB SER 1 2HB SER 1 22.931 20.430 -10.025 7 HG SER 1 HG SER 1 21.101 21.472 -9.194 8 H LYS 2 H LYS 2 23.407 17.817 -11.914 9 HA LYS 2 HA LYS 2 25.887 17.055 -10.412 10 1HB LYS 2 2HB LYS 2 26.305 14.915 -11.348 11 2HB LYS 2 1HB LYS 2 24.892 14.924 -10.314 12 1HG LYS 2 2HG LYS 2 23.393 14.787 -12.350 13 2HG LYS 2 1HG LYS 2 24.816 14.773 -13.392 14 1HD LYS 2 2HD LYS 2 25.595 12.612 -12.301 15 2HD LYS 2 1HD LYS 2 24.171 12.626 -11.258 16 1HE LYS 2 1HE LYS 2 22.671 12.448 -13.296 17 2HE LYS 2 2HE LYS 2 24.102 12.434 -14.344 18 1HZ LYS 2 1HZ LYS 2 24.849 10.413 -13.196 19 2HZ LYS 2 2HZ LYS 2 23.517 10.426 -12.219 20 3HZ LYS 2 3HZ LYS 2 23.347 10.191 -13.846 21 H TYR 3 H TYR 3 26.754 18.798 -11.325 22 HA TYR 3 HA TYR 3 26.663 19.447 -14.212 23 1HB TYR 3 1HB TYR 3 27.824 21.468 -13.671 24 2HB TYR 3 2HB TYR 3 26.640 21.205 -12.435 25 HD1 TYR 3 HD1 TYR 3 30.324 21.103 -13.167 26 HD2 TYR 3 HD2 TYR 3 27.357 20.827 -10.060 27 HE1 TYR 3 HE1 TYR 3 32.041 21.271 -11.499 28 HE2 TYR 3 HE2 TYR 3 29.097 20.918 -8.413 29 HH TYR 3 HH TYR 3 32.534 21.248 -9.323 30 H GLU 4 H GLU 4 28.393 19.596 -15.675 31 HA GLU 4 HA GLU 4 31.063 18.255 -15.045 32 1HB GLU 4 2HB GLU 4 29.631 16.544 -16.196 33 2HB GLU 4 1HB GLU 4 29.353 17.654 -17.533 34 1HG GLU 4 2HG GLU 4 31.852 17.541 -18.052 35 2HG GLU 4 1HG GLU 4 32.060 16.364 -16.768 36 HE2 GLU 4 HE2 GLU 4 30.242 13.818 -18.426 37 H TYR 5 H TYR 5 32.401 19.964 -15.302 38 HA TYR 5 HA TYR 5 32.091 21.734 -17.795 39 1HB TYR 5 1HB TYR 5 32.621 23.722 -16.861 40 2HB TYR 5 2HB TYR 5 31.244 23.019 -16.060 41 HD1 TYR 5 HD1 TYR 5 31.154 23.100 -13.624 42 HD2 TYR 5 HD2 TYR 5 34.897 23.857 -15.603 43 HE1 TYR 5 HE1 TYR 5 32.112 23.900 -11.547 44 HE2 TYR 5 HE2 TYR 5 35.798 24.704 -13.520 45 HH TYR 5 HH TYR 5 33.878 24.753 -10.539 46 H THR 6 H THR 6 33.667 21.198 -19.064 47 HA THR 6 HA THR 6 36.336 20.316 -18.013 48 HB THR 6 HB THR 6 35.325 20.255 -20.916 49 HG1 THR 6 HG1 THR 6 34.593 18.179 -20.449 50 1HG2 THR 6 1HG2 THR 6 37.736 19.581 -20.642 51 2HG2 THR 6 2HG2 THR 6 36.717 18.193 -21.136 52 3HG2 THR 6 3HG2 THR 6 37.248 18.353 -19.439 53 H VAL 7 H VAL 7 37.342 22.090 -17.433 54 HA VAL 7 HA VAL 7 37.905 24.309 -19.484 55 HB VAL 7 HB VAL 7 38.162 24.346 -16.435 56 1HG1 VAL 7 1HG2 VAL 7 39.039 26.706 -18.234 57 2HG1 VAL 7 2HG2 VAL 7 40.118 25.622 -17.338 58 3HG1 VAL 7 3HG2 VAL 7 39.019 26.683 -16.443 59 1HG2 VAL 7 1HG1 VAL 7 35.831 24.809 -17.370 60 2HG2 VAL 7 2HG1 VAL 7 36.464 26.169 -16.426 61 3HG2 VAL 7 3HG1 VAL 7 36.448 26.230 -18.214 62 HA DPR 8 HA PRO 8 42.282 22.850 -19.440 63 1HB DPR 8 1HB PRO 8 42.745 24.084 -21.338 64 2HB DPR 8 2HB PRO 8 42.844 22.487 -22.115 65 1HG DPR 8 2HG PRO 8 41.160 24.306 -23.133 66 2HG DPR 8 1HG PRO 8 40.593 22.614 -22.906 67 1HD DPR 8 2HD PRO 8 39.958 25.047 -21.165 68 2HD DPR 8 1HD PRO 8 38.886 23.696 -21.625 69 H SER 9 H SER 9 43.368 20.932 -19.913 70 HA SER 9 HA SER 9 41.750 18.356 -20.140 71 1HB SER 9 1HB SER 9 44.698 18.815 -19.395 72 2HB SER 9 2HB SER 9 43.926 17.238 -19.586 73 HG SER 9 HG SER 9 43.359 17.846 -21.718 74 H TYR 10 H TYR 10 40.550 20.009 -18.177 75 HA TYR 10 HA TYR 10 40.890 18.288 -15.716 76 1HB TYR 10 1HB TYR 10 41.986 20.945 -15.778 77 2HB TYR 10 2HB TYR 10 40.456 21.199 -15.015 78 HD1 TYR 10 HD1 TYR 10 39.975 20.116 -12.744 79 HD2 TYR 10 HD2 TYR 10 43.777 19.537 -14.696 80 HE1 TYR 10 HE1 TYR 10 40.939 19.277 -10.684 81 HE2 TYR 10 HE2 TYR 10 44.693 18.706 -12.618 82 HH TYR 10 HH TYR 10 44.326 18.239 -10.490 83 H THR 11 H THR 11 39.120 17.385 -16.136 84 HA THR 11 HA THR 11 36.515 18.654 -16.871 85 HB THR 11 HB THR 11 37.004 15.717 -16.166 86 HG1 THR 11 HG1 THR 11 37.223 17.044 -18.659 87 1HG2 THR 11 1HG2 THR 11 35.176 15.212 -17.790 88 2HG2 THR 11 2HG2 THR 11 34.553 16.286 -16.504 89 3HG2 THR 11 3HG2 THR 11 34.944 16.947 -18.109 90 H PHE 12 H PHE 12 35.520 19.848 -15.234 91 HA PHE 12 HA PHE 12 35.909 18.996 -12.340 92 1HB PHE 12 2HB PHE 12 34.689 21.496 -13.532 93 2HB PHE 12 1HB PHE 12 34.755 21.180 -11.823 94 HD1 PHE 12 HD1 PHE 12 36.825 22.125 -14.779 95 HD2 PHE 12 HD2 PHE 12 36.954 21.222 -10.565 96 HE1 PHE 12 HE1 PHE 12 39.016 23.139 -14.601 97 HE2 PHE 12 HE2 PHE 12 39.147 22.245 -10.436 98 HZ PHE 12 HZ PHE 12 40.199 23.210 -12.444 99 H ARG 13 H ARG 13 34.619 17.178 -12.306 100 HA ARG 13 HA ARG 13 31.639 17.444 -12.807 101 1HB ARG 13 2HB ARG 13 33.347 14.942 -12.226 102 2HB ARG 13 1HB ARG 13 31.585 14.908 -12.338 103 1HG ARG 13 1HG ARG 13 31.686 15.723 -14.694 104 2HG ARG 13 2HG ARG 13 33.453 15.735 -14.616 105 1HD ARG 13 2HD ARG 13 33.398 13.203 -14.185 106 2HD ARG 13 1HD ARG 13 31.630 13.255 -14.364 107 HE ARG 13 HE ARG 13 32.801 14.496 -16.717 108 1HH1 ARG 13 2HH1 ARG 13 32.575 11.159 -15.375 109 2HH1 ARG 13 1HH1 ARG 13 32.734 10.491 -17.077 110 1HH2 ARG 13 1HH2 ARG 13 32.967 13.586 -18.545 111 2HH2 ARG 13 2HH2 ARG 13 32.938 11.760 -18.726 112 H GLY 14 H GLY 14 30.289 17.578 -11.126 113 1HA GLY 14 1HA GLY 14 30.594 16.314 -8.508 114 2HA GLY 14 2HA GLY 14 31.071 18.003 -8.355 115 HA PRO 15 HA PRO 15 26.291 17.880 -8.342 116 1HB PRO 15 2HB PRO 15 25.449 17.809 -5.726 117 2HB PRO 15 1HB PRO 15 25.963 16.367 -6.625 118 1HG PRO 15 2HG PRO 15 27.584 17.986 -4.629 119 2HG PRO 15 1HG PRO 15 27.392 16.205 -4.707 120 1HD PRO 15 1HD PRO 15 29.565 17.622 -5.832 121 2HD PRO 15 2HD PRO 15 29.008 16.045 -6.453 122 H GLY 16 H GLY 16 24.948 19.598 -8.153 123 1HA GLY 16 1HA GLY 16 24.096 21.795 -7.706 124 2HA GLY 16 2HA GLY 16 25.297 21.943 -6.429 125 H CYS 17 H CYS 17 24.336 23.589 -8.981 126 HA CYS 17 HA CYS 17 26.639 23.859 -10.709 127 1HB CYS 17 1HB CYS 17 24.745 26.225 -10.675 128 2HB CYS 17 2HB CYS 17 25.491 25.359 -12.012 129 HA PRO 18 HA PRO 18 28.574 26.751 -7.554 130 1HB PRO 18 2HB PRO 18 31.168 26.101 -7.621 131 2HB PRO 18 1HB PRO 18 29.908 24.931 -7.150 132 1HG PRO 18 1HG PRO 18 31.346 25.151 -9.825 133 2HG PRO 18 2HG PRO 18 30.974 23.677 -8.892 134 1HD PRO 18 2HD PRO 18 29.404 24.760 -11.027 135 2HD PRO 18 1HD PRO 18 28.801 23.583 -9.842 136 H THR 19 H THR 19 30.961 27.092 -10.204 137 HA THR 19 HA THR 19 30.418 30.061 -10.353 138 HB THR 19 HB THR 19 32.418 29.978 -11.943 139 HG1 THR 19 HG1 THR 19 32.301 27.771 -12.374 140 1HG2 THR 19 1HG2 THR 19 33.081 29.084 -9.105 141 2HG2 THR 19 2HG2 THR 19 34.200 29.856 -10.270 142 3HG2 THR 19 3HG2 THR 19 32.793 30.761 -9.645 143 H VAL 20 H VAL 20 29.704 30.975 -12.183 144 HA VAL 20 HA VAL 20 28.895 29.320 -14.627 145 HB VAL 20 HB VAL 20 27.016 31.127 -13.263 146 1HG1 VAL 20 1HG2 VAL 20 26.541 30.965 -15.743 147 2HG1 VAL 20 2HG2 VAL 20 26.307 29.214 -15.620 148 3HG1 VAL 20 3HG2 VAL 20 25.149 30.341 -14.850 149 1HG2 VAL 20 1HG1 VAL 20 25.475 29.194 -12.551 150 2HG2 VAL 20 2HG1 VAL 20 26.631 28.030 -13.269 151 3HG2 VAL 20 3HG1 VAL 20 27.104 29.016 -11.877 152 H LYS 21 H LYS 21 30.802 30.683 -14.458 153 HA LYS 21 HA LYS 21 31.017 33.424 -15.347 154 1HB LYS 21 2HB LYS 21 32.898 31.704 -14.443 155 2HB LYS 21 1HB LYS 21 33.027 31.229 -16.113 156 1HG LYS 21 1HG LYS 21 34.811 32.650 -15.759 157 2HG LYS 21 2HG LYS 21 33.692 33.639 -16.681 158 1HD LYS 21 2HD LYS 21 32.992 34.767 -14.468 159 2HD LYS 21 1HD LYS 21 34.161 33.757 -13.638 160 1HE LYS 21 2HE LYS 21 35.288 35.808 -13.845 161 2HE LYS 21 1HE LYS 21 36.028 34.852 -15.121 162 1HZ LYS 21 1HZ LYS 21 35.452 37.080 -15.878 163 2HZ LYS 21 2HZ LYS 21 34.529 35.995 -16.714 164 3HZ LYS 21 3HZ LYS 21 33.859 36.880 -15.490 165 HA PRO 22 HA PRO 22 29.400 33.418 -19.390 166 1HB PRO 22 1HB PRO 22 31.058 35.748 -20.320 167 2HB PRO 22 2HB PRO 22 29.295 35.580 -20.135 168 1HG PRO 22 1HG PRO 22 30.682 36.984 -18.230 169 2HG PRO 22 2HG PRO 22 29.443 35.812 -17.685 170 1HD PRO 22 2HD PRO 22 32.465 35.296 -17.947 171 2HD PRO 22 1HD PRO 22 31.413 35.171 -16.516 172 H DAL 23 H ALA 23 29.975 31.538 -20.260 173 HA DAL 23 HA ALA 23 32.451 31.238 -22.023 174 1HB DAL 23 1HB ALA 23 29.598 30.480 -22.899 175 2HB DAL 23 2HB ALA 23 30.499 31.910 -23.467 176 3HB DAL 23 3HB ALA 23 31.086 30.278 -23.864 177 H ILE 24 H ILE 24 30.266 29.449 -19.850 178 HA ILE 24 HA ILE 24 31.789 26.916 -20.427 179 HB ILE 24 HB ILE 24 29.777 27.289 -18.211 180 1HG1 ILE 24 2HG1 ILE 24 32.856 27.359 -17.730 181 2HG1 ILE 24 1HG1 ILE 24 31.911 28.815 -17.921 182 1HG2 ILE 24 1HG2 ILE 24 31.798 25.041 -18.763 183 2HG2 ILE 24 2HG2 ILE 24 30.009 24.960 -18.721 184 3HG2 ILE 24 3HG2 ILE 24 30.932 25.181 -17.217 185 1HD1 ILE 24 1HD1 ILE 24 32.235 28.386 -15.530 186 2HD1 ILE 24 2HD1 ILE 24 30.480 28.248 -15.966 187 3HD1 ILE 24 3HD1 ILE 24 31.451 26.778 -15.711 188 H SER 25 H SER 25 30.743 25.263 -21.079 189 HA SER 25 HA SER 25 27.888 25.281 -22.243 190 1HB SER 25 2HB SER 25 29.710 24.813 -23.901 191 2HB SER 25 1HB SER 25 30.328 23.500 -22.879 192 HG SER 25 HG SER 25 28.268 22.502 -23.067 193 H LEU 26 H LEU 26 27.305 25.263 -19.992 194 HA LEU 26 HA LEU 26 28.352 23.256 -18.105 195 1HB LEU 26 1HB LEU 26 27.679 25.788 -17.696 196 2HB LEU 26 2HB LEU 26 26.054 25.191 -17.601 197 HG LEU 26 HG LEU 26 26.920 23.710 -15.528 198 1HD1 LEU 26 1HD2 LEU 26 29.016 24.333 -14.398 199 2HD1 LEU 26 2HD2 LEU 26 29.345 23.813 -16.064 200 3HD1 LEU 26 3HD2 LEU 26 29.408 25.536 -15.661 201 1HD2 LEU 26 1HD1 LEU 26 26.814 25.685 -13.953 202 2HD2 LEU 26 2HD1 LEU 26 25.615 25.874 -15.246 203 3HD2 LEU 26 3HD1 LEU 26 27.128 26.798 -15.311 204 H ARG 27 H ARG 27 27.226 21.629 -17.054 205 HA ARG 27 HA ARG 27 24.548 20.706 -18.235 206 1HB ARG 27 2HB ARG 27 27.118 18.996 -18.163 207 2HB ARG 27 1HB ARG 27 25.520 18.280 -18.252 208 1HG ARG 27 1HG ARG 27 25.029 19.448 -20.403 209 2HG ARG 27 2HG ARG 27 26.610 20.225 -20.360 210 1HD ARG 27 2HD ARG 27 27.738 17.964 -20.489 211 2HD ARG 27 1HD ARG 27 26.157 17.168 -20.517 212 HE ARG 27 HE ARG 27 27.304 18.935 -22.725 213 1HH1 ARG 27 2HH2 ARG 27 24.671 16.645 -21.835 214 2HH1 ARG 27 1HH2 ARG 27 24.184 16.556 -23.602 215 1HH2 ARG 27 1HH1 ARG 27 26.634 18.724 -24.649 216 2HH2 ARG 27 2HH1 ARG 27 25.212 17.642 -25.066 217 H CYS 28 H CYS 28 24.802 21.971 -16.021 218 HA CYS 28 HA CYS 28 24.849 20.624 -13.646 219 1HB CYS 28 1HB CYS 28 24.737 23.131 -13.964 220 2HB CYS 28 2HB CYS 28 22.973 22.976 -14.117 221 H GLU 29 H GLU 29 21.761 20.882 -15.508 222 HA GLU 29 HA GLU 29 20.335 19.203 -13.422 223 1HB GLU 29 1HB GLU 29 18.264 19.635 -14.495 224 2HB GLU 29 2HB GLU 29 19.098 21.122 -14.113 225 1HG GLU 29 2HG GLU 29 19.628 21.467 -16.566 226 2HG GLU 29 1HG GLU 29 18.784 19.962 -16.953 227 HE2 GLU 29 HE2 GLU 29 18.577 23.120 -15.894 Start of MODEL 10 1 1H SER 1 1H SER 1 22.774 20.528 -10.394 2 2H SER 1 2H SER 1 21.127 20.398 -10.369 3 3H SER 1 3H SER 1 21.995 19.674 -11.574 4 HA SER 1 HA SER 1 22.084 18.984 -8.704 5 1HB SER 1 2HB SER 1 20.748 17.489 -11.012 6 2HB SER 1 1HB SER 1 20.938 16.850 -9.370 7 HG SER 1 HG SER 1 19.635 19.272 -10.084 8 H LYS 2 H LYS 2 23.326 17.908 -11.898 9 HA LYS 2 HA LYS 2 25.868 16.973 -10.528 10 1HB LYS 2 2HB LYS 2 24.356 15.124 -12.469 11 2HB LYS 2 1HB LYS 2 25.997 14.925 -11.931 12 1HG LYS 2 1HG LYS 2 25.041 13.422 -10.558 13 2HG LYS 2 2HG LYS 2 25.113 14.809 -9.473 14 1HD LYS 2 1HD LYS 2 22.641 15.272 -10.011 15 2HD LYS 2 2HD LYS 2 22.628 13.855 -11.054 16 1HE LYS 2 2HE LYS 2 23.164 12.377 -9.063 17 2HE LYS 2 1HE LYS 2 23.182 13.806 -8.012 18 1HZ LYS 2 1HZ LYS 2 21.025 12.707 -7.982 19 2HZ LYS 2 2HZ LYS 2 20.855 14.216 -8.635 20 3HZ LYS 2 3HZ LYS 2 20.840 12.886 -9.614 21 H TYR 3 H TYR 3 26.758 18.748 -11.411 22 HA TYR 3 HA TYR 3 26.665 19.413 -14.325 23 1HB TYR 3 2HB TYR 3 27.748 21.450 -13.794 24 2HB TYR 3 1HB TYR 3 26.570 21.181 -12.555 25 HD1 TYR 3 HD1 TYR 3 27.305 20.948 -10.166 26 HD2 TYR 3 HD2 TYR 3 30.258 21.129 -13.293 27 HE1 TYR 3 HE1 TYR 3 29.055 21.185 -8.531 28 HE2 TYR 3 HE2 TYR 3 31.979 21.402 -11.638 29 HH TYR 3 HH TYR 3 32.475 21.528 -9.471 30 H GLU 4 H GLU 4 28.408 19.529 -15.745 31 HA GLU 4 HA GLU 4 31.086 18.261 -15.022 32 1HB GLU 4 2HB GLU 4 29.747 16.482 -16.093 33 2HB GLU 4 1HB GLU 4 29.407 17.476 -17.491 34 1HG GLU 4 1HG GLU 4 32.267 16.606 -16.696 35 2HG GLU 4 2HG GLU 4 31.190 15.580 -17.641 36 HE2 GLU 4 HE2 GLU 4 31.809 17.070 -20.609 37 H TYR 5 H TYR 5 32.467 19.895 -15.392 38 HA TYR 5 HA TYR 5 32.113 21.649 -17.891 39 1HB TYR 5 1HB TYR 5 32.704 23.626 -16.979 40 2HB TYR 5 2HB TYR 5 31.355 22.968 -16.107 41 HD1 TYR 5 HD1 TYR 5 35.033 23.767 -15.850 42 HD2 TYR 5 HD2 TYR 5 31.417 22.996 -13.654 43 HE1 TYR 5 HE1 TYR 5 36.062 24.590 -13.819 44 HE2 TYR 5 HE2 TYR 5 32.502 23.783 -11.632 45 HH TYR 5 HH TYR 5 34.326 24.625 -10.728 46 H THR 6 H THR 6 33.663 21.054 -19.218 47 HA THR 6 HA THR 6 36.354 20.198 -18.225 48 HB THR 6 HB THR 6 35.360 20.209 -21.137 49 HG1 THR 6 HG1 THR 6 34.650 18.114 -20.740 50 1HG2 THR 6 1HG2 THR 6 37.276 18.276 -19.691 51 2HG2 THR 6 2HG2 THR 6 36.772 18.169 -21.400 52 3HG2 THR 6 3HG2 THR 6 37.777 19.545 -20.847 53 H VAL 7 H VAL 7 37.441 21.911 -17.659 54 HA VAL 7 HA VAL 7 37.986 24.148 -19.699 55 HB VAL 7 HB VAL 7 37.981 24.302 -16.642 56 1HG1 VAL 7 1HG2 VAL 7 38.722 26.677 -16.663 57 2HG1 VAL 7 2HG2 VAL 7 38.893 26.643 -18.446 58 3HG1 VAL 7 3HG2 VAL 7 39.943 25.645 -17.424 59 1HG2 VAL 7 1HG1 VAL 7 35.717 24.616 -17.784 60 2HG2 VAL 7 2HG1 VAL 7 36.336 26.038 -18.625 61 3HG2 VAL 7 3HG1 VAL 7 36.203 26.035 -16.840 62 HA DPR 8 HA PRO 8 42.409 22.846 -19.219 63 1HB DPR 8 2HB PRO 8 43.048 24.237 -20.958 64 2HB DPR 8 1HB PRO 8 43.256 22.704 -21.836 65 1HG DPR 8 1HG PRO 8 41.661 24.585 -22.895 66 2HG DPR 8 2HG PRO 8 41.104 22.876 -22.861 67 1HD DPR 8 1HD PRO 8 40.234 25.159 -21.030 68 2HD DPR 8 2HD PRO 8 39.252 23.826 -21.692 69 H SER 9 H SER 9 43.583 20.961 -19.793 70 HA SER 9 HA SER 9 41.994 18.420 -20.360 71 1HB SER 9 1HB SER 9 44.882 18.817 -19.378 72 2HB SER 9 2HB SER 9 44.139 17.263 -19.758 73 HG SER 9 HG SER 9 44.382 19.468 -21.535 74 H TYR 10 H TYR 10 40.656 19.886 -18.325 75 HA TYR 10 HA TYR 10 40.944 18.041 -15.951 76 1HB TYR 10 2HB TYR 10 42.113 20.637 -15.840 77 2HB TYR 10 1HB TYR 10 40.559 20.946 -15.149 78 HD1 TYR 10 HD1 TYR 10 39.916 19.823 -12.935 79 HD2 TYR 10 HD2 TYR 10 43.775 19.110 -14.724 80 HE1 TYR 10 HE1 TYR 10 40.736 18.868 -10.863 81 HE2 TYR 10 HE2 TYR 10 44.547 18.166 -12.639 82 HH TYR 10 HH TYR 10 44.053 17.650 -10.545 83 H THR 11 H THR 11 39.167 17.187 -16.419 84 HA THR 11 HA THR 11 36.590 18.508 -17.130 85 HB THR 11 HB THR 11 37.037 15.550 -16.490 86 HG1 THR 11 HG1 THR 11 38.451 16.344 -18.073 87 1HG2 THR 11 1HG2 THR 11 34.591 16.125 -16.797 88 2HG2 THR 11 2HG2 THR 11 34.971 16.863 -18.373 89 3HG2 THR 11 3HG2 THR 11 35.202 15.114 -18.139 90 H PHE 12 H PHE 12 35.575 19.674 -15.492 91 HA PHE 12 HA PHE 12 35.912 18.785 -12.606 92 1HB PHE 12 1HB PHE 12 34.772 21.322 -13.827 93 2HB PHE 12 2HB PHE 12 34.742 20.995 -12.120 94 HD1 PHE 12 HD1 PHE 12 36.856 21.012 -10.744 95 HD2 PHE 12 HD2 PHE 12 37.000 21.869 -14.967 96 HE1 PHE 12 HE1 PHE 12 39.058 21.989 -10.492 97 HE2 PHE 12 HE2 PHE 12 39.198 22.841 -14.666 98 HZ PHE 12 HZ PHE 12 40.250 22.911 -12.442 99 H ARG 13 H ARG 13 34.622 16.953 -12.657 100 HA ARG 13 HA ARG 13 31.635 17.248 -13.069 101 1HB ARG 13 1HB ARG 13 33.351 14.764 -12.418 102 2HB ARG 13 2HB ARG 13 31.590 14.724 -12.447 103 1HG ARG 13 2HG ARG 13 31.580 15.422 -14.854 104 2HG ARG 13 1HG ARG 13 33.346 15.433 -14.862 105 1HD ARG 13 2HD ARG 13 33.352 12.949 -14.330 106 2HD ARG 13 1HD ARG 13 31.575 12.956 -14.344 107 HE ARG 13 HE ARG 13 32.641 14.085 -16.854 108 1HH1 ARG 13 2HH1 ARG 13 32.018 10.871 -15.350 109 2HH1 ARG 13 1HH1 ARG 13 31.930 10.131 -17.027 110 1HH2 ARG 13 1HH2 ARG 13 32.512 13.102 -18.647 111 2HH2 ARG 13 2HH2 ARG 13 32.188 11.298 -18.743 112 H GLY 14 H GLY 14 30.345 17.527 -11.359 113 1HA GLY 14 1HA GLY 14 30.791 16.507 -8.620 114 2HA GLY 14 2HA GLY 14 31.203 18.219 -8.700 115 HA PRO 15 HA PRO 15 26.422 17.856 -8.516 116 1HB PRO 15 2HB PRO 15 25.603 17.692 -5.896 117 2HB PRO 15 1HB PRO 15 26.158 16.293 -6.837 118 1HG PRO 15 2HG PRO 15 27.743 17.918 -4.814 119 2HG PRO 15 1HG PRO 15 27.612 16.135 -4.933 120 1HD PRO 15 1HD PRO 15 29.724 17.643 -6.041 121 2HD PRO 15 2HD PRO 15 29.205 16.072 -6.705 122 H GLY 16 H GLY 16 24.990 19.508 -8.248 123 1HA GLY 16 1HA GLY 16 24.048 21.643 -7.701 124 2HA GLY 16 2HA GLY 16 25.304 21.836 -6.484 125 H CYS 17 H CYS 17 24.140 23.386 -9.069 126 HA CYS 17 HA CYS 17 26.354 23.772 -10.850 127 1HB CYS 17 1HB CYS 17 24.335 26.047 -10.690 128 2HB CYS 17 2HB CYS 17 25.133 25.310 -12.078 129 HA PRO 18 HA PRO 18 28.441 26.664 -7.831 130 1HB PRO 18 2HB PRO 18 31.049 26.427 -8.446 131 2HB PRO 18 1HB PRO 18 30.077 25.033 -7.913 132 1HG PRO 18 1HG PRO 18 30.854 25.790 -10.774 133 2HG PRO 18 2HG PRO 18 30.999 24.190 -9.989 134 1HD PRO 18 2HD PRO 18 28.812 24.978 -11.587 135 2HD PRO 18 1HD PRO 18 28.689 23.746 -10.306 136 H THR 19 H THR 19 30.827 28.220 -9.708 137 HA THR 19 HA THR 19 29.144 30.650 -10.142 138 HB THR 19 HB THR 19 31.347 31.580 -11.051 139 HG1 THR 19 HG1 THR 19 32.283 29.575 -11.492 140 1HG2 THR 19 1HG2 THR 19 32.478 31.969 -8.919 141 2HG2 THR 19 2HG2 THR 19 30.710 32.153 -8.752 142 3HG2 THR 19 3HG2 THR 19 31.510 30.677 -8.145 143 H VAL 20 H VAL 20 28.651 31.448 -12.112 144 HA VAL 20 HA VAL 20 28.988 29.666 -14.604 145 HB VAL 20 HB VAL 20 26.415 30.796 -13.708 146 1HG1 VAL 20 1HG2 VAL 20 25.202 29.304 -15.419 147 2HG1 VAL 20 2HG2 VAL 20 26.465 30.257 -16.199 148 3HG1 VAL 20 3HG2 VAL 20 26.767 28.553 -15.847 149 1HG2 VAL 20 1HG1 VAL 20 26.844 29.000 -12.030 150 2HG2 VAL 20 2HG1 VAL 20 27.038 27.784 -13.297 151 3HG2 VAL 20 3HG1 VAL 20 25.436 28.524 -12.987 152 H LYS 21 H LYS 21 30.226 31.775 -14.074 153 HA LYS 21 HA LYS 21 29.605 34.177 -15.707 154 1HB LYS 21 1HB LYS 21 31.805 34.919 -15.594 155 2HB LYS 21 2HB LYS 21 31.260 34.328 -14.042 156 1HG LYS 21 1HG LYS 21 32.707 32.203 -14.454 157 2HG LYS 21 2HG LYS 21 33.308 32.963 -15.929 158 1HD LYS 21 2HD LYS 21 34.153 34.907 -14.561 159 2HD LYS 21 1HD LYS 21 33.569 34.132 -13.087 160 1HE LYS 21 1HE LYS 21 35.701 32.822 -14.931 161 2HE LYS 21 2HE LYS 21 36.102 33.963 -13.657 162 1HZ LYS 21 1HZ LYS 21 36.296 31.703 -12.867 163 2HZ LYS 21 2HZ LYS 21 34.709 31.379 -13.190 164 3HZ LYS 21 3HZ LYS 21 35.106 32.474 -12.019 165 HA PRO 22 HA PRO 22 29.493 32.916 -19.778 166 1HB PRO 22 2HB PRO 22 30.899 35.360 -20.904 167 2HB PRO 22 1HB PRO 22 29.251 34.748 -21.182 168 1HG PRO 22 1HG PRO 22 29.579 36.861 -19.472 169 2HG PRO 22 2HG PRO 22 28.497 35.531 -18.958 170 1HD PRO 22 1HD PRO 22 31.463 35.877 -18.221 171 2HD PRO 22 2HD PRO 22 30.034 35.752 -17.161 172 H DAL 23 H ALA 23 30.435 31.467 -21.050 173 HA DAL 23 HA ALA 23 33.308 30.812 -20.680 174 1HB DAL 23 1HB ALA 23 33.941 30.559 -23.075 175 2HB DAL 23 2HB ALA 23 33.523 32.255 -22.712 176 3HB DAL 23 3HB ALA 23 32.365 31.218 -23.587 177 H ILE 24 H ILE 24 31.544 29.448 -19.445 178 HA ILE 24 HA ILE 24 32.031 26.816 -20.305 179 HB ILE 24 HB ILE 24 29.923 27.328 -18.215 180 1HG1 ILE 24 1HG1 ILE 24 32.928 27.167 -17.419 181 2HG1 ILE 24 2HG1 ILE 24 32.107 28.686 -17.666 182 1HG2 ILE 24 1HG2 ILE 24 30.788 25.109 -17.212 183 2HG2 ILE 24 2HG2 ILE 24 31.906 24.987 -18.589 184 3HG2 ILE 24 3HG2 ILE 24 30.142 24.952 -18.854 185 1HD1 ILE 24 1HD1 ILE 24 31.243 26.634 -15.603 186 2HD1 ILE 24 2HD1 ILE 24 30.431 28.187 -15.915 187 3HD1 ILE 24 3HD1 ILE 24 32.127 28.168 -15.271 188 H SER 25 H SER 25 30.838 25.319 -21.071 189 HA SER 25 HA SER 25 28.001 25.672 -22.218 190 1HB SER 25 2HB SER 25 29.756 25.282 -23.978 191 2HB SER 25 1HB SER 25 30.309 23.828 -23.123 192 HG SER 25 HG SER 25 28.809 23.369 -24.776 193 H LEU 26 H LEU 26 27.407 25.407 -20.008 194 HA LEU 26 HA LEU 26 28.484 23.228 -18.321 195 1HB LEU 26 2HB LEU 26 28.011 25.661 -17.628 196 2HB LEU 26 1HB LEU 26 26.313 25.244 -17.699 197 HG LEU 26 HG LEU 26 26.800 23.542 -15.735 198 1HD1 LEU 26 1HD2 LEU 26 28.841 23.691 -14.403 199 2HD1 LEU 26 2HD2 LEU 26 29.540 24.932 -15.467 200 3HD1 LEU 26 3HD2 LEU 26 29.251 23.281 -16.080 201 1HD2 LEU 26 1HD1 LEU 26 26.852 25.349 -13.981 202 2HD2 LEU 26 2HD1 LEU 26 27.458 26.513 -15.188 203 3HD2 LEU 26 3HD1 LEU 26 25.819 25.848 -15.332 204 H ARG 27 H ARG 27 27.282 21.650 -17.223 205 HA ARG 27 HA ARG 27 24.617 20.768 -18.434 206 1HB ARG 27 1HB ARG 27 27.159 19.016 -18.444 207 2HB ARG 27 2HB ARG 27 25.548 18.328 -18.527 208 1HG ARG 27 2HG ARG 27 25.043 19.565 -20.635 209 2HG ARG 27 1HG ARG 27 26.638 20.314 -20.597 210 1HD ARG 27 1HD ARG 27 27.726 18.032 -20.807 211 2HD ARG 27 2HD ARG 27 26.122 17.274 -20.844 212 HE ARG 27 HE ARG 27 26.000 19.207 -22.919 213 1HH1 ARG 27 1HH1 ARG 27 28.221 16.423 -22.371 214 2HH1 ARG 27 2HH1 ARG 27 28.471 16.297 -24.185 215 1HH2 ARG 27 2HH2 ARG 27 26.388 18.928 -24.911 216 2HH2 ARG 27 1HH2 ARG 27 27.513 17.606 -25.505 217 H CYS 28 H CYS 28 24.841 21.972 -16.192 218 HA CYS 28 HA CYS 28 24.838 20.565 -13.848 219 1HB CYS 28 1HB CYS 28 24.653 23.075 -14.096 220 2HB CYS 28 2HB CYS 28 22.899 22.861 -14.296 221 H GLU 29 H GLU 29 21.773 20.865 -15.759 222 HA GLU 29 HA GLU 29 20.408 18.869 -13.878 223 1HB GLU 29 1HB GLU 29 19.280 20.639 -16.121 224 2HB GLU 29 2HB GLU 29 18.323 19.392 -15.359 225 1HG GLU 29 2HG GLU 29 19.516 21.736 -13.769 226 2HG GLU 29 1HG GLU 29 17.941 21.784 -14.555 227 HE2 GLU 29 HE2 GLU 29 16.310 19.674 -12.357 Start of MODEL 11 1 1H SER 1 1H SER 1 20.702 18.343 -9.398 2 2H SER 1 2H SER 1 20.302 17.299 -10.613 3 3H SER 1 3H SER 1 19.603 18.794 -10.545 4 HA SER 1 HA SER 1 21.243 18.762 -12.283 5 1HB SER 1 2HB SER 1 22.545 20.748 -11.557 6 2HB SER 1 1HB SER 1 20.837 20.876 -11.110 7 HG SER 1 HG SER 1 21.418 20.141 -9.018 8 H LYS 2 H LYS 2 23.147 17.877 -12.979 9 HA LYS 2 HA LYS 2 25.258 16.915 -11.043 10 1HB LYS 2 2HB LYS 2 23.685 14.997 -11.662 11 2HB LYS 2 1HB LYS 2 24.073 15.263 -13.362 12 1HG LYS 2 2HG LYS 2 26.487 14.728 -12.863 13 2HG LYS 2 1HG LYS 2 26.074 14.482 -11.157 14 1HD LYS 2 1HD LYS 2 24.537 12.561 -11.821 15 2HD LYS 2 2HD LYS 2 24.958 12.812 -13.518 16 1HE LYS 2 2HE LYS 2 27.380 12.260 -13.001 17 2HE LYS 2 1HE LYS 2 26.956 12.007 -11.298 18 1HZ LYS 2 1HZ LYS 2 25.818 10.479 -13.591 19 2HZ LYS 2 2HZ LYS 2 25.423 10.244 -12.004 20 3HZ LYS 2 3HZ LYS 2 26.957 9.926 -12.529 21 H TYR 3 H TYR 3 26.356 18.700 -11.614 22 HA TYR 3 HA TYR 3 26.731 19.615 -14.396 23 1HB TYR 3 2HB TYR 3 27.129 21.604 -13.576 24 2HB TYR 3 1HB TYR 3 26.523 21.019 -12.085 25 HD1 TYR 3 HD1 TYR 3 29.060 19.617 -10.911 26 HD2 TYR 3 HD2 TYR 3 28.433 23.428 -12.809 27 HE1 TYR 3 HE1 TYR 3 30.907 20.568 -9.671 28 HE2 TYR 3 HE2 TYR 3 30.226 24.347 -11.505 29 HH TYR 3 HH TYR 3 31.785 23.990 -9.956 30 H GLU 4 H GLU 4 28.413 19.394 -15.692 31 HA GLU 4 HA GLU 4 31.102 18.238 -14.771 32 1HB GLU 4 2HB GLU 4 29.663 16.385 -15.726 33 2HB GLU 4 1HB GLU 4 29.433 17.315 -17.201 34 1HG GLU 4 1HG GLU 4 31.957 17.122 -17.619 35 2HG GLU 4 2HG GLU 4 32.090 16.080 -16.212 36 HE2 GLU 4 HE2 GLU 4 30.468 14.376 -16.187 37 H TYR 5 H TYR 5 32.356 19.994 -15.177 38 HA TYR 5 HA TYR 5 32.026 21.483 -17.862 39 1HB TYR 5 1HB TYR 5 32.580 23.510 -17.133 40 2HB TYR 5 2HB TYR 5 31.267 22.921 -16.144 41 HD1 TYR 5 HD1 TYR 5 34.862 23.968 -16.169 42 HD2 TYR 5 HD2 TYR 5 31.545 22.884 -13.644 43 HE1 TYR 5 HE1 TYR 5 35.965 24.968 -14.262 44 HE2 TYR 5 HE2 TYR 5 32.692 23.925 -11.765 45 HH TYR 5 HH TYR 5 34.464 24.997 -11.049 46 H THR 6 H THR 6 33.482 20.596 -19.098 47 HA THR 6 HA THR 6 36.218 19.868 -18.100 48 HB THR 6 HB THR 6 34.979 19.340 -20.864 49 HG1 THR 6 HG1 THR 6 34.328 17.366 -19.996 50 1HG2 THR 6 1HG2 THR 6 37.415 18.723 -20.710 51 2HG2 THR 6 2HG2 THR 6 36.380 17.271 -20.871 52 3HG2 THR 6 3HG2 THR 6 37.063 17.710 -19.281 53 H VAL 7 H VAL 7 37.253 21.704 -17.890 54 HA VAL 7 HA VAL 7 37.661 23.561 -20.306 55 HB VAL 7 HB VAL 7 38.065 24.116 -17.323 56 1HG1 VAL 7 1HG1 VAL 7 39.933 25.263 -18.536 57 2HG1 VAL 7 2HG1 VAL 7 38.776 26.156 -19.539 58 3HG1 VAL 7 3HG1 VAL 7 38.849 26.437 -17.771 59 1HG2 VAL 7 1HG2 VAL 7 36.315 25.877 -17.525 60 2HG2 VAL 7 2HG2 VAL 7 36.205 25.635 -19.295 61 3HG2 VAL 7 3HG2 VAL 7 35.677 24.363 -18.191 62 HA DPR 8 HA PRO 8 42.068 22.165 -20.210 63 1HB DPR 8 1HB PRO 8 42.456 23.137 -22.275 64 2HB DPR 8 2HB PRO 8 42.535 21.449 -22.832 65 1HG DPR 8 2HG PRO 8 40.808 23.115 -24.026 66 2HG DPR 8 1HG PRO 8 40.258 21.469 -23.554 67 1HD DPR 8 2HD PRO 8 39.669 24.113 -22.137 68 2HD DPR 8 1HD PRO 8 38.592 22.708 -22.369 69 H SER 9 H SER 9 43.144 20.192 -20.478 70 HA SER 9 HA SER 9 41.503 17.624 -20.272 71 1HB SER 9 1HB SER 9 44.493 18.137 -19.776 72 2HB SER 9 2HB SER 9 43.701 16.560 -19.705 73 HG SER 9 HG SER 9 43.717 18.315 -21.940 74 H TYR 10 H TYR 10 40.401 19.509 -18.512 75 HA TYR 10 HA TYR 10 40.885 18.163 -15.850 76 1HB TYR 10 2HB TYR 10 41.915 20.809 -16.351 77 2HB TYR 10 1HB TYR 10 40.430 21.133 -15.532 78 HD1 TYR 10 HD1 TYR 10 40.109 20.339 -13.114 79 HD2 TYR 10 HD2 TYR 10 43.811 19.612 -15.202 80 HE1 TYR 10 HE1 TYR 10 41.219 19.811 -11.024 81 HE2 TYR 10 HE2 TYR 10 44.874 19.090 -13.092 82 HH TYR 10 HH TYR 10 44.645 18.902 -10.904 83 H THR 11 H THR 11 39.116 17.195 -16.038 84 HA THR 11 HA THR 11 36.452 18.294 -16.831 85 HB THR 11 HB THR 11 37.089 15.517 -15.716 86 HG1 THR 11 HG1 THR 11 38.367 16.075 -17.502 87 1HG2 THR 11 1HG2 THR 11 34.859 16.361 -17.676 88 2HG2 THR 11 2HG2 THR 11 35.195 14.704 -17.116 89 3HG2 THR 11 3HG2 THR 11 34.602 15.936 -15.964 90 H PHE 12 H PHE 12 35.558 19.762 -15.327 91 HA PHE 12 HA PHE 12 36.054 19.296 -12.363 92 1HB PHE 12 2HB PHE 12 34.852 21.640 -13.851 93 2HB PHE 12 1HB PHE 12 34.925 21.554 -12.116 94 HD1 PHE 12 HD1 PHE 12 36.958 22.121 -15.175 95 HD2 PHE 12 HD2 PHE 12 37.150 21.680 -10.890 96 HE1 PHE 12 HE1 PHE 12 39.150 23.149 -15.140 97 HE2 PHE 12 HE2 PHE 12 39.343 22.710 -10.906 98 HZ PHE 12 HZ PHE 12 40.363 23.454 -13.020 99 H ARG 13 H ARG 13 34.751 17.565 -11.977 100 HA ARG 13 HA ARG 13 31.729 17.815 -12.329 101 1HB ARG 13 1HB ARG 13 33.466 15.374 -11.551 102 2HB ARG 13 2HB ARG 13 31.701 15.354 -11.565 103 1HG ARG 13 1HG ARG 13 31.692 15.858 -14.020 104 2HG ARG 13 2HG ARG 13 33.457 15.849 -14.020 105 1HD ARG 13 1HD ARG 13 33.418 13.403 -13.265 106 2HD ARG 13 2HD ARG 13 31.644 13.441 -13.345 107 HE ARG 13 HE ARG 13 32.535 14.346 -15.911 108 1HH1 ARG 13 2HH2 ARG 13 32.925 11.249 -14.111 109 2HH1 ARG 13 1HH2 ARG 13 33.072 10.365 -15.713 110 1HH2 ARG 13 1HH1 ARG 13 32.718 13.208 -17.605 111 2HH2 ARG 13 2HH1 ARG 13 32.963 11.391 -17.532 112 H GLY 14 H GLY 14 30.507 18.065 -10.495 113 1HA GLY 14 1HA GLY 14 31.106 17.109 -7.791 114 2HA GLY 14 2HA GLY 14 31.512 18.843 -7.874 115 HA PRO 15 HA PRO 15 26.871 18.348 -9.268 116 1HB PRO 15 2HB PRO 15 25.108 16.741 -7.692 117 2HB PRO 15 1HB PRO 15 25.995 16.183 -9.117 118 1HG PRO 15 1HG PRO 15 26.853 15.958 -6.200 119 2HG PRO 15 2HG PRO 15 26.769 14.651 -7.421 120 1HD PRO 15 2HD PRO 15 29.153 15.899 -6.902 121 2HD PRO 15 1HD PRO 15 28.716 15.525 -8.597 122 H GLY 16 H GLY 16 25.083 19.551 -8.712 123 1HA GLY 16 2HA GLY 16 23.854 21.249 -7.342 124 2HA GLY 16 1HA GLY 16 25.090 21.129 -6.082 125 H CYS 17 H CYS 17 24.304 22.536 -9.176 126 HA CYS 17 HA CYS 17 26.910 23.365 -10.026 127 1HB CYS 17 2HB CYS 17 24.405 24.820 -10.959 128 2HB CYS 17 1HB CYS 17 25.903 24.506 -11.843 129 HA PRO 18 HA PRO 18 26.717 27.032 -7.075 130 1HB PRO 18 2HB PRO 18 29.174 27.086 -6.007 131 2HB PRO 18 1HB PRO 18 28.063 25.711 -5.779 132 1HG PRO 18 1HG PRO 18 30.468 25.881 -7.628 133 2HG PRO 18 2HG PRO 18 29.914 24.501 -6.645 134 1HD PRO 18 1HD PRO 18 29.324 25.045 -9.427 135 2HD PRO 18 2HD PRO 18 28.570 23.764 -8.450 136 H THR 19 H THR 19 29.845 27.518 -8.771 137 HA THR 19 HA THR 19 29.023 30.287 -9.647 138 HB THR 19 HB THR 19 31.401 30.285 -10.595 139 HG1 THR 19 HG1 THR 19 31.663 28.050 -10.604 140 1HG2 THR 19 1HG2 THR 19 32.622 30.713 -8.516 141 2HG2 THR 19 2HG2 THR 19 31.306 29.964 -7.564 142 3HG2 THR 19 3HG2 THR 19 31.005 31.468 -8.478 143 H VAL 20 H VAL 20 29.139 30.884 -11.982 144 HA VAL 20 HA VAL 20 29.447 28.966 -14.014 145 HB VAL 20 HB VAL 20 27.543 29.318 -15.187 146 1HG1 VAL 20 1HG2 VAL 20 26.158 27.369 -14.405 147 2HG1 VAL 20 2HG2 VAL 20 27.872 27.103 -14.032 148 3HG1 VAL 20 3HG2 VAL 20 26.765 27.607 -12.743 149 1HG2 VAL 20 1HG1 VAL 20 26.212 31.170 -14.104 150 2HG2 VAL 20 2HG1 VAL 20 25.784 30.089 -12.764 151 3HG2 VAL 20 3HG1 VAL 20 25.168 29.775 -14.411 152 H LYS 21 H LYS 21 30.933 30.389 -14.028 153 HA LYS 21 HA LYS 21 30.844 33.241 -14.682 154 1HB LYS 21 2HB LYS 21 32.854 31.687 -13.706 155 2HB LYS 21 1HB LYS 21 33.178 31.363 -15.380 156 1HG LYS 21 1HG LYS 21 34.714 32.972 -14.818 157 2HG LYS 21 2HG LYS 21 33.526 33.888 -15.735 158 1HD LYS 21 2HD LYS 21 32.541 34.714 -13.515 159 2HD LYS 21 1HD LYS 21 33.775 33.802 -12.649 160 1HE LYS 21 1HE LYS 21 35.590 35.206 -13.749 161 2HE LYS 21 2HE LYS 21 34.346 36.125 -14.618 162 1HZ LYS 21 1HZ LYS 21 35.008 37.242 -12.574 163 2HZ LYS 21 2HZ LYS 21 34.580 35.942 -11.650 164 3HZ LYS 21 3HZ LYS 21 33.421 36.798 -12.460 165 HA PRO 22 HA PRO 22 29.604 33.134 -18.886 166 1HB PRO 22 1HB PRO 22 30.905 35.787 -19.553 167 2HB PRO 22 2HB PRO 22 29.190 35.314 -19.529 168 1HG PRO 22 2HG PRO 22 30.184 36.827 -17.467 169 2HG PRO 22 1HG PRO 22 29.099 35.458 -17.076 170 1HD PRO 22 2HD PRO 22 32.178 35.413 -17.086 171 2HD PRO 22 1HD PRO 22 31.044 35.070 -15.757 172 H DAL 23 H ALA 23 30.234 32.018 -20.607 173 HA DAL 23 HA ALA 23 33.109 31.482 -21.153 174 1HB DAL 23 1HB ALA 23 31.413 32.483 -23.521 175 2HB DAL 23 2HB ALA 23 33.068 31.824 -23.615 176 3HB DAL 23 3HB ALA 23 32.766 33.361 -22.759 177 H ILE 24 H ILE 24 31.883 29.761 -19.877 178 HA ILE 24 HA ILE 24 31.952 27.429 -21.500 179 HB ILE 24 HB ILE 24 30.910 27.388 -18.692 180 1HG1 ILE 24 1HG1 ILE 24 33.982 26.980 -19.091 181 2HG1 ILE 24 2HG1 ILE 24 33.363 28.591 -18.992 182 1HG2 ILE 24 1HG2 ILE 24 31.907 25.048 -18.555 183 2HG2 ILE 24 2HG2 ILE 24 32.488 25.220 -20.236 184 3HG2 ILE 24 3HG2 ILE 24 30.737 25.193 -19.880 185 1HD1 ILE 24 1HD1 ILE 24 34.077 27.885 -16.785 186 2HD1 ILE 24 2HD1 ILE 24 32.876 26.535 -16.827 187 3HD1 ILE 24 3HD1 ILE 24 32.303 28.225 -16.824 188 H SER 25 H SER 25 30.439 26.015 -21.984 189 HA SER 25 HA SER 25 27.441 26.703 -22.031 190 1HB SER 25 2HB SER 25 28.499 26.545 -24.278 191 2HB SER 25 1HB SER 25 29.132 24.931 -23.899 192 HG SER 25 HG SER 25 26.963 24.257 -23.555 193 H LEU 26 H LEU 26 27.049 25.917 -19.999 194 HA LEU 26 HA LEU 26 28.382 23.549 -18.838 195 1HB LEU 26 1HB LEU 26 26.127 25.304 -17.731 196 2HB LEU 26 2HB LEU 26 26.848 24.007 -16.834 197 HG LEU 26 HG LEU 26 27.597 25.962 -15.926 198 1HD1 LEU 26 1HD2 LEU 26 30.034 25.770 -15.793 199 2HD1 LEU 26 2HD2 LEU 26 30.061 24.826 -17.309 200 3HD1 LEU 26 3HD2 LEU 26 29.268 24.166 -15.860 201 1HD2 LEU 26 1HD1 LEU 26 28.947 27.782 -17.012 202 2HD2 LEU 26 2HD1 LEU 26 27.331 27.600 -17.724 203 3HD2 LEU 26 3HD1 LEU 26 28.740 26.950 -18.585 204 H ARG 27 H ARG 27 27.385 21.667 -18.008 205 HA ARG 27 HA ARG 27 24.706 20.851 -19.150 206 1HB ARG 27 2HB ARG 27 25.331 18.643 -19.550 207 2HB ARG 27 1HB ARG 27 26.467 19.675 -20.397 208 1HG ARG 27 2HG ARG 27 28.220 19.155 -18.671 209 2HG ARG 27 1HG ARG 27 27.100 18.120 -17.801 210 1HD ARG 27 1HD ARG 27 27.929 17.583 -20.743 211 2HD ARG 27 2HD ARG 27 28.840 16.994 -19.360 212 HE ARG 27 HE ARG 27 26.237 16.034 -18.829 213 1HH1 ARG 27 1HH1 ARG 27 28.451 15.556 -21.630 214 2HH1 ARG 27 2HH1 ARG 27 27.668 13.926 -21.940 215 1HH2 ARG 27 1HH2 ARG 27 25.474 14.195 -19.312 216 2HH2 ARG 27 2HH2 ARG 27 26.116 13.221 -20.729 217 H CYS 28 H CYS 28 24.986 22.217 -16.944 218 HA CYS 28 HA CYS 28 24.779 21.009 -14.520 219 1HB CYS 28 2HB CYS 28 24.768 23.428 -14.798 220 2HB CYS 28 1HB CYS 28 23.139 23.401 -15.500 221 H GLU 29 H GLU 29 21.835 21.214 -16.627 222 HA GLU 29 HA GLU 29 20.624 18.852 -15.124 223 1HB GLU 29 2HB GLU 29 19.174 21.546 -15.570 224 2HB GLU 29 1HB GLU 29 18.304 20.048 -15.267 225 1HG GLU 29 1HG GLU 29 19.368 19.799 -13.024 226 2HG GLU 29 2HG GLU 29 20.287 21.289 -13.279 227 HE2 GLU 29 HE2 GLU 29 19.195 23.126 -13.633 Start of MODEL 12 1 1H SER 1 1H SER 1 22.388 20.192 -10.876 2 2H SER 1 2H SER 1 21.654 18.958 -11.693 3 3H SER 1 3H SER 1 20.775 19.905 -10.664 4 HA SER 1 HA SER 1 21.998 19.139 -8.766 5 1HB SER 1 2HB SER 1 20.734 16.908 -10.432 6 2HB SER 1 1HB SER 1 21.086 16.797 -8.699 7 HG SER 1 HG SER 1 19.782 18.650 -8.393 8 H LYS 2 H LYS 2 23.231 17.379 -11.659 9 HA LYS 2 HA LYS 2 25.824 16.837 -10.152 10 1HB LYS 2 1HB LYS 2 24.318 14.790 -10.158 11 2HB LYS 2 2HB LYS 2 24.247 14.868 -11.907 12 1HG LYS 2 2HG LYS 2 25.730 13.174 -11.569 13 2HG LYS 2 1HG LYS 2 26.774 14.519 -11.942 14 1HD LYS 2 1HD LYS 2 27.969 13.487 -10.237 15 2HD LYS 2 2HD LYS 2 27.183 14.795 -9.370 16 1HE LYS 2 2HE LYS 2 25.443 13.127 -8.513 17 2HE LYS 2 1HE LYS 2 26.279 11.833 -9.389 18 1HZ LYS 2 1HZ LYS 2 27.498 13.519 -7.249 19 2HZ LYS 2 2HZ LYS 2 28.279 12.314 -8.066 20 3HZ LYS 2 3HZ LYS 2 27.005 11.952 -7.079 21 H TYR 3 H TYR 3 26.549 18.660 -11.188 22 HA TYR 3 HA TYR 3 26.470 19.100 -14.105 23 1HB TYR 3 2HB TYR 3 27.493 21.219 -13.698 24 2HB TYR 3 1HB TYR 3 26.364 20.961 -12.413 25 HD1 TYR 3 HD1 TYR 3 27.186 20.781 -10.039 26 HD2 TYR 3 HD2 TYR 3 30.021 21.082 -13.268 27 HE1 TYR 3 HE1 TYR 3 28.987 21.080 -8.466 28 HE2 TYR 3 HE2 TYR 3 31.789 21.387 -11.676 29 HH TYR 3 HH TYR 3 31.164 21.378 -8.162 30 H GLU 4 H GLU 4 28.130 19.206 -15.598 31 HA GLU 4 HA GLU 4 30.880 18.049 -14.924 32 1HB GLU 4 1HB GLU 4 29.500 16.230 -15.934 33 2HB GLU 4 2HB GLU 4 29.164 17.208 -17.346 34 1HG GLU 4 2HG GLU 4 32.019 16.338 -16.529 35 2HG GLU 4 1HG GLU 4 30.947 15.319 -17.486 36 HE2 GLU 4 HE2 GLU 4 30.834 15.563 -19.437 37 H TYR 5 H TYR 5 32.093 19.824 -15.239 38 HA TYR 5 HA TYR 5 31.787 21.399 -17.851 39 1HB TYR 5 2HB TYR 5 32.287 23.497 -16.920 40 2HB TYR 5 1HB TYR 5 30.773 22.839 -16.340 41 HD1 TYR 5 HD1 TYR 5 30.293 23.310 -14.012 42 HD2 TYR 5 HD2 TYR 5 34.397 23.384 -15.301 43 HE1 TYR 5 HE1 TYR 5 30.956 24.357 -11.935 44 HE2 TYR 5 HE2 TYR 5 35.019 24.417 -13.199 45 HH TYR 5 HH TYR 5 34.336 25.196 -11.254 46 H THR 6 H THR 6 33.652 21.524 -19.007 47 HA THR 6 HA THR 6 36.290 20.882 -17.702 48 HB THR 6 HB THR 6 37.087 21.094 -20.181 49 HG1 THR 6 HG1 THR 6 35.487 20.828 -21.708 50 1HG2 THR 6 1HG2 THR 6 36.366 18.861 -20.911 51 2HG2 THR 6 2HG2 THR 6 36.889 18.864 -19.207 52 3HG2 THR 6 3HG2 THR 6 35.147 18.806 -19.602 53 H VAL 7 H VAL 7 37.261 22.475 -16.821 54 HA VAL 7 HA VAL 7 37.518 25.194 -18.250 55 HB VAL 7 HB VAL 7 38.120 24.475 -15.336 56 1HG1 VAL 7 1HG2 VAL 7 38.762 27.238 -16.577 57 2HG1 VAL 7 2HG2 VAL 7 39.949 26.007 -16.108 58 3HG1 VAL 7 3HG2 VAL 7 38.957 26.776 -14.857 59 1HG2 VAL 7 1HG1 VAL 7 36.430 26.194 -14.683 60 2HG2 VAL 7 2HG1 VAL 7 35.703 25.063 -15.830 61 3HG2 VAL 7 3HG1 VAL 7 36.190 26.663 -16.393 62 HA DPR 8 HA PRO 8 41.821 23.671 -19.077 63 1HB DPR 8 1HB PRO 8 42.117 25.347 -20.662 64 2HB DPR 8 2HB PRO 8 42.066 23.981 -21.802 65 1HG DPR 8 2HG PRO 8 40.360 26.022 -22.157 66 2HG DPR 8 1HG PRO 8 39.754 24.333 -22.282 67 1HD DPR 8 2HD PRO 8 39.372 26.283 -19.966 68 2HD DPR 8 1HD PRO 8 38.237 25.058 -20.593 69 H SER 9 H SER 9 42.722 21.900 -20.130 70 HA SER 9 HA SER 9 40.960 19.516 -20.816 71 1HB SER 9 1HB SER 9 43.972 19.694 -20.200 72 2HB SER 9 2HB SER 9 43.124 18.235 -20.710 73 HG SER 9 HG SER 9 44.042 19.364 -22.456 74 H TYR 10 H TYR 10 40.007 20.648 -18.379 75 HA TYR 10 HA TYR 10 40.647 18.477 -16.367 76 1HB TYR 10 1HB TYR 10 41.863 21.019 -16.112 77 2HB TYR 10 2HB TYR 10 40.431 21.268 -15.170 78 HD1 TYR 10 HD1 TYR 10 40.086 19.905 -13.024 79 HD2 TYR 10 HD2 TYR 10 43.616 19.345 -15.438 80 HE1 TYR 10 HE1 TYR 10 41.155 18.677 -11.233 81 HE2 TYR 10 HE2 TYR 10 44.642 18.129 -13.627 82 HH TYR 10 HH TYR 10 42.950 17.595 -10.542 83 H THR 11 H THR 11 38.820 17.667 -16.671 84 HA THR 11 HA THR 11 36.161 18.938 -16.809 85 HB THR 11 HB THR 11 36.707 15.963 -16.298 86 HG1 THR 11 HG1 THR 11 36.613 17.368 -18.752 87 1HG2 THR 11 1HG2 THR 11 34.250 16.572 -16.274 88 2HG2 THR 11 2HG2 THR 11 34.418 17.273 -17.905 89 3HG2 THR 11 3HG2 THR 11 34.670 15.524 -17.656 90 H PHE 12 H PHE 12 35.331 19.969 -15.009 91 HA PHE 12 HA PHE 12 35.909 18.880 -12.206 92 1HB PHE 12 2HB PHE 12 34.754 21.536 -13.159 93 2HB PHE 12 1HB PHE 12 34.757 21.056 -11.488 94 HD1 PHE 12 HD1 PHE 12 36.898 20.936 -10.167 95 HD2 PHE 12 HD2 PHE 12 36.963 22.135 -14.308 96 HE1 PHE 12 HE1 PHE 12 39.125 21.839 -9.890 97 HE2 PHE 12 HE2 PHE 12 39.196 23.018 -13.986 98 HZ PHE 12 HZ PHE 12 40.300 22.883 -11.791 99 H ARG 13 H ARG 13 34.605 17.089 -12.265 100 HA ARG 13 HA ARG 13 31.608 17.361 -12.650 101 1HB ARG 13 2HB ARG 13 33.350 14.887 -12.033 102 2HB ARG 13 1HB ARG 13 31.589 14.832 -12.068 103 1HG ARG 13 1HG ARG 13 31.577 15.554 -14.470 104 2HG ARG 13 2HG ARG 13 33.342 15.583 -14.468 105 1HD ARG 13 1HD ARG 13 33.390 13.100 -13.967 106 2HD ARG 13 2HD ARG 13 31.615 13.071 -13.972 107 HE ARG 13 HE ARG 13 32.736 14.227 -16.475 108 1HH1 ARG 13 2HH2 ARG 13 31.834 11.063 -15.006 109 2HH1 ARG 13 1HH2 ARG 13 31.696 10.348 -16.691 110 1HH2 ARG 13 2HH1 ARG 13 32.537 13.274 -18.278 111 2HH2 ARG 13 1HH1 ARG 13 32.064 11.505 -18.393 112 H GLY 14 H GLY 14 30.344 17.625 -10.928 113 1HA GLY 14 2HA GLY 14 30.805 16.557 -8.205 114 2HA GLY 14 1HA GLY 14 31.188 18.277 -8.261 115 HA PRO 15 HA PRO 15 26.427 17.802 -8.096 116 1HB PRO 15 2HB PRO 15 25.606 17.738 -5.466 117 2HB PRO 15 1HB PRO 15 26.212 16.315 -6.337 118 1HG PRO 15 2HG PRO 15 27.737 18.097 -4.401 119 2HG PRO 15 1HG PRO 15 27.670 16.307 -4.429 120 1HD PRO 15 1HD PRO 15 29.729 17.827 -5.615 121 2HD PRO 15 2HD PRO 15 29.262 16.209 -6.203 122 H GLY 16 H GLY 16 24.932 19.403 -7.916 123 1HA GLY 16 1HA GLY 16 23.926 21.544 -7.527 124 2HA GLY 16 2HA GLY 16 25.167 21.862 -6.321 125 H CYS 17 H CYS 17 23.970 23.267 -8.916 126 HA CYS 17 HA CYS 17 26.201 23.620 -10.749 127 1HB CYS 17 1HB CYS 17 24.021 25.741 -10.758 128 2HB CYS 17 2HB CYS 17 24.877 24.974 -12.092 129 HA PRO 18 HA PRO 18 27.855 26.869 -7.786 130 1HB PRO 18 1HB PRO 18 30.503 26.447 -7.836 131 2HB PRO 18 2HB PRO 18 29.343 25.215 -7.266 132 1HG PRO 18 2HG PRO 18 30.795 25.342 -9.927 133 2HG PRO 18 1HG PRO 18 30.473 23.910 -8.912 134 1HD PRO 18 2HD PRO 18 28.893 24.825 -11.144 135 2HD PRO 18 1HD PRO 18 28.370 23.616 -9.954 136 H THR 19 H THR 19 29.855 27.077 -10.723 137 HA THR 19 HA THR 19 29.312 30.080 -10.844 138 HB THR 19 HB THR 19 31.375 29.941 -9.780 139 HG1 THR 19 HG1 THR 19 32.519 31.201 -11.236 140 1HG2 THR 19 1HG2 THR 19 32.693 28.512 -12.187 141 2HG2 THR 19 2HG2 THR 19 33.552 29.224 -10.795 142 3HG2 THR 19 3HG2 THR 19 32.500 27.802 -10.561 143 H VAL 20 H VAL 20 29.662 31.065 -12.809 144 HA VAL 20 HA VAL 20 29.385 29.438 -15.380 145 HB VAL 20 HB VAL 20 27.342 31.388 -14.603 146 1HG1 VAL 20 1HG2 VAL 20 25.913 30.728 -16.626 147 2HG1 VAL 20 2HG2 VAL 20 27.544 31.203 -17.111 148 3HG1 VAL 20 3HG2 VAL 20 27.125 29.485 -17.054 149 1HG2 VAL 20 1HG1 VAL 20 26.860 29.342 -13.223 150 2HG2 VAL 20 2HG1 VAL 20 25.499 29.639 -14.317 151 3HG2 VAL 20 3HG1 VAL 20 26.684 28.347 -14.677 152 H LYS 21 H LYS 21 31.273 30.686 -14.755 153 HA LYS 21 HA LYS 21 31.845 33.393 -15.807 154 1HB LYS 21 1HB LYS 21 34.144 33.048 -15.749 155 2HB LYS 21 2HB LYS 21 33.369 32.423 -14.311 156 1HG LYS 21 2HG LYS 21 33.712 30.033 -15.286 157 2HG LYS 21 1HG LYS 21 34.614 30.763 -16.616 158 1HD LYS 21 2HD LYS 21 36.219 31.785 -14.889 159 2HD LYS 21 1HD LYS 21 35.291 30.965 -13.632 160 1HE LYS 21 1HE LYS 21 37.159 29.568 -13.920 161 2HE LYS 21 2HE LYS 21 35.903 28.694 -14.784 162 1HZ LYS 21 1HZ LYS 21 37.971 28.786 -16.042 163 2HZ LYS 21 2HZ LYS 21 36.823 29.635 -16.873 164 3HZ LYS 21 3HZ LYS 21 37.993 30.438 -16.027 165 HA PRO 22 HA PRO 22 31.236 33.263 -20.038 166 1HB PRO 22 2HB PRO 22 33.545 35.093 -20.740 167 2HB PRO 22 1HB PRO 22 31.792 35.308 -20.960 168 1HG PRO 22 1HG PRO 22 33.018 36.618 -18.891 169 2HG PRO 22 2HG PRO 22 31.465 35.791 -18.562 170 1HD PRO 22 2HD PRO 22 34.286 34.658 -18.081 171 2HD PRO 22 1HD PRO 22 32.951 34.909 -16.926 172 H DAL 23 H ALA 23 31.487 31.485 -21.187 173 HA DAL 23 HA ALA 23 34.056 30.026 -21.443 174 1HB DAL 23 1HB ALA 23 34.244 31.443 -23.496 175 2HB DAL 23 2HB ALA 23 32.675 30.827 -24.081 176 3HB DAL 23 3HB ALA 23 34.062 29.718 -23.914 177 H ILE 24 H ILE 24 32.314 29.179 -19.840 178 HA ILE 24 HA ILE 24 31.808 26.570 -20.706 179 HB ILE 24 HB ILE 24 30.352 27.509 -18.272 180 1HG1 ILE 24 1HG1 ILE 24 33.330 26.770 -17.870 181 2HG1 ILE 24 2HG1 ILE 24 32.799 28.414 -18.108 182 1HG2 ILE 24 1HG2 ILE 24 30.077 25.067 -18.950 183 2HG2 ILE 24 2HG2 ILE 24 31.847 24.830 -18.831 184 3HG2 ILE 24 3HG2 ILE 24 30.857 25.172 -17.377 185 1HD1 ILE 24 1HD1 ILE 24 31.267 28.335 -16.180 186 2HD1 ILE 24 2HD1 ILE 24 32.969 27.936 -15.689 187 3HD1 ILE 24 3HD1 ILE 24 31.725 26.642 -15.885 188 H SER 25 H SER 25 30.080 25.429 -21.134 189 HA SER 25 HA SER 25 27.249 26.581 -21.365 190 1HB SER 25 1HB SER 25 28.292 26.331 -23.640 191 2HB SER 25 2HB SER 25 28.691 24.638 -23.288 192 HG SER 25 HG SER 25 26.722 24.869 -24.413 193 H LEU 26 H LEU 26 26.888 25.808 -19.246 194 HA LEU 26 HA LEU 26 27.983 23.307 -18.202 195 1HB LEU 26 1HB LEU 26 25.845 25.195 -17.022 196 2HB LEU 26 2HB LEU 26 26.293 23.705 -16.253 197 HG LEU 26 HG LEU 26 28.779 24.550 -16.206 198 1HD1 LEU 26 1HD1 LEU 26 27.377 27.320 -16.542 199 2HD1 LEU 26 2HD1 LEU 26 29.118 27.058 -16.200 200 3HD1 LEU 26 3HD1 LEU 26 28.425 26.571 -17.754 201 1HD2 LEU 26 1HD2 LEU 26 26.790 25.929 -14.339 202 2HD2 LEU 26 2HD2 LEU 26 28.542 25.679 -14.063 203 3HD2 LEU 26 3HD2 LEU 26 27.461 24.285 -14.179 204 H ARG 27 H ARG 27 26.833 21.522 -17.350 205 HA ARG 27 HA ARG 27 24.161 20.770 -18.603 206 1HB ARG 27 2HB ARG 27 26.667 18.987 -18.839 207 2HB ARG 27 1HB ARG 27 25.037 18.344 -18.925 208 1HG ARG 27 2HG ARG 27 24.502 19.758 -20.913 209 2HG ARG 27 1HG ARG 27 26.115 20.466 -20.865 210 1HD ARG 27 1HD ARG 27 27.138 18.184 -21.289 211 2HD ARG 27 2HD ARG 27 25.516 17.469 -21.337 212 HE ARG 27 HE ARG 27 25.397 19.575 -23.245 213 1HH1 ARG 27 2HH2 ARG 27 27.506 16.664 -22.996 214 2HH1 ARG 27 1HH2 ARG 27 27.690 16.671 -24.821 215 1HH2 ARG 27 2HH1 ARG 27 25.707 19.439 -25.265 216 2HH2 ARG 27 1HH1 ARG 27 26.750 18.120 -26.000 217 H CYS 28 H CYS 28 24.394 21.796 -16.316 218 HA CYS 28 HA CYS 28 24.776 20.420 -14.048 219 1HB CYS 28 1HB CYS 28 24.186 22.861 -14.225 220 2HB CYS 28 2HB CYS 28 22.471 22.388 -14.219 221 H GLU 29 H GLU 29 21.490 20.224 -15.559 222 HA GLU 29 HA GLU 29 20.676 18.121 -13.528 223 1HB GLU 29 2HB GLU 29 18.436 18.249 -14.297 224 2HB GLU 29 1HB GLU 29 19.038 19.827 -13.845 225 1HG GLU 29 2HG GLU 29 19.163 20.490 -16.287 226 2HG GLU 29 1HG GLU 29 18.553 18.894 -16.744 227 HE2 GLU 29 HE2 GLU 29 15.281 19.518 -16.029 Start of MODEL 13 1 1H SER 1 1H SER 1 21.723 17.498 -8.072 2 2H SER 1 2H SER 1 21.425 16.347 -9.220 3 3H SER 1 3H SER 1 20.426 17.656 -9.083 4 HA SER 1 HA SER 1 21.828 17.923 -11.009 5 1HB SER 1 1HB SER 1 22.485 19.810 -8.675 6 2HB SER 1 2HB SER 1 22.832 20.163 -10.377 7 HG SER 1 HG SER 1 20.842 21.002 -9.696 8 H LYS 2 H LYS 2 23.775 17.397 -11.897 9 HA LYS 2 HA LYS 2 26.267 17.016 -10.239 10 1HB LYS 2 2HB LYS 2 25.055 14.776 -10.475 11 2HB LYS 2 1HB LYS 2 25.141 14.942 -12.229 12 1HG LYS 2 1HG LYS 2 27.658 14.945 -12.076 13 2HG LYS 2 2HG LYS 2 27.546 14.795 -10.313 14 1HD LYS 2 2HD LYS 2 26.369 12.552 -10.594 15 2HD LYS 2 1HD LYS 2 26.490 12.709 -12.349 16 1HE LYS 2 2HE LYS 2 29.022 12.699 -12.177 17 2HE LYS 2 1HE LYS 2 28.899 12.541 -10.415 18 1HZ LYS 2 1HZ LYS 2 27.689 10.448 -10.748 19 2HZ LYS 2 2HZ LYS 2 29.166 10.388 -11.484 20 3HZ LYS 2 3HZ LYS 2 27.801 10.596 -12.390 21 H TYR 3 H TYR 3 26.930 18.903 -11.127 22 HA TYR 3 HA TYR 3 26.797 19.586 -14.008 23 1HB TYR 3 2HB TYR 3 27.724 21.704 -13.482 24 2HB TYR 3 1HB TYR 3 26.515 21.304 -12.311 25 HD1 TYR 3 HD1 TYR 3 27.098 21.244 -9.891 26 HD2 TYR 3 HD2 TYR 3 30.235 21.611 -12.810 27 HE1 TYR 3 HE1 TYR 3 28.702 21.738 -8.149 28 HE2 TYR 3 HE2 TYR 3 31.795 22.136 -11.060 29 HH TYR 3 HH TYR 3 30.799 22.230 -7.641 30 H GLU 4 H GLU 4 28.187 18.922 -15.512 31 HA GLU 4 HA GLU 4 31.104 18.199 -14.833 32 1HB GLU 4 1HB GLU 4 29.770 16.236 -15.486 33 2HB GLU 4 2HB GLU 4 29.245 17.020 -16.973 34 1HG GLU 4 1HG GLU 4 31.642 16.971 -17.789 35 2HG GLU 4 2HG GLU 4 32.138 16.142 -16.325 36 HE2 GLU 4 HE2 GLU 4 30.359 13.159 -17.150 37 H TYR 5 H TYR 5 32.378 19.747 -15.579 38 HA TYR 5 HA TYR 5 31.917 20.902 -18.370 39 1HB TYR 5 2HB TYR 5 32.570 23.103 -17.953 40 2HB TYR 5 1HB TYR 5 31.086 22.665 -17.135 41 HD1 TYR 5 HD1 TYR 5 34.489 24.019 -16.676 42 HD2 TYR 5 HD2 TYR 5 31.006 22.600 -14.597 43 HE1 TYR 5 HE1 TYR 5 35.216 25.145 -14.652 44 HE2 TYR 5 HE2 TYR 5 31.749 23.777 -12.600 45 HH TYR 5 HH TYR 5 34.772 25.627 -12.550 46 H THR 6 H THR 6 33.581 20.266 -19.534 47 HA THR 6 HA THR 6 36.193 19.646 -18.252 48 HB THR 6 HB THR 6 35.394 19.213 -21.200 49 HG1 THR 6 HG1 THR 6 34.696 17.183 -20.529 50 1HG2 THR 6 1HG2 THR 6 37.272 17.553 -19.400 51 2HG2 THR 6 2HG2 THR 6 37.805 18.661 -20.696 52 3HG2 THR 6 3HG2 THR 6 36.859 17.198 -21.102 53 H VAL 7 H VAL 7 37.620 21.164 -18.080 54 HA VAL 7 HA VAL 7 38.113 23.211 -20.333 55 HB VAL 7 HB VAL 7 38.881 23.469 -17.393 56 1HG1 VAL 7 1HG2 VAL 7 39.424 25.557 -19.616 57 2HG1 VAL 7 2HG2 VAL 7 40.635 24.509 -18.855 58 3HG1 VAL 7 3HG2 VAL 7 39.818 25.739 -17.878 59 1HG2 VAL 7 1HG1 VAL 7 36.872 25.238 -18.964 60 2HG2 VAL 7 2HG1 VAL 7 36.448 23.981 -17.787 61 3HG2 VAL 7 3HG1 VAL 7 37.317 25.424 -17.239 62 HA DPR 8 HA PRO 8 42.195 21.361 -20.861 63 1HB DPR 8 2HB PRO 8 42.130 21.780 -23.099 64 2HB DPR 8 1HB PRO 8 42.122 20.011 -23.269 65 1HG DPR 8 2HG PRO 8 40.157 21.410 -24.404 66 2HG DPR 8 1HG PRO 8 39.744 19.935 -23.456 67 1HD DPR 8 2HD PRO 8 39.454 22.859 -22.584 68 2HD DPR 8 1HD PRO 8 38.338 21.496 -22.290 69 H SER 9 H SER 9 43.241 19.523 -20.667 70 HA SER 9 HA SER 9 42.276 16.826 -20.028 71 1HB SER 9 1HB SER 9 44.710 18.352 -18.886 72 2HB SER 9 2HB SER 9 44.472 16.614 -18.742 73 HG SER 9 HG SER 9 44.397 16.488 -21.025 74 H TYR 10 H TYR 10 40.964 19.371 -18.278 75 HA TYR 10 HA TYR 10 41.171 17.927 -15.592 76 1HB TYR 10 2HB TYR 10 42.726 20.074 -15.979 77 2HB TYR 10 1HB TYR 10 41.244 20.978 -15.798 78 HD1 TYR 10 HD1 TYR 10 43.724 18.759 -14.093 79 HD2 TYR 10 HD2 TYR 10 40.112 21.041 -13.502 80 HE1 TYR 10 HE1 TYR 10 43.990 18.584 -11.709 81 HE2 TYR 10 HE2 TYR 10 40.416 20.843 -11.111 82 HH TYR 10 HH TYR 10 41.652 20.056 -9.456 83 H THR 11 H THR 11 39.315 17.127 -15.958 84 HA THR 11 HA THR 11 36.851 18.454 -16.813 85 HB THR 11 HB THR 11 37.001 15.683 -15.524 86 HG1 THR 11 HG1 THR 11 37.395 16.453 -18.220 87 1HG2 THR 11 1HG2 THR 11 35.141 15.043 -17.052 88 2HG2 THR 11 2HG2 THR 11 35.112 16.678 -17.759 89 3HG2 THR 11 3HG2 THR 11 34.626 16.439 -16.066 90 H PHE 12 H PHE 12 35.495 19.751 -15.554 91 HA PHE 12 HA PHE 12 35.747 19.609 -12.520 92 1HB PHE 12 2HB PHE 12 34.456 21.651 -14.380 93 2HB PHE 12 1HB PHE 12 34.269 21.698 -12.657 94 HD1 PHE 12 HD1 PHE 12 36.192 22.268 -11.147 95 HD2 PHE 12 HD2 PHE 12 36.730 22.216 -15.423 96 HE1 PHE 12 HE1 PHE 12 38.216 23.574 -10.919 97 HE2 PHE 12 HE2 PHE 12 38.754 23.526 -15.148 98 HZ PHE 12 HZ PHE 12 39.523 24.212 -12.916 99 H ARG 13 H ARG 13 34.725 17.552 -12.384 100 HA ARG 13 HA ARG 13 31.720 17.495 -12.770 101 1HB ARG 13 2HB ARG 13 33.619 15.278 -11.773 102 2HB ARG 13 1HB ARG 13 31.863 15.117 -11.790 103 1HG ARG 13 1HG ARG 13 31.834 15.434 -14.274 104 2HG ARG 13 2HG ARG 13 33.600 15.557 -14.274 105 1HD ARG 13 2HD ARG 13 33.676 13.158 -13.300 106 2HD ARG 13 1HD ARG 13 31.908 13.102 -13.481 107 HE ARG 13 HE ARG 13 33.246 13.853 -16.015 108 1HH1 ARG 13 1HH2 ARG 13 32.371 10.924 -14.109 109 2HH1 ARG 13 2HH2 ARG 13 32.446 9.929 -15.649 110 1HH2 ARG 13 2HH1 ARG 13 33.287 12.601 -17.636 111 2HH2 ARG 13 1HH1 ARG 13 32.924 10.808 -17.486 112 H GLY 14 H GLY 14 30.445 17.905 -11.051 113 1HA GLY 14 2HA GLY 14 31.178 17.469 -8.183 114 2HA GLY 14 1HA GLY 14 31.223 19.174 -8.634 115 HA PRO 15 HA PRO 15 26.615 17.899 -8.201 116 1HB PRO 15 2HB PRO 15 25.845 17.535 -5.583 117 2HB PRO 15 1HB PRO 15 26.627 16.273 -6.556 118 1HG PRO 15 1HG PRO 15 27.921 18.103 -4.501 119 2HG PRO 15 2HG PRO 15 28.098 16.327 -4.660 120 1HD PRO 15 1HD PRO 15 29.914 18.197 -5.738 121 2HD PRO 15 2HD PRO 15 29.665 16.576 -6.439 122 H GLY 16 H GLY 16 24.911 19.256 -7.895 123 1HA GLY 16 2HA GLY 16 23.632 21.218 -7.339 124 2HA GLY 16 1HA GLY 16 24.866 21.642 -6.162 125 H CYS 17 H CYS 17 23.442 22.830 -8.857 126 HA CYS 17 HA CYS 17 25.696 23.637 -10.537 127 1HB CYS 17 1HB CYS 17 23.012 25.094 -10.632 128 2HB CYS 17 2HB CYS 17 24.176 24.824 -11.928 129 HA PRO 18 HA PRO 18 26.309 27.242 -7.564 130 1HB PRO 18 2HB PRO 18 28.972 27.261 -7.223 131 2HB PRO 18 1HB PRO 18 27.955 25.874 -6.748 132 1HG PRO 18 2HG PRO 18 29.783 26.116 -9.156 133 2HG PRO 18 1HG PRO 18 29.463 24.689 -8.136 134 1HD PRO 18 1HD PRO 18 28.175 25.415 -10.643 135 2HD PRO 18 2HD PRO 18 27.709 24.070 -9.584 136 H THR 19 H THR 19 28.645 27.641 -10.207 137 HA THR 19 HA THR 19 27.634 30.482 -10.712 138 HB THR 19 HB THR 19 29.554 30.722 -9.321 139 HG1 THR 19 HG1 THR 19 30.625 32.126 -10.689 140 1HG2 THR 19 1HG2 THR 19 31.924 30.378 -10.051 141 2HG2 THR 19 2HG2 THR 19 31.116 28.797 -9.875 142 3HG2 THR 19 3HG2 THR 19 31.372 29.493 -11.498 143 H VAL 20 H VAL 20 28.695 31.325 -12.846 144 HA VAL 20 HA VAL 20 29.152 29.472 -14.933 145 HB VAL 20 HB VAL 20 27.727 30.226 -16.491 146 1HG1 VAL 20 1HG2 VAL 20 25.819 28.601 -16.240 147 2HG1 VAL 20 2HG2 VAL 20 27.284 27.975 -15.472 148 3HG1 VAL 20 3HG2 VAL 20 26.008 28.666 -14.463 149 1HG2 VAL 20 1HG1 VAL 20 25.576 31.302 -14.544 150 2HG2 VAL 20 2HG1 VAL 20 26.543 32.295 -15.652 151 3HG2 VAL 20 3HG1 VAL 20 25.364 31.155 -16.313 152 H LYS 21 H LYS 21 30.823 30.559 -14.442 153 HA LYS 21 HA LYS 21 31.485 33.400 -14.934 154 1HB LYS 21 2HB LYS 21 33.411 31.012 -15.107 155 2HB LYS 21 1HB LYS 21 33.957 32.667 -15.151 156 1HG LYS 21 1HG LYS 21 32.566 31.381 -12.731 157 2HG LYS 21 2HG LYS 21 34.305 31.407 -12.991 158 1HD LYS 21 2HD LYS 21 34.286 33.938 -12.935 159 2HD LYS 21 1HD LYS 21 32.544 33.906 -12.650 160 1HE LYS 21 1HE LYS 21 32.909 32.676 -10.466 161 2HE LYS 21 2HE LYS 21 34.661 32.697 -10.747 162 1HZ LYS 21 1HZ LYS 21 34.565 35.139 -10.767 163 2HZ LYS 21 2HZ LYS 21 32.934 35.118 -10.504 164 3HZ LYS 21 3HZ LYS 21 33.965 34.546 -9.346 165 HA PRO 22 HA PRO 22 31.162 33.819 -19.221 166 1HB PRO 22 2HB PRO 22 33.306 35.931 -19.452 167 2HB PRO 22 1HB PRO 22 31.553 36.026 -19.742 168 1HG PRO 22 1HG PRO 22 32.574 37.093 -17.433 169 2HG PRO 22 2HG PRO 22 31.074 36.121 -17.336 170 1HD PRO 22 2HD PRO 22 33.945 35.113 -16.849 171 2HD PRO 22 1HD PRO 22 32.541 35.100 -15.752 172 H DAL 23 H ALA 23 31.706 32.139 -20.450 173 HA DAL 23 HA ALA 23 34.364 31.002 -20.715 174 1HB DAL 23 1HB ALA 23 33.325 32.169 -23.371 175 2HB DAL 23 2HB ALA 23 34.764 32.723 -22.473 176 3HB DAL 23 3HB ALA 23 34.727 31.084 -23.176 177 H ILE 24 H ILE 24 32.839 29.585 -19.608 178 HA ILE 24 HA ILE 24 32.120 27.393 -21.256 179 HB ILE 24 HB ILE 24 31.038 27.458 -18.475 180 1HG1 ILE 24 1HG1 ILE 24 33.990 26.503 -18.632 181 2HG1 ILE 24 2HG1 ILE 24 33.660 28.197 -18.471 182 1HG2 ILE 24 1HG2 ILE 24 30.601 25.398 -19.916 183 2HG2 ILE 24 2HG2 ILE 24 31.538 24.971 -18.482 184 3HG2 ILE 24 3HG2 ILE 24 32.360 25.131 -20.064 185 1HD1 ILE 24 1HD1 ILE 24 33.963 27.196 -16.262 186 2HD1 ILE 24 2HD1 ILE 24 32.318 27.926 -16.470 187 3HD1 ILE 24 3HD1 ILE 24 32.509 26.157 -16.551 188 H SER 25 H SER 25 30.241 26.522 -21.778 189 HA SER 25 HA SER 25 27.546 27.952 -21.371 190 1HB SER 25 2HB SER 25 28.326 27.846 -23.750 191 2HB SER 25 1HB SER 25 28.541 26.089 -23.623 192 HG SER 25 HG SER 25 26.308 25.944 -23.089 193 H LEU 26 H LEU 26 27.235 26.995 -19.343 194 HA LEU 26 HA LEU 26 28.081 24.304 -18.631 195 1HB LEU 26 2HB LEU 26 26.706 26.529 -17.141 196 2HB LEU 26 1HB LEU 26 26.152 24.999 -16.616 197 HG LEU 26 HG LEU 26 27.736 25.744 -15.088 198 1HD1 LEU 26 1HD1 LEU 26 29.237 23.927 -14.738 199 2HD1 LEU 26 2HD1 LEU 26 27.705 23.310 -15.389 200 3HD1 LEU 26 3HD1 LEU 26 29.124 23.427 -16.455 201 1HD2 LEU 26 1HD2 LEU 26 29.991 25.878 -17.140 202 2HD2 LEU 26 2HD2 LEU 26 29.118 27.296 -16.544 203 3HD2 LEU 26 3HD2 LEU 26 30.076 26.311 -15.420 204 H ARG 27 H ARG 27 26.860 22.461 -18.052 205 HA ARG 27 HA ARG 27 24.046 22.161 -19.158 206 1HB ARG 27 1HB ARG 27 26.406 20.438 -20.150 207 2HB ARG 27 2HB ARG 27 24.744 19.887 -20.221 208 1HG ARG 27 2HG ARG 27 24.104 21.831 -21.681 209 2HG ARG 27 1HG ARG 27 25.760 22.407 -21.614 210 1HD ARG 27 1HD ARG 27 25.648 21.332 -23.704 211 2HD ARG 27 2HD ARG 27 26.499 20.150 -22.719 212 HE ARG 27 HE ARG 27 23.747 19.387 -22.546 213 1HH1 ARG 27 2HH2 ARG 27 25.982 19.784 -25.343 214 2HH1 ARG 27 1HH2 ARG 27 24.998 18.545 -26.273 215 1HH2 ARG 27 2HH1 ARG 27 22.762 18.028 -23.720 216 2HH2 ARG 27 1HH1 ARG 27 23.320 17.632 -25.422 217 H CYS 28 H CYS 28 24.552 22.510 -16.720 218 HA CYS 28 HA CYS 28 24.989 20.455 -14.983 219 1HB CYS 28 1HB CYS 28 24.773 22.904 -14.407 220 2HB CYS 28 2HB CYS 28 23.009 22.756 -14.510 221 H GLU 29 H GLU 29 23.831 18.799 -14.058 222 HA GLU 29 HA GLU 29 22.323 17.101 -13.721 223 1HB GLU 29 2HB GLU 29 20.884 19.057 -12.727 224 2HB GLU 29 1HB GLU 29 19.933 18.965 -14.197 225 1HG GLU 29 1HG GLU 29 19.341 16.551 -13.615 226 2HG GLU 29 2HG GLU 29 20.303 16.687 -12.137 227 HE2 GLU 29 HE2 GLU 29 19.669 17.893 -10.581 Start of MODEL 14 1 1H SER 1 1H SER 1 22.996 21.150 -10.148 2 2H SER 1 2H SER 1 21.347 21.236 -10.174 3 3H SER 1 3H SER 1 22.151 20.453 -11.385 4 HA SER 1 HA SER 1 22.055 19.644 -8.544 5 1HB SER 1 1HB SER 1 19.873 19.376 -9.692 6 2HB SER 1 2HB SER 1 20.641 18.389 -10.949 7 HG SER 1 HG SER 1 21.289 16.948 -9.288 8 H LYS 2 H LYS 2 23.298 18.629 -11.739 9 HA LYS 2 HA LYS 2 25.632 17.314 -10.371 10 1HB LYS 2 2HB LYS 2 25.629 15.201 -11.458 11 2HB LYS 2 1HB LYS 2 24.241 15.397 -10.415 12 1HG LYS 2 1HG LYS 2 22.765 15.719 -12.489 13 2HG LYS 2 2HG LYS 2 24.187 15.470 -13.474 14 1HD LYS 2 2HD LYS 2 23.229 13.391 -13.591 15 2HD LYS 2 1HD LYS 2 24.462 13.113 -12.381 16 1HE LYS 2 2HE LYS 2 22.651 13.313 -10.571 17 2HE LYS 2 1HE LYS 2 21.443 13.560 -11.843 18 1HZ LYS 2 1HZ LYS 2 21.569 11.231 -11.177 19 2HZ LYS 2 2HZ LYS 2 22.043 11.371 -12.754 20 3HZ LYS 2 3HZ LYS 2 23.171 11.142 -11.569 21 H TYR 3 H TYR 3 26.764 18.991 -11.170 22 HA TYR 3 HA TYR 3 26.769 19.782 -14.035 23 1HB TYR 3 2HB TYR 3 28.286 21.529 -13.458 24 2HB TYR 3 1HB TYR 3 26.951 21.485 -12.352 25 HD1 TYR 3 HD1 TYR 3 27.420 21.393 -9.907 26 HD2 TYR 3 HD2 TYR 3 30.620 20.618 -12.676 27 HE1 TYR 3 HE1 TYR 3 29.044 21.511 -8.109 28 HE2 TYR 3 HE2 TYR 3 32.205 20.748 -10.861 29 HH TYR 3 HH TYR 3 31.163 21.382 -7.520 30 H GLU 4 H GLU 4 28.350 19.523 -15.538 31 HA GLU 4 HA GLU 4 31.004 18.184 -14.905 32 1HB GLU 4 2HB GLU 4 29.580 16.332 -15.683 33 2HB GLU 4 1HB GLU 4 29.109 17.214 -17.130 34 1HG GLU 4 1HG GLU 4 31.470 17.111 -17.974 35 2HG GLU 4 2HG GLU 4 31.984 16.245 -16.542 36 HE2 GLU 4 HE2 GLU 4 30.572 14.301 -19.623 37 H TYR 5 H TYR 5 32.091 20.042 -15.228 38 HA TYR 5 HA TYR 5 31.637 21.616 -17.837 39 1HB TYR 5 1HB TYR 5 32.165 23.657 -16.973 40 2HB TYR 5 2HB TYR 5 30.801 22.949 -16.134 41 HD1 TYR 5 HD1 TYR 5 30.885 22.609 -13.661 42 HD2 TYR 5 HD2 TYR 5 34.298 24.198 -15.744 43 HE1 TYR 5 HE1 TYR 5 31.836 23.394 -11.564 44 HE2 TYR 5 HE2 TYR 5 35.199 24.978 -13.635 45 HH TYR 5 HH TYR 5 34.927 25.121 -11.454 46 H THR 6 H THR 6 33.157 21.036 -19.150 47 HA THR 6 HA THR 6 35.918 20.336 -18.211 48 HB THR 6 HB THR 6 34.738 20.056 -21.035 49 HG1 THR 6 HG1 THR 6 33.400 19.070 -19.499 50 1HG2 THR 6 1HG2 THR 6 36.215 18.045 -21.220 51 2HG2 THR 6 2HG2 THR 6 36.850 18.346 -19.581 52 3HG2 THR 6 3HG2 THR 6 37.191 19.510 -20.892 53 H VAL 7 H VAL 7 36.866 22.180 -17.789 54 HA VAL 7 HA VAL 7 37.175 24.332 -19.959 55 HB VAL 7 HB VAL 7 37.641 24.514 -16.941 56 1HG1 VAL 7 1HG2 VAL 7 38.181 26.848 -18.902 57 2HG1 VAL 7 2HG2 VAL 7 38.306 26.910 -17.116 58 3HG1 VAL 7 3HG2 VAL 7 39.412 25.894 -18.055 59 1HG2 VAL 7 1HG1 VAL 7 35.811 26.206 -16.865 60 2HG2 VAL 7 2HG1 VAL 7 35.220 24.751 -17.688 61 3HG2 VAL 7 3HG1 VAL 7 35.644 26.173 -18.647 62 HA DPR 8 HA PRO 8 41.626 23.096 -20.123 63 1HB DPR 8 2HB PRO 8 41.917 24.282 -22.088 64 2HB DPR 8 1HB PRO 8 42.048 22.663 -22.814 65 1HG DPR 8 1HG PRO 8 40.223 24.364 -23.791 66 2HG DPR 8 2HG PRO 8 39.752 22.657 -23.473 67 1HD DPR 8 1HD PRO 8 39.099 25.120 -21.783 68 2HD DPR 8 2HD PRO 8 38.072 23.703 -22.130 69 H SER 9 H SER 9 42.771 21.215 -20.592 70 HA SER 9 HA SER 9 41.260 18.563 -20.628 71 1HB SER 9 2HB SER 9 44.224 19.172 -20.087 72 2HB SER 9 1HB SER 9 43.512 17.558 -20.173 73 HG SER 9 HG SER 9 42.788 18.062 -22.285 74 H TYR 10 H TYR 10 40.092 20.217 -18.677 75 HA TYR 10 HA TYR 10 40.650 18.622 -16.170 76 1HB TYR 10 1HB TYR 10 41.559 21.350 -16.398 77 2HB TYR 10 2HB TYR 10 40.064 21.521 -15.549 78 HD1 TYR 10 HD1 TYR 10 39.796 20.487 -13.222 79 HD2 TYR 10 HD2 TYR 10 43.510 20.116 -15.382 80 HE1 TYR 10 HE1 TYR 10 40.938 19.795 -11.198 81 HE2 TYR 10 HE2 TYR 10 44.605 19.429 -13.338 82 HH TYR 10 HH TYR 10 44.399 19.013 -11.178 83 H THR 11 H THR 11 38.921 17.599 -16.460 84 HA THR 11 HA THR 11 36.203 18.666 -17.102 85 HB THR 11 HB THR 11 36.921 15.813 -16.264 86 HG1 THR 11 HG1 THR 11 38.181 16.561 -17.991 87 1HG2 THR 11 1HG2 THR 11 35.035 15.102 -17.741 88 2HG2 THR 11 2HG2 THR 11 34.662 16.800 -18.123 89 3HG2 THR 11 3HG2 THR 11 34.425 16.194 -16.464 90 H PHE 12 H PHE 12 35.247 19.915 -15.462 91 HA PHE 12 HA PHE 12 35.789 19.194 -12.556 92 1HB PHE 12 1HB PHE 12 34.435 21.600 -13.816 93 2HB PHE 12 2HB PHE 12 34.518 21.347 -12.096 94 HD1 PHE 12 HD1 PHE 12 36.717 21.522 -10.846 95 HD2 PHE 12 HD2 PHE 12 36.534 22.278 -15.088 96 HE1 PHE 12 HE1 PHE 12 38.872 22.629 -10.766 97 HE2 PHE 12 HE2 PHE 12 38.689 23.377 -14.957 98 HZ PHE 12 HZ PHE 12 39.877 23.564 -12.811 99 H ARG 13 H ARG 13 34.590 17.346 -12.339 100 HA ARG 13 HA ARG 13 31.593 17.415 -12.783 101 1HB ARG 13 1HB ARG 13 33.472 15.082 -12.038 102 2HB ARG 13 2HB ARG 13 31.715 14.919 -12.072 103 1HG ARG 13 2HG ARG 13 31.667 15.519 -14.488 104 2HG ARG 13 1HG ARG 13 33.430 15.658 -14.499 105 1HD ARG 13 2HD ARG 13 33.586 13.188 -13.859 106 2HD ARG 13 1HD ARG 13 31.812 13.093 -13.916 107 HE ARG 13 HE ARG 13 32.664 14.190 -16.448 108 1HH1 ARG 13 2HH2 ARG 13 33.018 11.001 -14.807 109 2HH1 ARG 13 1HH2 ARG 13 33.148 10.197 -16.451 110 1HH2 ARG 13 1HH1 ARG 13 32.827 13.136 -18.197 111 2HH2 ARG 13 2HH1 ARG 13 33.048 11.315 -18.216 112 H GLY 14 H GLY 14 30.230 17.552 -11.083 113 1HA GLY 14 1HA GLY 14 30.684 16.587 -8.366 114 2HA GLY 14 2HA GLY 14 31.063 18.307 -8.392 115 HA PRO 15 HA PRO 15 26.261 17.923 -8.285 116 1HB PRO 15 2HB PRO 15 25.416 17.546 -5.695 117 2HB PRO 15 1HB PRO 15 25.898 16.222 -6.774 118 1HG PRO 15 2HG PRO 15 27.561 17.544 -4.597 119 2HG PRO 15 1HG PRO 15 27.329 15.792 -4.894 120 1HD PRO 15 2HD PRO 15 29.534 17.264 -5.843 121 2HD PRO 15 1HD PRO 15 28.912 15.817 -6.680 122 H GLY 16 H GLY 16 24.900 19.625 -7.834 123 1HA GLY 16 1HA GLY 16 24.119 21.785 -7.087 124 2HA GLY 16 2HA GLY 16 25.447 21.829 -5.937 125 H CYS 17 H CYS 17 24.373 22.912 -9.023 126 HA CYS 17 HA CYS 17 26.913 23.530 -10.262 127 1HB CYS 17 2HB CYS 17 24.219 24.723 -11.001 128 2HB CYS 17 1HB CYS 17 25.660 24.595 -12.029 129 HA PRO 18 HA PRO 18 27.152 27.528 -7.851 130 1HB PRO 18 2HB PRO 18 29.679 27.533 -6.986 131 2HB PRO 18 1HB PRO 18 28.524 26.256 -6.531 132 1HG PRO 18 2HG PRO 18 30.776 26.096 -8.566 133 2HG PRO 18 1HG PRO 18 30.241 24.860 -7.397 134 1HD PRO 18 1HD PRO 18 29.426 25.132 -10.174 135 2HD PRO 18 2HD PRO 18 28.712 24.020 -8.989 136 H THR 19 H THR 19 30.087 27.546 -9.916 137 HA THR 19 HA THR 19 29.656 30.448 -10.544 138 HB THR 19 HB THR 19 31.970 30.197 -11.583 139 HG1 THR 19 HG1 THR 19 31.859 27.971 -11.898 140 1HG2 THR 19 1HG2 THR 19 31.917 29.477 -8.619 141 2HG2 THR 19 2HG2 THR 19 33.307 30.134 -9.532 142 3HG2 THR 19 3HG2 THR 19 31.838 31.123 -9.306 143 H VAL 20 H VAL 20 29.635 31.253 -12.640 144 HA VAL 20 HA VAL 20 29.513 29.507 -15.039 145 HB VAL 20 HB VAL 20 27.166 31.195 -14.565 146 1HG1 VAL 20 1HG2 VAL 20 27.636 30.819 -17.014 147 2HG1 VAL 20 2HG2 VAL 20 26.038 30.172 -16.619 148 3HG1 VAL 20 3HG2 VAL 20 27.433 29.068 -16.811 149 1HG2 VAL 20 1HG1 VAL 20 26.939 28.117 -14.362 150 2HG2 VAL 20 2HG1 VAL 20 25.550 29.243 -14.259 151 3HG2 VAL 20 3HG1 VAL 20 26.816 29.265 -13.020 152 H LYS 21 H LYS 21 31.157 30.834 -14.724 153 HA LYS 21 HA LYS 21 31.459 33.711 -15.507 154 1HB LYS 21 1HB LYS 21 33.580 31.465 -15.541 155 2HB LYS 21 2HB LYS 21 33.971 33.122 -15.964 156 1HG LYS 21 1HG LYS 21 33.392 33.988 -13.739 157 2HG LYS 21 2HG LYS 21 32.827 32.405 -13.207 158 1HD LYS 21 1HD LYS 21 35.085 31.446 -13.471 159 2HD LYS 21 2HD LYS 21 35.731 32.976 -14.066 160 1HE LYS 21 1HE LYS 21 34.500 32.660 -11.233 161 2HE LYS 21 2HE LYS 21 36.186 32.330 -11.600 162 1HZ LYS 21 1HZ LYS 21 35.914 34.573 -10.781 163 2HZ LYS 21 2HZ LYS 21 36.468 34.625 -12.337 164 3HZ LYS 21 3HZ LYS 21 34.886 34.972 -12.011 165 HA PRO 22 HA PRO 22 30.695 33.793 -19.735 166 1HB PRO 22 2HB PRO 22 32.763 35.922 -20.360 167 2HB PRO 22 1HB PRO 22 30.990 35.961 -20.497 168 1HG PRO 22 2HG PRO 22 32.177 37.235 -18.383 169 2HG PRO 22 1HG PRO 22 30.726 36.238 -18.064 170 1HD PRO 22 2HD PRO 22 33.661 35.353 -17.773 171 2HD PRO 22 1HD PRO 22 32.362 35.392 -16.552 172 H DAL 23 H ALA 23 31.086 32.444 -21.367 173 HA DAL 23 HA ALA 23 33.895 31.274 -21.763 174 1HB DAL 23 1HB ALA 23 31.921 31.899 -24.033 175 2HB DAL 23 2HB ALA 23 33.481 31.049 -24.200 176 3HB DAL 23 3HB ALA 23 33.448 32.759 -23.694 177 H ILE 24 H ILE 24 32.838 29.990 -19.922 178 HA ILE 24 HA ILE 24 32.810 27.629 -20.077 179 HB ILE 24 HB ILE 24 32.024 29.395 -18.204 180 1HG1 ILE 24 2HG1 ILE 24 31.605 26.475 -17.837 181 2HG1 ILE 24 1HG1 ILE 24 33.129 27.362 -17.818 182 1HG2 ILE 24 1HG2 ILE 24 29.644 29.781 -18.856 183 2HG2 ILE 24 2HG2 ILE 24 29.735 29.066 -17.222 184 3HG2 ILE 24 3HG2 ILE 24 29.287 28.053 -18.611 185 1HD1 ILE 24 1HD1 ILE 24 31.026 27.919 -15.683 186 2HD1 ILE 24 2HD1 ILE 24 32.733 28.402 -15.688 187 3HD1 ILE 24 3HD1 ILE 24 32.279 26.671 -15.506 188 H SER 25 H SER 25 31.512 25.911 -19.545 189 HA SER 25 HA SER 25 29.195 25.213 -21.411 190 1HB SER 25 1HB SER 25 31.217 24.592 -22.730 191 2HB SER 25 2HB SER 25 31.790 23.562 -21.406 192 HG SER 25 HG SER 25 29.314 23.310 -22.790 193 H LEU 26 H LEU 26 27.763 24.394 -20.033 194 HA LEU 26 HA LEU 26 28.597 22.570 -17.707 195 1HB LEU 26 2HB LEU 26 26.554 24.908 -17.722 196 2HB LEU 26 1HB LEU 26 26.334 23.536 -16.682 197 HG LEU 26 HG LEU 26 28.651 23.968 -15.648 198 1HD1 LEU 26 1HD2 LEU 26 29.639 26.230 -15.791 199 2HD1 LEU 26 2HD2 LEU 26 28.432 26.762 -16.996 200 3HD1 LEU 26 3HD2 LEU 26 29.630 25.515 -17.402 201 1HD2 LEU 26 1HD1 LEU 26 26.550 24.553 -14.464 202 2HD2 LEU 26 2HD1 LEU 26 27.786 25.769 -14.105 203 3HD2 LEU 26 3HD1 LEU 26 26.488 26.132 -15.281 204 H ARG 27 H ARG 27 27.072 21.058 -17.097 205 HA ARG 27 HA ARG 27 24.711 20.392 -18.839 206 1HB ARG 27 1HB ARG 27 26.985 18.354 -18.394 207 2HB ARG 27 2HB ARG 27 25.333 17.865 -18.728 208 1HG ARG 27 1HG ARG 27 25.345 19.070 -20.921 209 2HG ARG 27 2HG ARG 27 26.995 19.615 -20.629 210 1HD ARG 27 1HD ARG 27 27.797 17.210 -20.609 211 2HD ARG 27 2HD ARG 27 26.137 16.657 -20.900 212 HE ARG 27 HE ARG 27 26.629 18.517 -22.998 213 1HH1 ARG 27 1HH1 ARG 27 28.270 15.453 -22.049 214 2HH1 ARG 27 2HH1 ARG 27 28.783 15.216 -23.795 215 1HH2 ARG 27 1HH2 ARG 27 27.281 18.101 -24.895 216 2HH2 ARG 27 2HH2 ARG 27 28.264 16.599 -25.275 217 H CYS 28 H CYS 28 24.547 21.654 -16.705 218 HA CYS 28 HA CYS 28 24.533 20.597 -14.239 219 1HB CYS 28 1HB CYS 28 24.190 23.005 -14.772 220 2HB CYS 28 2HB CYS 28 22.489 22.676 -15.168 221 H GLU 29 H GLU 29 21.510 20.307 -16.215 222 HA GLU 29 HA GLU 29 20.576 18.070 -14.342 223 1HB GLU 29 1HB GLU 29 19.382 20.383 -13.894 224 2HB GLU 29 2HB GLU 29 18.716 20.224 -15.503 225 1HG GLU 29 1HG GLU 29 16.987 19.517 -14.065 226 2HG GLU 29 2HG GLU 29 17.615 18.003 -14.708 227 HE2 GLU 29 HE2 GLU 29 17.795 18.978 -10.797 Start of MODEL 15 1 1H SER 1 1H SER 1 22.841 20.665 -10.190 2 2H SER 1 2H SER 1 21.921 19.758 -11.219 3 3H SER 1 3H SER 1 21.204 20.585 -9.982 4 HA SER 1 HA SER 1 22.299 19.257 -8.330 5 1HB SER 1 1HB SER 1 20.987 17.204 -8.626 6 2HB SER 1 2HB SER 1 20.041 18.625 -9.099 7 HG SER 1 HG SER 1 19.926 16.935 -10.614 8 H LYS 2 H LYS 2 23.385 18.219 -11.555 9 HA LYS 2 HA LYS 2 25.844 17.041 -10.295 10 1HB LYS 2 2HB LYS 2 25.923 14.933 -11.366 11 2HB LYS 2 1HB LYS 2 24.576 15.056 -10.253 12 1HG LYS 2 1HG LYS 2 22.970 15.231 -12.211 13 2HG LYS 2 2HG LYS 2 24.326 15.102 -13.329 14 1HD LYS 2 1HD LYS 2 24.868 12.791 -12.373 15 2HD LYS 2 2HD LYS 2 23.492 12.951 -11.293 16 1HE LYS 2 1HE LYS 2 22.665 11.598 -13.005 17 2HE LYS 2 2HE LYS 2 21.964 13.157 -13.405 18 1HZ LYS 2 1HZ LYS 2 24.390 11.952 -14.676 19 2HZ LYS 2 2HZ LYS 2 22.886 12.053 -15.353 20 3HZ LYS 2 3HZ LYS 2 23.762 13.427 -15.076 21 H TYR 3 H TYR 3 26.849 18.767 -11.159 22 HA TYR 3 HA TYR 3 26.701 19.510 -14.039 23 1HB TYR 3 1HB TYR 3 28.149 21.342 -13.547 24 2HB TYR 3 2HB TYR 3 26.851 21.255 -12.398 25 HD1 TYR 3 HD1 TYR 3 27.405 21.284 -9.977 26 HD2 TYR 3 HD2 TYR 3 30.548 20.553 -12.823 27 HE1 TYR 3 HE1 TYR 3 29.078 21.480 -8.228 28 HE2 TYR 3 HE2 TYR 3 32.181 20.770 -11.058 29 HH TYR 3 HH TYR 3 32.540 21.124 -8.901 30 H GLU 4 H GLU 4 28.277 19.355 -15.581 31 HA GLU 4 HA GLU 4 30.988 18.099 -15.010 32 1HB GLU 4 2HB GLU 4 29.572 16.221 -15.796 33 2HB GLU 4 1HB GLU 4 29.097 17.116 -17.233 34 1HG GLU 4 1HG GLU 4 31.482 17.058 -18.050 35 2HG GLU 4 2HG GLU 4 31.975 16.165 -16.626 36 HE2 GLU 4 HE2 GLU 4 31.171 15.961 -19.626 37 H TYR 5 H TYR 5 32.061 19.965 -15.373 38 HA TYR 5 HA TYR 5 31.523 21.519 -17.975 39 1HB TYR 5 1HB TYR 5 31.971 23.586 -17.120 40 2HB TYR 5 2HB TYR 5 30.644 22.830 -16.264 41 HD1 TYR 5 HD1 TYR 5 34.132 24.148 -15.929 42 HD2 TYR 5 HD2 TYR 5 30.742 22.577 -13.790 43 HE1 TYR 5 HE1 TYR 5 35.037 24.977 -13.839 44 HE2 TYR 5 HE2 TYR 5 31.698 23.414 -11.715 45 HH TYR 5 HH TYR 5 33.358 24.490 -10.754 46 H THR 6 H THR 6 33.083 21.092 -19.307 47 HA THR 6 HA THR 6 35.841 20.422 -18.370 48 HB THR 6 HB THR 6 34.763 20.327 -21.249 49 HG1 THR 6 HG1 THR 6 34.567 18.340 -19.244 50 1HG2 THR 6 1HG2 THR 6 36.271 18.349 -21.516 51 2HG2 THR 6 2HG2 THR 6 36.830 18.532 -19.831 52 3HG2 THR 6 3HG2 THR 6 37.219 19.792 -21.036 53 H VAL 7 H VAL 7 36.965 22.134 -17.928 54 HA VAL 7 HA VAL 7 37.304 24.372 -20.006 55 HB VAL 7 HB VAL 7 37.342 24.662 -16.962 56 1HG1 VAL 7 1HG2 VAL 7 37.871 26.975 -18.957 57 2HG1 VAL 7 2HG2 VAL 7 39.087 26.180 -17.942 58 3HG1 VAL 7 3HG2 VAL 7 37.793 27.112 -17.172 59 1HG2 VAL 7 1HG1 VAL 7 35.396 26.039 -18.952 60 2HG2 VAL 7 2HG1 VAL 7 35.366 26.186 -17.167 61 3HG2 VAL 7 3HG1 VAL 7 35.012 24.635 -17.944 62 HA DPR 8 HA PRO 8 41.804 23.470 -19.382 63 1HB DPR 8 2HB PRO 8 42.359 24.813 -21.187 64 2HB DPR 8 1HB PRO 8 42.736 23.260 -21.968 65 1HG DPR 8 1HG PRO 8 41.000 24.913 -23.170 66 2HG DPR 8 2HG PRO 8 40.605 23.164 -23.046 67 1HD DPR 8 1HD PRO 8 39.476 25.456 -21.372 68 2HD DPR 8 2HD PRO 8 38.639 24.002 -21.979 69 H SER 9 H SER 9 43.161 21.688 -19.784 70 HA SER 9 HA SER 9 41.829 18.974 -20.219 71 1HB SER 9 2HB SER 9 44.204 19.308 -20.882 72 2HB SER 9 1HB SER 9 44.639 19.669 -19.196 73 HG SER 9 HG SER 9 44.963 17.496 -19.756 74 H TYR 10 H TYR 10 40.277 20.395 -18.399 75 HA TYR 10 HA TYR 10 40.501 18.671 -15.941 76 1HB TYR 10 2HB TYR 10 41.095 21.614 -15.887 77 2HB TYR 10 1HB TYR 10 39.680 21.303 -14.954 78 HD1 TYR 10 HD1 TYR 10 43.337 20.626 -15.161 79 HD2 TYR 10 HD2 TYR 10 39.761 19.880 -12.869 80 HE1 TYR 10 HE1 TYR 10 44.663 19.835 -13.296 81 HE2 TYR 10 HE2 TYR 10 41.125 19.099 -11.033 82 HH TYR 10 HH TYR 10 44.673 19.031 -11.242 83 H THR 11 H THR 11 38.837 17.648 -16.494 84 HA THR 11 HA THR 11 36.159 18.782 -17.276 85 HB THR 11 HB THR 11 36.836 15.881 -16.573 86 HG1 THR 11 HG1 THR 11 37.115 15.647 -18.799 87 1HG2 THR 11 1HG2 THR 11 34.993 15.271 -18.151 88 2HG2 THR 11 2HG2 THR 11 34.351 16.286 -16.825 89 3HG2 THR 11 3HG2 THR 11 34.640 16.993 -18.436 90 H PHE 12 H PHE 12 35.222 19.989 -15.596 91 HA PHE 12 HA PHE 12 35.876 19.254 -12.731 92 1HB PHE 12 2HB PHE 12 34.404 21.637 -13.899 93 2HB PHE 12 1HB PHE 12 34.596 21.381 -12.190 94 HD1 PHE 12 HD1 PHE 12 36.941 21.398 -11.106 95 HD2 PHE 12 HD2 PHE 12 36.302 22.644 -15.185 96 HE1 PHE 12 HE1 PHE 12 39.005 22.669 -11.067 97 HE2 PHE 12 HE2 PHE 12 38.363 23.918 -15.088 98 HZ PHE 12 HZ PHE 12 39.731 23.940 -13.046 99 H ARG 13 H ARG 13 34.682 17.389 -12.463 100 HA ARG 13 HA ARG 13 31.674 17.429 -12.815 101 1HB ARG 13 1HB ARG 13 33.597 15.115 -12.127 102 2HB ARG 13 2HB ARG 13 31.840 14.936 -12.112 103 1HG ARG 13 1HG ARG 13 31.718 15.541 -14.524 104 2HG ARG 13 2HG ARG 13 33.479 15.698 -14.585 105 1HD ARG 13 2HD ARG 13 33.683 13.231 -13.962 106 2HD ARG 13 1HD ARG 13 31.910 13.113 -13.957 107 HE ARG 13 HE ARG 13 32.492 14.190 -16.509 108 1HH1 ARG 13 2HH1 ARG 13 33.584 11.151 -14.912 109 2HH1 ARG 13 1HH1 ARG 13 33.773 10.379 -16.565 110 1HH2 ARG 13 1HH2 ARG 13 32.757 13.180 -18.271 111 2HH2 ARG 13 2HH2 ARG 13 33.340 11.441 -18.314 112 H GLY 14 H GLY 14 30.363 17.579 -11.094 113 1HA GLY 14 2HA GLY 14 30.903 16.651 -8.366 114 2HA GLY 14 1HA GLY 14 31.217 18.383 -8.440 115 HA PRO 15 HA PRO 15 26.439 17.783 -8.235 116 1HB PRO 15 2HB PRO 15 25.651 17.505 -5.613 117 2HB PRO 15 1HB PRO 15 26.187 16.154 -6.631 118 1HG PRO 15 1HG PRO 15 27.812 17.678 -4.562 119 2HG PRO 15 2HG PRO 15 27.669 15.902 -4.757 120 1HD PRO 15 1HD PRO 15 29.780 17.423 -5.825 121 2HD PRO 15 2HD PRO 15 29.212 15.910 -6.580 122 H GLY 16 H GLY 16 25.000 19.432 -7.873 123 1HA GLY 16 2HA GLY 16 24.104 21.587 -7.281 124 2HA GLY 16 1HA GLY 16 25.383 21.736 -6.086 125 H CYS 17 H CYS 17 24.334 22.783 -9.168 126 HA CYS 17 HA CYS 17 26.872 23.425 -10.407 127 1HB CYS 17 2HB CYS 17 24.178 24.631 -11.150 128 2HB CYS 17 1HB CYS 17 25.619 24.498 -12.174 129 HA PRO 18 HA PRO 18 27.062 27.406 -7.958 130 1HB PRO 18 1HB PRO 18 29.583 27.426 -7.081 131 2HB PRO 18 2HB PRO 18 28.442 26.127 -6.653 132 1HG PRO 18 1HG PRO 18 30.704 26.031 -8.683 133 2HG PRO 18 2HG PRO 18 30.184 24.769 -7.534 134 1HD PRO 18 2HD PRO 18 29.372 25.068 -10.308 135 2HD PRO 18 1HD PRO 18 28.668 23.935 -9.137 136 H THR 19 H THR 19 30.008 27.497 -10.004 137 HA THR 19 HA THR 19 29.503 30.402 -10.607 138 HB THR 19 HB THR 19 31.891 30.257 -11.491 139 HG1 THR 19 HG1 THR 19 31.900 28.026 -11.809 140 1HG2 THR 19 1HG2 THR 19 33.085 30.250 -9.354 141 2HG2 THR 19 2HG2 THR 19 31.666 29.530 -8.537 142 3HG2 THR 19 3HG2 THR 19 31.561 31.171 -9.232 143 H VAL 20 H VAL 20 29.533 31.215 -12.678 144 HA VAL 20 HA VAL 20 29.553 29.449 -15.105 145 HB VAL 20 HB VAL 20 27.185 31.100 -14.618 146 1HG1 VAL 20 1HG1 VAL 20 27.650 30.779 -17.079 147 2HG1 VAL 20 2HG1 VAL 20 27.483 29.021 -16.911 148 3HG1 VAL 20 3HG1 VAL 20 26.067 30.092 -16.695 149 1HG2 VAL 20 1HG2 VAL 20 26.862 29.133 -13.117 150 2HG2 VAL 20 2HG2 VAL 20 25.602 29.095 -14.363 151 3HG2 VAL 20 3HG2 VAL 20 27.026 28.012 -14.477 152 H LYS 21 H LYS 21 31.184 30.866 -14.648 153 HA LYS 21 HA LYS 21 31.445 33.702 -15.534 154 1HB LYS 21 2HB LYS 21 33.627 31.520 -15.404 155 2HB LYS 21 1HB LYS 21 33.990 33.175 -15.856 156 1HG LYS 21 2HG LYS 21 33.270 34.085 -13.694 157 2HG LYS 21 1HG LYS 21 32.734 32.495 -13.142 158 1HD LYS 21 1HD LYS 21 35.065 31.608 -13.286 159 2HD LYS 21 2HD LYS 21 35.649 33.177 -13.871 160 1HE LYS 21 2HE LYS 21 34.949 34.251 -11.682 161 2HE LYS 21 1HE LYS 21 34.371 32.678 -11.098 162 1HZ LYS 21 1HZ LYS 21 36.639 31.814 -11.363 163 2HZ LYS 21 2HZ LYS 21 36.631 33.124 -10.356 164 3HZ LYS 21 3HZ LYS 21 37.178 33.278 -11.908 165 HA PRO 22 HA PRO 22 30.876 33.695 -19.780 166 1HB PRO 22 1HB PRO 22 32.964 35.818 -20.364 167 2HB PRO 22 2HB PRO 22 31.200 35.842 -20.595 168 1HG PRO 22 1HG PRO 22 32.261 37.177 -18.451 169 2HG PRO 22 2HG PRO 22 30.807 36.170 -18.182 170 1HD PRO 22 1HD PRO 22 33.732 35.330 -17.721 171 2HD PRO 22 2HD PRO 22 32.371 35.380 -16.571 172 H DAL 23 H ALA 23 31.330 32.388 -21.434 173 HA DAL 23 HA ALA 23 34.128 31.150 -21.668 174 1HB DAL 23 1HB ALA 23 33.818 32.649 -23.619 175 2HB DAL 23 2HB ALA 23 33.840 30.941 -24.128 176 3HB DAL 23 3HB ALA 23 32.292 31.823 -24.039 177 H ILE 24 H ILE 24 32.848 29.940 -19.871 178 HA ILE 24 HA ILE 24 32.875 27.548 -20.097 179 HB ILE 24 HB ILE 24 32.052 29.293 -18.203 180 1HG1 ILE 24 2HG1 ILE 24 31.616 26.367 -17.894 181 2HG1 ILE 24 1HG1 ILE 24 33.150 27.242 -17.838 182 1HG2 ILE 24 1HG2 ILE 24 29.687 29.687 -18.893 183 2HG2 ILE 24 2HG2 ILE 24 29.745 28.939 -17.272 184 3HG2 ILE 24 3HG2 ILE 24 29.328 27.953 -18.690 185 1HD1 ILE 24 1HD1 ILE 24 32.292 26.534 -15.548 186 2HD1 ILE 24 2HD1 ILE 24 31.013 27.755 -15.725 187 3HD1 ILE 24 3HD1 ILE 24 32.709 28.277 -15.705 188 H SER 25 H SER 25 31.476 25.845 -19.595 189 HA SER 25 HA SER 25 29.224 25.238 -21.559 190 1HB SER 25 1HB SER 25 31.263 24.608 -22.844 191 2HB SER 25 2HB SER 25 31.782 23.532 -21.535 192 HG SER 25 HG SER 25 29.338 23.368 -22.989 193 H LEU 26 H LEU 26 27.742 24.458 -20.209 194 HA LEU 26 HA LEU 26 28.468 22.515 -17.944 195 1HB LEU 26 2HB LEU 26 26.539 24.948 -17.886 196 2HB LEU 26 1HB LEU 26 26.237 23.549 -16.905 197 HG LEU 26 HG LEU 26 28.562 23.825 -15.831 198 1HD1 LEU 26 1HD1 LEU 26 28.490 26.687 -17.044 199 2HD1 LEU 26 2HD1 LEU 26 29.621 25.401 -17.515 200 3HD1 LEU 26 3HD1 LEU 26 29.664 26.026 -15.868 201 1HD2 LEU 26 1HD2 LEU 26 27.758 25.599 -14.220 202 2HD2 LEU 26 2HD2 LEU 26 26.488 26.060 -15.393 203 3HD2 LEU 26 3HD2 LEU 26 26.478 24.450 -14.641 204 H ARG 27 H ARG 27 26.883 21.045 -17.412 205 HA ARG 27 HA ARG 27 24.493 20.576 -19.182 206 1HB ARG 27 1HB ARG 27 26.667 18.410 -18.826 207 2HB ARG 27 2HB ARG 27 24.997 18.013 -19.181 208 1HG ARG 27 2HG ARG 27 25.082 19.333 -21.320 209 2HG ARG 27 1HG ARG 27 26.751 19.752 -20.976 210 1HD ARG 27 2HD ARG 27 26.946 18.000 -22.536 211 2HD ARG 27 1HD ARG 27 27.311 17.192 -21.017 212 HE ARG 27 HE ARG 27 24.438 16.927 -21.632 213 1HH1 ARG 27 2HH1 ARG 27 27.566 15.521 -22.734 214 2HH1 ARG 27 1HH1 ARG 27 26.667 14.024 -23.298 215 1HH2 ARG 27 2HH2 ARG 27 23.591 15.191 -22.315 216 2HH2 ARG 27 1HH2 ARG 27 24.594 13.857 -23.078 217 H CYS 28 H CYS 28 24.411 21.756 -16.969 218 HA CYS 28 HA CYS 28 24.204 20.443 -14.582 219 1HB CYS 28 2HB CYS 28 24.319 22.927 -14.886 220 2HB CYS 28 1HB CYS 28 22.613 22.943 -15.377 221 H GLU 29 H GLU 29 22.697 19.193 -13.587 222 HA GLU 29 HA GLU 29 20.836 17.894 -13.064 223 1HB GLU 29 1HB GLU 29 19.076 20.009 -14.429 224 2HB GLU 29 2HB GLU 29 18.440 18.616 -13.562 225 1HG GLU 29 1HG GLU 29 19.460 19.407 -11.423 226 2HG GLU 29 2HG GLU 29 20.133 20.817 -12.252 227 HE2 GLU 29 HE2 GLU 29 17.145 22.520 -12.592 Start of MODEL 16 1 1H SER 1 1H SER 1 22.803 20.943 -10.254 2 2H SER 1 2H SER 1 21.152 20.874 -10.235 3 3H SER 1 3H SER 1 21.994 20.166 -11.467 4 HA SER 1 HA SER 1 22.050 19.363 -8.625 5 1HB SER 1 2HB SER 1 20.752 17.379 -9.270 6 2HB SER 1 1HB SER 1 19.880 18.867 -9.674 7 HG SER 1 HG SER 1 21.487 17.317 -11.437 8 H LYS 2 H LYS 2 23.328 18.477 -11.843 9 HA LYS 2 HA LYS 2 25.780 17.366 -10.517 10 1HB LYS 2 1HB LYS 2 25.946 15.247 -11.595 11 2HB LYS 2 2HB LYS 2 24.572 15.329 -10.518 12 1HG LYS 2 1HG LYS 2 23.021 15.471 -12.479 13 2HG LYS 2 2HG LYS 2 24.370 15.396 -13.596 14 1HD LYS 2 2HD LYS 2 23.761 13.146 -11.563 15 2HD LYS 2 1HD LYS 2 22.961 13.241 -13.105 16 1HE LYS 2 1HE LYS 2 26.024 13.022 -12.884 17 2HE LYS 2 2HE LYS 2 24.955 11.620 -12.906 18 1HZ LYS 2 1HZ LYS 2 24.142 12.310 -15.095 19 2HZ LYS 2 2HZ LYS 2 25.781 12.106 -15.116 20 3HZ LYS 2 3HZ LYS 2 25.139 13.628 -15.096 21 H TYR 3 H TYR 3 26.763 19.107 -11.354 22 HA TYR 3 HA TYR 3 26.660 19.829 -14.252 23 1HB TYR 3 1HB TYR 3 27.778 21.841 -13.698 24 2HB TYR 3 2HB TYR 3 26.586 21.569 -12.472 25 HD1 TYR 3 HD1 TYR 3 30.268 21.532 -13.180 26 HD2 TYR 3 HD2 TYR 3 27.298 21.188 -10.085 27 HE1 TYR 3 HE1 TYR 3 31.977 21.721 -11.508 28 HE2 TYR 3 HE2 TYR 3 29.037 21.307 -8.432 29 HH TYR 3 HH TYR 3 32.462 21.716 -9.329 30 H GLU 4 H GLU 4 28.373 19.836 -15.696 31 HA GLU 4 HA GLU 4 31.053 18.556 -14.959 32 1HB GLU 4 1HB GLU 4 29.700 16.805 -16.067 33 2HB GLU 4 2HB GLU 4 29.370 17.853 -17.440 34 1HG GLU 4 1HG GLU 4 31.810 17.806 -18.049 35 2HG GLU 4 2HG GLU 4 32.153 16.749 -16.693 36 HE2 GLU 4 HE2 GLU 4 31.831 16.819 -19.715 37 H TYR 5 H TYR 5 32.467 20.144 -15.320 38 HA TYR 5 HA TYR 5 32.191 21.875 -17.842 39 1HB TYR 5 1HB TYR 5 32.903 23.858 -16.980 40 2HB TYR 5 2HB TYR 5 31.457 23.293 -16.223 41 HD1 TYR 5 HD1 TYR 5 31.278 23.394 -13.778 42 HD2 TYR 5 HD2 TYR 5 35.134 23.885 -15.629 43 HE1 TYR 5 HE1 TYR 5 32.198 24.209 -11.692 44 HE2 TYR 5 HE2 TYR 5 36.002 24.727 -13.531 45 HH TYR 5 HH TYR 5 33.973 24.982 -10.635 46 H THR 6 H THR 6 33.702 21.205 -19.116 47 HA THR 6 HA THR 6 36.390 20.312 -18.117 48 HB THR 6 HB THR 6 35.300 20.201 -20.990 49 HG1 THR 6 HG1 THR 6 33.838 19.248 -19.549 50 1HG2 THR 6 1HG2 THR 6 37.705 19.496 -20.773 51 2HG2 THR 6 2HG2 THR 6 37.239 18.312 -19.519 52 3HG2 THR 6 3HG2 THR 6 36.654 18.107 -21.192 53 H VAL 7 H VAL 7 37.380 22.115 -17.581 54 HA VAL 7 HA VAL 7 37.908 24.294 -19.681 55 HB VAL 7 HB VAL 7 38.189 24.396 -16.635 56 1HG1 VAL 7 1HG1 VAL 7 38.983 26.757 -16.706 57 2HG1 VAL 7 2HG1 VAL 7 40.098 25.706 -17.594 58 3HG1 VAL 7 3HG1 VAL 7 38.977 26.740 -18.497 59 1HG2 VAL 7 1HG2 VAL 7 36.399 26.192 -18.430 60 2HG2 VAL 7 2HG2 VAL 7 35.835 24.776 -17.540 61 3HG2 VAL 7 3HG2 VAL 7 36.444 26.177 -16.641 62 HA DPR 8 HA PRO 8 42.297 22.824 -19.602 63 1HB DPR 8 2HB PRO 8 42.785 24.086 -21.483 64 2HB DPR 8 1HB PRO 8 42.874 22.497 -22.278 65 1HG DPR 8 2HG PRO 8 41.218 24.348 -23.288 66 2HG DPR 8 1HG PRO 8 40.633 22.659 -23.089 67 1HD DPR 8 2HD PRO 8 39.996 25.075 -21.330 68 2HD DPR 8 1HD PRO 8 38.926 23.729 -21.805 69 H SER 9 H SER 9 43.358 20.891 -20.115 70 HA SER 9 HA SER 9 41.677 18.354 -20.367 71 1HB SER 9 1HB SER 9 44.645 18.730 -19.661 72 2HB SER 9 2HB SER 9 43.831 17.175 -19.862 73 HG SER 9 HG SER 9 43.977 19.241 -21.808 74 H TYR 10 H TYR 10 40.512 19.972 -18.402 75 HA TYR 10 HA TYR 10 40.858 18.249 -15.942 76 1HB TYR 10 2HB TYR 10 41.923 20.929 -16.017 77 2HB TYR 10 1HB TYR 10 40.402 21.150 -15.228 78 HD1 TYR 10 HD1 TYR 10 39.972 20.045 -12.959 79 HD2 TYR 10 HD2 TYR 10 43.755 19.547 -14.968 80 HE1 TYR 10 HE1 TYR 10 40.981 19.213 -10.917 81 HE2 TYR 10 HE2 TYR 10 44.716 18.721 -12.908 82 HH TYR 10 HH TYR 10 44.388 18.237 -10.778 83 H THR 11 H THR 11 39.092 17.337 -16.356 84 HA THR 11 HA THR 11 36.467 18.577 -17.067 85 HB THR 11 HB THR 11 36.980 15.659 -16.309 86 HG1 THR 11 HG1 THR 11 37.281 15.369 -18.525 87 1HG2 THR 11 1HG2 THR 11 34.521 16.216 -16.615 88 2HG2 THR 11 2HG2 THR 11 34.881 16.836 -18.244 89 3HG2 THR 11 3HG2 THR 11 35.125 15.111 -17.884 90 H PHE 12 H PHE 12 35.558 19.840 -15.416 91 HA PHE 12 HA PHE 12 35.875 18.963 -12.522 92 1HB PHE 12 2HB PHE 12 34.730 21.491 -13.736 93 2HB PHE 12 1HB PHE 12 34.719 21.167 -12.028 94 HD1 PHE 12 HD1 PHE 12 36.929 22.098 -14.881 95 HD2 PHE 12 HD2 PHE 12 36.860 21.157 -10.673 96 HE1 PHE 12 HE1 PHE 12 39.130 23.066 -14.600 97 HE2 PHE 12 HE2 PHE 12 39.065 22.136 -10.442 98 HZ PHE 12 HZ PHE 12 40.220 23.096 -12.394 99 H ARG 13 H ARG 13 34.576 17.133 -12.586 100 HA ARG 13 HA ARG 13 31.588 17.462 -12.992 101 1HB ARG 13 1HB ARG 13 33.248 14.928 -12.377 102 2HB ARG 13 2HB ARG 13 31.486 14.938 -12.439 103 1HG ARG 13 1HG ARG 13 31.547 15.671 -14.838 104 2HG ARG 13 2HG ARG 13 33.312 15.627 -14.801 105 1HD ARG 13 2HD ARG 13 33.194 13.120 -14.275 106 2HD ARG 13 1HD ARG 13 31.424 13.219 -14.399 107 HE ARG 13 HE ARG 13 32.441 14.330 -16.843 108 1HH1 ARG 13 2HH1 ARG 13 32.590 11.061 -15.336 109 2HH1 ARG 13 1HH1 ARG 13 32.742 10.323 -17.009 110 1HH2 ARG 13 1HH2 ARG 13 32.618 13.347 -18.631 111 2HH2 ARG 13 2HH2 ARG 13 32.756 11.520 -18.724 112 H GLY 14 H GLY 14 30.300 17.648 -11.242 113 1HA GLY 14 2HA GLY 14 30.756 16.516 -8.570 114 2HA GLY 14 1HA GLY 14 31.227 18.215 -8.555 115 HA PRO 15 HA PRO 15 26.417 18.033 -8.462 116 1HB PRO 15 2HB PRO 15 25.504 17.540 -5.909 117 2HB PRO 15 1HB PRO 15 25.963 16.263 -7.053 118 1HG PRO 15 2HG PRO 15 27.628 17.411 -4.782 119 2HG PRO 15 1HG PRO 15 27.344 15.685 -5.173 120 1HD PRO 15 2HD PRO 15 29.616 17.120 -6.006 121 2HD PRO 15 1HD PRO 15 28.954 15.750 -6.937 122 H GLY 16 H GLY 16 25.124 19.737 -7.992 123 1HA GLY 16 2HA GLY 16 24.359 21.865 -7.127 124 2HA GLY 16 1HA GLY 16 25.671 21.838 -5.960 125 H CYS 17 H CYS 17 24.637 23.145 -8.951 126 HA CYS 17 HA CYS 17 27.132 23.737 -10.234 127 1HB CYS 17 2HB CYS 17 24.544 25.258 -10.693 128 2HB CYS 17 1HB CYS 17 25.886 25.021 -11.826 129 HA PRO 18 HA PRO 18 27.762 27.401 -7.361 130 1HB PRO 18 1HB PRO 18 30.387 27.347 -6.841 131 2HB PRO 18 2HB PRO 18 29.298 26.014 -6.374 132 1HG PRO 18 2HG PRO 18 31.205 26.121 -8.749 133 2HG PRO 18 1HG PRO 18 30.930 24.770 -7.615 134 1HD PRO 18 2HD PRO 18 29.662 25.111 -10.162 135 2HD PRO 18 1HD PRO 18 29.070 24.040 -8.875 136 H THR 19 H THR 19 30.511 27.784 -9.635 137 HA THR 19 HA THR 19 29.619 30.585 -10.296 138 HB THR 19 HB THR 19 31.832 30.600 -11.572 139 HG1 THR 19 HG1 THR 19 32.247 28.205 -10.148 140 1HG2 THR 19 1HG2 THR 19 33.347 30.905 -9.673 141 2HG2 THR 19 2HG2 THR 19 32.167 30.124 -8.578 142 3HG2 THR 19 3HG2 THR 19 31.768 31.677 -9.362 143 H VAL 20 H VAL 20 29.156 31.202 -12.353 144 HA VAL 20 HA VAL 20 28.784 29.151 -14.590 145 HB VAL 20 HB VAL 20 26.599 30.906 -13.685 146 1HG1 VAL 20 1HG1 VAL 20 24.999 29.708 -15.304 147 2HG1 VAL 20 2HG1 VAL 20 26.337 28.624 -15.791 148 3HG1 VAL 20 3HG1 VAL 20 26.412 30.356 -16.146 149 1HG2 VAL 20 1HG2 VAL 20 25.185 28.932 -12.841 150 2HG2 VAL 20 2HG2 VAL 20 26.517 27.814 -13.267 151 3HG2 VAL 20 3HG2 VAL 20 26.741 29.030 -12.000 152 H LYS 21 H LYS 21 30.526 30.741 -14.462 153 HA LYS 21 HA LYS 21 30.632 33.386 -15.429 154 1HB LYS 21 2HB LYS 21 32.751 31.215 -15.989 155 2HB LYS 21 1HB LYS 21 33.038 32.933 -16.214 156 1HG LYS 21 1HG LYS 21 32.690 33.396 -13.818 157 2HG LYS 21 2HG LYS 21 32.309 31.716 -13.487 158 1HD LYS 21 1HD LYS 21 35.000 32.642 -14.598 159 2HD LYS 21 2HD LYS 21 34.603 32.598 -12.884 160 1HE LYS 21 2HE LYS 21 34.573 30.060 -14.624 161 2HE LYS 21 1HE LYS 21 36.031 30.649 -13.828 162 1HZ LYS 21 1HZ LYS 21 34.924 28.990 -12.479 163 2HZ LYS 21 2HZ LYS 21 34.909 30.435 -11.679 164 3HZ LYS 21 3HZ LYS 21 33.533 29.879 -12.405 165 HA PRO 22 HA PRO 22 29.282 33.594 -19.542 166 1HB PRO 22 2HB PRO 22 31.050 35.895 -20.305 167 2HB PRO 22 1HB PRO 22 29.281 35.804 -20.137 168 1HG PRO 22 2HG PRO 22 30.736 37.056 -18.179 169 2HG PRO 22 1HG PRO 22 29.417 35.948 -17.695 170 1HD PRO 22 2HD PRO 22 32.407 35.236 -17.938 171 2HD PRO 22 1HD PRO 22 31.334 35.132 -16.520 172 H DAL 23 H ALA 23 29.937 31.661 -20.334 173 HA DAL 23 HA ALA 23 32.414 31.446 -22.113 174 1HB DAL 23 1HB ALA 23 29.585 30.577 -22.953 175 2HB DAL 23 2HB ALA 23 31.067 30.436 -23.935 176 3HB DAL 23 3HB ALA 23 30.421 32.043 -23.528 177 H ILE 24 H ILE 24 30.311 29.551 -19.943 178 HA ILE 24 HA ILE 24 32.002 27.118 -20.465 179 HB ILE 24 HB ILE 24 29.876 27.374 -18.339 180 1HG1 ILE 24 2HG1 ILE 24 32.928 27.643 -17.761 181 2HG1 ILE 24 1HG1 ILE 24 31.883 29.026 -17.965 182 1HG2 ILE 24 1HG2 ILE 24 32.112 25.287 -18.657 183 2HG2 ILE 24 2HG2 ILE 24 30.359 25.033 -18.906 184 3HG2 ILE 24 3HG2 ILE 24 30.977 25.354 -17.279 185 1HD1 ILE 24 1HD1 ILE 24 32.195 28.603 -15.571 186 2HD1 ILE 24 2HD1 ILE 24 31.534 26.945 -15.777 187 3HD1 ILE 24 3HD1 ILE 24 30.461 28.341 -16.038 188 H SER 25 H SER 25 31.109 25.394 -21.144 189 HA SER 25 HA SER 25 28.311 25.184 -22.424 190 1HB SER 25 2HB SER 25 30.233 24.830 -23.999 191 2HB SER 25 1HB SER 25 30.901 23.580 -22.931 192 HG SER 25 HG SER 25 28.929 22.431 -23.187 193 H LEU 26 H LEU 26 27.670 25.170 -20.186 194 HA LEU 26 HA LEU 26 28.745 23.173 -18.258 195 1HB LEU 26 2HB LEU 26 28.280 25.649 -17.805 196 2HB LEU 26 1HB LEU 26 26.576 25.262 -17.907 197 HG LEU 26 HG LEU 26 26.927 23.785 -15.738 198 1HD1 LEU 26 1HD2 LEU 26 29.346 23.376 -15.924 199 2HD1 LEU 26 2HD2 LEU 26 29.710 25.085 -15.556 200 3HD1 LEU 26 3HD2 LEU 26 28.919 24.052 -14.344 201 1HD2 LEU 26 1HD1 LEU 26 27.680 26.787 -15.525 202 2HD2 LEU 26 2HD1 LEU 26 26.989 25.801 -14.209 203 3HD2 LEU 26 3HD1 LEU 26 26.023 26.167 -15.649 204 H ARG 27 H ARG 27 27.537 21.646 -17.168 205 HA ARG 27 HA ARG 27 24.958 20.641 -18.521 206 1HB ARG 27 2HB ARG 27 27.435 18.940 -17.817 207 2HB ARG 27 1HB ARG 27 25.848 18.235 -18.039 208 1HG ARG 27 2HG ARG 27 25.733 19.083 -20.400 209 2HG ARG 27 1HG ARG 27 27.317 19.810 -20.200 210 1HD ARG 27 2HD ARG 27 27.779 17.825 -21.374 211 2HD ARG 27 1HD ARG 27 28.265 17.416 -19.734 212 HE ARG 27 HE ARG 27 25.513 16.553 -20.032 213 1HH1 ARG 27 1HH1 ARG 27 28.649 15.604 -21.528 214 2HH1 ARG 27 2HH1 ARG 27 27.966 13.930 -21.841 215 1HH2 ARG 27 1HH2 ARG 27 24.907 14.642 -20.454 216 2HH2 ARG 27 2HH2 ARG 27 26.014 13.433 -21.279 217 H CYS 28 H CYS 28 24.991 22.224 -16.504 218 HA CYS 28 HA CYS 28 24.666 21.356 -13.966 219 1HB CYS 28 2HB CYS 28 24.535 23.737 -14.644 220 2HB CYS 28 1HB CYS 28 22.860 23.497 -15.201 221 H GLU 29 H GLU 29 21.818 21.142 -16.198 222 HA GLU 29 HA GLU 29 20.581 19.063 -14.323 223 1HB GLU 29 1HB GLU 29 19.508 21.459 -14.091 224 2HB GLU 29 2HB GLU 29 18.970 21.276 -15.755 225 1HG GLU 29 2HG GLU 29 17.613 19.233 -15.027 226 2HG GLU 29 1HG GLU 29 18.174 19.478 -13.367 227 HE2 GLU 29 HE2 GLU 29 15.204 21.626 -14.968 Start of MODEL 17 1 1H SER 1 1H SER 1 20.924 20.343 -10.279 2 2H SER 1 2H SER 1 22.563 20.505 -10.151 3 3H SER 1 3H SER 1 21.908 19.742 -11.462 4 HA SER 1 HA SER 1 21.770 18.811 -8.663 5 1HB SER 1 1HB SER 1 20.652 16.790 -9.501 6 2HB SER 1 2HB SER 1 19.730 18.245 -9.915 7 HG SER 1 HG SER 1 19.973 16.818 -11.667 8 H LYS 2 H LYS 2 23.373 18.152 -11.792 9 HA LYS 2 HA LYS 2 25.822 17.259 -10.358 10 1HB LYS 2 2HB LYS 2 24.397 15.199 -12.155 11 2HB LYS 2 1HB LYS 2 26.119 15.121 -11.794 12 1HG LYS 2 2HG LYS 2 25.648 14.909 -9.344 13 2HG LYS 2 1HG LYS 2 23.914 14.997 -9.658 14 1HD LYS 2 1HD LYS 2 24.053 12.870 -11.044 15 2HD LYS 2 2HD LYS 2 25.790 12.780 -10.733 16 1HE LYS 2 1HE LYS 2 25.336 12.545 -8.249 17 2HE LYS 2 2HE LYS 2 23.592 12.635 -8.562 18 1HZ LYS 2 1HZ LYS 2 25.426 10.561 -9.669 19 2HZ LYS 2 2HZ LYS 2 23.802 10.644 -9.960 20 3HZ LYS 2 3HZ LYS 2 24.353 10.342 -8.432 21 H TYR 3 H TYR 3 26.810 18.863 -11.315 22 HA TYR 3 HA TYR 3 26.517 19.594 -14.204 23 1HB TYR 3 1HB TYR 3 27.722 21.583 -13.721 24 2HB TYR 3 2HB TYR 3 26.567 21.339 -12.455 25 HD1 TYR 3 HD1 TYR 3 30.234 21.229 -13.282 26 HD2 TYR 3 HD2 TYR 3 27.352 21.054 -10.085 27 HE1 TYR 3 HE1 TYR 3 31.997 21.417 -11.669 28 HE2 TYR 3 HE2 TYR 3 29.149 21.222 -8.490 29 HH TYR 3 HH TYR 3 31.337 21.406 -8.162 30 H GLU 4 H GLU 4 28.158 19.634 -15.736 31 HA GLU 4 HA GLU 4 30.869 18.332 -15.168 32 1HB GLU 4 2HB GLU 4 29.410 16.612 -16.263 33 2HB GLU 4 1HB GLU 4 29.076 17.716 -17.590 34 1HG GLU 4 1HG GLU 4 31.560 17.643 -18.187 35 2HG GLU 4 2HG GLU 4 31.816 16.447 -16.930 36 HE2 GLU 4 HE2 GLU 4 30.221 14.704 -17.010 37 H TYR 5 H TYR 5 32.077 20.143 -15.336 38 HA TYR 5 HA TYR 5 31.709 21.945 -17.808 39 1HB TYR 5 2HB TYR 5 32.379 23.877 -16.841 40 2HB TYR 5 1HB TYR 5 30.933 23.255 -16.073 41 HD1 TYR 5 HD1 TYR 5 30.843 23.389 -13.635 42 HD2 TYR 5 HD2 TYR 5 34.648 23.836 -15.596 43 HE1 TYR 5 HE1 TYR 5 31.839 24.197 -11.574 44 HE2 TYR 5 HE2 TYR 5 35.593 24.658 -13.522 45 HH TYR 5 HH TYR 5 35.250 25.152 -11.404 46 H THR 6 H THR 6 33.280 21.567 -19.155 47 HA THR 6 HA THR 6 35.953 20.587 -18.225 48 HB THR 6 HB THR 6 34.962 20.851 -21.127 49 HG1 THR 6 HG1 THR 6 34.553 18.698 -19.338 50 1HG2 THR 6 1HG2 THR 6 36.336 18.804 -21.545 51 2HG2 THR 6 2HG2 THR 6 36.844 18.781 -19.834 52 3HG2 THR 6 3HG2 THR 6 37.364 20.121 -20.895 53 H VAL 7 H VAL 7 37.201 22.158 -17.609 54 HA VAL 7 HA VAL 7 37.748 24.537 -19.470 55 HB VAL 7 HB VAL 7 37.662 24.593 -16.413 56 1HG1 VAL 7 1HG1 VAL 7 38.439 27.012 -18.189 57 2HG1 VAL 7 2HG1 VAL 7 38.282 27.013 -16.404 58 3HG1 VAL 7 3HG1 VAL 7 39.549 26.058 -17.189 59 1HG2 VAL 7 1HG2 VAL 7 35.387 24.802 -17.494 60 2HG2 VAL 7 2HG2 VAL 7 35.911 26.249 -18.369 61 3HG2 VAL 7 3HG2 VAL 7 35.804 26.261 -16.581 62 HA DPR 8 HA PRO 8 42.157 23.286 -18.750 63 1HB DPR 8 2HB PRO 8 42.892 24.796 -20.351 64 2HB DPR 8 1HB PRO 8 43.193 23.324 -21.304 65 1HG DPR 8 1HG PRO 8 41.638 25.242 -22.358 66 2HG DPR 8 2HG PRO 8 41.115 23.526 -22.469 67 1HD DPR 8 1HD PRO 8 40.073 25.676 -20.567 68 2HD DPR 8 2HD PRO 8 39.166 24.373 -21.380 69 H SER 9 H SER 9 43.415 21.463 -19.357 70 HA SER 9 HA SER 9 41.878 18.940 -20.144 71 1HB SER 9 2HB SER 9 44.278 19.161 -20.762 72 2HB SER 9 1HB SER 9 44.725 19.275 -19.045 73 HG SER 9 HG SER 9 43.744 17.232 -18.746 74 H TYR 10 H TYR 10 40.408 20.227 -18.179 75 HA TYR 10 HA TYR 10 40.486 18.232 -15.932 76 1HB TYR 10 2HB TYR 10 41.337 21.082 -15.532 77 2HB TYR 10 1HB TYR 10 39.893 20.794 -14.636 78 HD1 TYR 10 HD1 TYR 10 43.476 19.821 -14.931 79 HD2 TYR 10 HD2 TYR 10 39.829 19.133 -12.735 80 HE1 TYR 10 HE1 TYR 10 44.711 18.703 -13.174 81 HE2 TYR 10 HE2 TYR 10 41.103 18.025 -11.006 82 HH TYR 10 HH TYR 10 44.633 17.667 -11.228 83 H THR 11 H THR 11 38.733 17.430 -16.563 84 HA THR 11 HA THR 11 36.182 18.879 -17.223 85 HB THR 11 HB THR 11 36.573 15.872 -16.802 86 HG1 THR 11 HG1 THR 11 37.985 16.729 -18.352 87 1HG2 THR 11 1HG2 THR 11 34.520 17.366 -18.557 88 2HG2 THR 11 2HG2 THR 11 34.706 15.599 -18.448 89 3HG2 THR 11 3HG2 THR 11 34.142 16.531 -17.028 90 H PHE 12 H PHE 12 35.295 19.980 -15.447 91 HA PHE 12 HA PHE 12 35.911 18.948 -12.661 92 1HB PHE 12 1HB PHE 12 34.631 21.534 -13.578 93 2HB PHE 12 2HB PHE 12 34.846 21.110 -11.907 94 HD1 PHE 12 HD1 PHE 12 37.206 20.871 -10.901 95 HD2 PHE 12 HD2 PHE 12 36.583 22.457 -14.861 96 HE1 PHE 12 HE1 PHE 12 39.372 21.957 -10.832 97 HE2 PHE 12 HE2 PHE 12 38.748 23.542 -14.735 98 HZ PHE 12 HZ PHE 12 40.160 23.302 -12.737 99 H ARG 13 H ARG 13 34.577 17.151 -12.628 100 HA ARG 13 HA ARG 13 31.574 17.459 -12.930 101 1HB ARG 13 2HB ARG 13 33.300 14.937 -12.491 102 2HB ARG 13 1HB ARG 13 31.535 14.908 -12.508 103 1HG ARG 13 1HG ARG 13 31.503 15.756 -14.850 104 2HG ARG 13 2HG ARG 13 33.270 15.780 -14.877 105 1HD ARG 13 2HD ARG 13 33.255 13.239 -14.477 106 2HD ARG 13 1HD ARG 13 31.481 13.283 -14.560 107 HE ARG 13 HE ARG 13 32.284 14.537 -16.964 108 1HH1 ARG 13 2HH1 ARG 13 33.055 11.284 -15.620 109 2HH1 ARG 13 1HH1 ARG 13 33.274 10.657 -17.331 110 1HH2 ARG 13 2HH2 ARG 13 32.566 13.678 -18.802 111 2HH2 ARG 13 1HH2 ARG 13 33.018 11.909 -18.986 112 H GLY 14 H GLY 14 30.331 17.564 -11.161 113 1HA GLY 14 2HA GLY 14 30.803 16.317 -8.550 114 2HA GLY 14 1HA GLY 14 31.312 18.003 -8.465 115 HA PRO 15 HA PRO 15 26.508 17.906 -8.308 116 1HB PRO 15 1HB PRO 15 25.634 17.406 -5.740 117 2HB PRO 15 2HB PRO 15 26.073 16.129 -6.892 118 1HG PRO 15 2HG PRO 15 27.776 17.272 -4.645 119 2HG PRO 15 1HG PRO 15 27.485 15.548 -5.035 120 1HD PRO 15 2HD PRO 15 29.742 16.987 -5.902 121 2HD PRO 15 1HD PRO 15 29.069 15.615 -6.821 122 H GLY 16 H GLY 16 25.206 19.600 -7.792 123 1HA GLY 16 1HA GLY 16 24.471 21.726 -6.864 124 2HA GLY 16 2HA GLY 16 25.885 21.750 -5.819 125 H CYS 17 H CYS 17 24.585 22.890 -8.787 126 HA CYS 17 HA CYS 17 26.988 23.461 -10.259 127 1HB CYS 17 1HB CYS 17 24.292 24.797 -10.659 128 2HB CYS 17 2HB CYS 17 25.596 24.605 -11.848 129 HA PRO 18 HA PRO 18 27.607 27.415 -7.803 130 1HB PRO 18 1HB PRO 18 30.214 27.324 -7.205 131 2HB PRO 18 2HB PRO 18 29.064 26.086 -6.636 132 1HG PRO 18 2HG PRO 18 31.098 25.857 -8.881 133 2HG PRO 18 1HG PRO 18 30.616 24.628 -7.682 134 1HD PRO 18 2HD PRO 18 29.559 24.989 -10.371 135 2HD PRO 18 1HD PRO 18 28.922 23.879 -9.143 136 H THR 19 H THR 19 30.287 27.321 -10.181 137 HA THR 19 HA THR 19 29.966 30.246 -10.733 138 HB THR 19 HB THR 19 32.083 29.858 -12.097 139 HG1 THR 19 HG1 THR 19 33.183 27.941 -11.728 140 1HG2 THR 19 1HG2 THR 19 32.409 29.081 -9.164 141 2HG2 THR 19 2HG2 THR 19 33.695 29.658 -10.262 142 3HG2 THR 19 3HG2 THR 19 32.350 30.742 -9.814 143 H VAL 20 H VAL 20 29.681 31.080 -12.766 144 HA VAL 20 HA VAL 20 29.111 29.376 -15.175 145 HB VAL 20 HB VAL 20 27.087 31.309 -14.297 146 1HG1 VAL 20 1HG2 VAL 20 26.826 29.432 -16.760 147 2HG1 VAL 20 2HG2 VAL 20 27.177 31.170 -16.804 148 3HG1 VAL 20 3HG2 VAL 20 25.587 30.621 -16.255 149 1HG2 VAL 20 1HG1 VAL 20 26.767 29.204 -12.931 150 2HG2 VAL 20 2HG1 VAL 20 26.558 28.238 -14.403 151 3HG2 VAL 20 3HG1 VAL 20 25.337 29.465 -13.945 152 H LYS 21 H LYS 21 30.949 30.455 -14.933 153 HA LYS 21 HA LYS 21 31.669 33.241 -15.610 154 1HB LYS 21 2HB LYS 21 33.383 30.729 -16.107 155 2HB LYS 21 1HB LYS 21 33.994 32.340 -16.393 156 1HG LYS 21 1HG LYS 21 33.048 31.413 -13.640 157 2HG LYS 21 2HG LYS 21 34.682 31.183 -14.206 158 1HD LYS 21 1HD LYS 21 33.397 33.964 -13.965 159 2HD LYS 21 2HD LYS 21 34.162 33.177 -12.607 160 1HE LYS 21 1HE LYS 21 35.691 33.803 -15.211 161 2HE LYS 21 2HE LYS 21 35.544 34.949 -13.878 162 1HZ LYS 21 1HZ LYS 21 37.598 33.700 -13.718 163 2HZ LYS 21 2HZ LYS 21 36.797 32.257 -13.651 164 3HZ LYS 21 3HZ LYS 21 36.646 33.344 -12.416 165 HA PRO 22 HA PRO 22 30.525 33.915 -19.687 166 1HB PRO 22 1HB PRO 22 32.841 35.699 -20.380 167 2HB PRO 22 2HB PRO 22 31.100 36.053 -20.268 168 1HG PRO 22 2HG PRO 22 32.737 36.870 -18.228 169 2HG PRO 22 1HG PRO 22 31.178 36.095 -17.811 170 1HD PRO 22 1HD PRO 22 33.922 34.706 -17.997 171 2HD PRO 22 2HD PRO 22 32.803 34.821 -16.614 172 H DAL 23 H ALA 23 30.637 31.929 -20.550 173 HA DAL 23 HA ALA 23 32.923 31.157 -22.444 174 1HB DAL 23 1HB ALA 23 29.904 30.945 -23.010 175 2HB DAL 23 2HB ALA 23 31.215 30.465 -24.121 176 3HB DAL 23 3HB ALA 23 30.997 32.177 -23.697 177 H ILE 24 H ILE 24 30.759 29.782 -19.992 178 HA ILE 24 HA ILE 24 31.692 27.023 -20.722 179 HB ILE 24 HB ILE 24 30.122 27.706 -18.264 180 1HG1 ILE 24 2HG1 ILE 24 33.204 27.457 -18.057 181 2HG1 ILE 24 1HG1 ILE 24 32.387 28.991 -18.230 182 1HG2 ILE 24 1HG2 ILE 24 30.979 25.521 -17.352 183 2HG2 ILE 24 2HG2 ILE 24 31.976 25.287 -18.835 184 3HG2 ILE 24 3HG2 ILE 24 30.183 25.256 -18.897 185 1HD1 ILE 24 1HD1 ILE 24 32.826 28.551 -15.831 186 2HD1 ILE 24 2HD1 ILE 24 31.043 28.622 -16.172 187 3HD1 ILE 24 3HD1 ILE 24 31.837 27.051 -15.949 188 H SER 25 H SER 25 30.253 25.537 -21.115 189 HA SER 25 HA SER 25 27.253 26.066 -21.518 190 1HB SER 25 2HB SER 25 28.451 25.786 -23.707 191 2HB SER 25 1HB SER 25 29.148 24.252 -23.148 192 HG SER 25 HG SER 25 26.372 24.866 -23.358 193 H LEU 26 H LEU 26 26.983 25.509 -19.297 194 HA LEU 26 HA LEU 26 28.270 23.157 -18.044 195 1HB LEU 26 1HB LEU 26 25.989 24.933 -16.959 196 2HB LEU 26 2HB LEU 26 26.583 23.530 -16.135 197 HG LEU 26 HG LEU 26 29.000 24.642 -16.215 198 1HD1 LEU 26 1HD1 LEU 26 28.281 26.620 -17.726 199 2HD1 LEU 26 2HD1 LEU 26 27.268 27.238 -16.408 200 3HD1 LEU 26 3HD1 LEU 26 29.045 27.147 -16.222 201 1HD2 LEU 26 1HD2 LEU 26 28.755 25.706 -14.060 202 2HD2 LEU 26 2HD2 LEU 26 26.973 25.752 -14.225 203 3HD2 LEU 26 3HD2 LEU 26 27.838 24.196 -14.134 204 H ARG 27 H ARG 27 27.189 21.369 -17.163 205 HA ARG 27 HA ARG 27 24.621 20.404 -18.536 206 1HB ARG 27 1HB ARG 27 27.137 18.681 -18.128 207 2HB ARG 27 2HB ARG 27 25.538 17.988 -18.324 208 1HG ARG 27 1HG ARG 27 25.285 19.028 -20.584 209 2HG ARG 27 2HG ARG 27 26.876 19.772 -20.437 210 1HD ARG 27 1HD ARG 27 27.948 17.478 -20.311 211 2HD ARG 27 2HD ARG 27 26.349 16.726 -20.458 212 HE ARG 27 HE ARG 27 26.755 18.607 -22.676 213 1HH1 ARG 27 1HH2 ARG 27 27.823 15.299 -21.729 214 2HH1 ARG 27 2HH2 ARG 27 28.104 14.909 -23.500 215 1HH2 ARG 27 1HH1 ARG 27 27.121 18.009 -24.601 216 2HH2 ARG 27 2HH1 ARG 27 27.736 16.325 -24.993 217 H CYS 28 H CYS 28 24.647 21.815 -16.437 218 HA CYS 28 HA CYS 28 24.609 20.822 -13.933 219 1HB CYS 28 2HB CYS 28 24.224 23.199 -14.488 220 2HB CYS 28 1HB CYS 28 22.553 22.837 -14.979 221 H GLU 29 H GLU 29 21.606 20.441 -15.933 222 HA GLU 29 HA GLU 29 20.398 18.627 -13.773 223 1HB GLU 29 1HB GLU 29 19.151 19.901 -16.294 224 2HB GLU 29 2HB GLU 29 18.324 18.671 -15.349 225 1HG GLU 29 2HG GLU 29 18.301 20.132 -13.329 226 2HG GLU 29 1HG GLU 29 19.151 21.402 -14.220 227 HE2 GLU 29 HE2 GLU 29 16.332 19.824 -13.609 Start of MODEL 18 1 1H SER 1 1H SER 1 19.998 18.249 -9.414 2 2H SER 1 2H SER 1 20.886 16.863 -9.559 3 3H SER 1 3H SER 1 21.277 17.978 -8.404 4 HA SER 1 HA SER 1 21.420 18.412 -11.341 5 1HB SER 1 1HB SER 1 22.227 20.226 -8.992 6 2HB SER 1 2HB SER 1 22.603 20.552 -10.692 7 HG SER 1 HG SER 1 20.361 20.458 -11.127 8 H LYS 2 H LYS 2 23.277 17.606 -12.211 9 HA LYS 2 HA LYS 2 25.736 17.059 -10.539 10 1HB LYS 2 1HB LYS 2 24.273 14.955 -10.730 11 2HB LYS 2 2HB LYS 2 24.426 15.048 -12.484 12 1HG LYS 2 1HG LYS 2 26.923 14.776 -12.249 13 2HG LYS 2 2HG LYS 2 26.748 14.711 -10.490 14 1HD LYS 2 1HD LYS 2 25.349 12.619 -10.709 15 2HD LYS 2 2HD LYS 2 25.510 12.662 -12.458 16 1HE LYS 2 2HE LYS 2 27.948 12.407 -10.553 17 2HE LYS 2 1HE LYS 2 27.008 11.036 -11.119 18 1HZ LYS 2 1HZ LYS 2 28.455 12.910 -12.916 19 2HZ LYS 2 2HZ LYS 2 27.565 11.609 -13.411 20 3HZ LYS 2 3HZ LYS 2 28.933 11.382 -12.512 21 H TYR 3 H TYR 3 26.548 18.858 -11.470 22 HA TYR 3 HA TYR 3 26.566 19.488 -14.347 23 1HB TYR 3 2HB TYR 3 27.686 21.514 -13.785 24 2HB TYR 3 1HB TYR 3 26.513 21.235 -12.542 25 HD1 TYR 3 HD1 TYR 3 27.251 20.821 -10.170 26 HD2 TYR 3 HD2 TYR 3 30.183 21.210 -13.297 27 HE1 TYR 3 HE1 TYR 3 29.008 20.899 -8.538 28 HE2 TYR 3 HE2 TYR 3 31.914 21.368 -11.643 29 HH TYR 3 HH TYR 3 31.196 21.093 -8.156 30 H GLU 4 H GLU 4 28.316 19.634 -15.785 31 HA GLU 4 HA GLU 4 30.992 18.346 -15.092 32 1HB GLU 4 1HB GLU 4 29.639 16.588 -16.212 33 2HB GLU 4 2HB GLU 4 29.343 17.635 -17.594 34 1HG GLU 4 2HG GLU 4 31.772 17.581 -18.186 35 2HG GLU 4 1HG GLU 4 32.141 16.615 -16.769 36 HE2 GLU 4 HE2 GLU 4 30.170 15.049 -19.966 37 H TYR 5 H TYR 5 32.339 20.017 -15.390 38 HA TYR 5 HA TYR 5 32.013 21.793 -17.879 39 1HB TYR 5 1HB TYR 5 32.570 23.771 -16.954 40 2HB TYR 5 2HB TYR 5 31.206 23.078 -16.121 41 HD1 TYR 5 HD1 TYR 5 34.868 23.914 -15.744 42 HD2 TYR 5 HD2 TYR 5 31.173 23.144 -13.683 43 HE1 TYR 5 HE1 TYR 5 35.808 24.769 -13.682 44 HE2 TYR 5 HE2 TYR 5 32.167 23.958 -11.631 45 HH TYR 5 HH TYR 5 35.501 25.173 -11.540 46 H THR 6 H THR 6 33.543 21.170 -19.166 47 HA THR 6 HA THR 6 36.234 20.296 -18.169 48 HB THR 6 HB THR 6 35.137 20.196 -21.038 49 HG1 THR 6 HG1 THR 6 34.859 18.274 -18.978 50 1HG2 THR 6 1HG2 THR 6 36.534 18.143 -21.285 51 2HG2 THR 6 2HG2 THR 6 37.122 18.320 -19.609 52 3HG2 THR 6 3HG2 THR 6 37.562 19.540 -20.839 53 H VAL 7 H VAL 7 37.246 22.083 -17.631 54 HA VAL 7 HA VAL 7 37.773 24.271 -19.725 55 HB VAL 7 HB VAL 7 38.039 24.373 -16.678 56 1HG1 VAL 7 1HG2 VAL 7 38.870 26.708 -18.530 57 2HG1 VAL 7 2HG2 VAL 7 38.859 26.722 -16.738 58 3HG1 VAL 7 3HG2 VAL 7 39.971 25.660 -17.617 59 1HG2 VAL 7 1HG1 VAL 7 36.287 26.192 -18.487 60 2HG2 VAL 7 2HG1 VAL 7 36.313 26.169 -16.697 61 3HG2 VAL 7 3HG1 VAL 7 35.697 24.780 -17.609 62 HA DPR 8 HA PRO 8 42.165 22.841 -19.650 63 1HB DPR 8 2HB PRO 8 42.633 24.074 -21.550 64 2HB DPR 8 1HB PRO 8 42.737 22.475 -22.323 65 1HG DPR 8 1HG PRO 8 41.055 24.290 -23.351 66 2HG DPR 8 2HG PRO 8 40.490 22.598 -23.124 67 1HD DPR 8 1HD PRO 8 39.842 25.032 -21.392 68 2HD DPR 8 2HD PRO 8 38.776 23.676 -21.851 69 H SER 9 H SER 9 43.255 20.919 -20.127 70 HA SER 9 HA SER 9 41.628 18.346 -20.342 71 1HB SER 9 2HB SER 9 44.583 18.796 -19.626 72 2HB SER 9 1HB SER 9 43.804 17.221 -19.807 73 HG SER 9 HG SER 9 44.800 17.928 -21.720 74 H TYR 10 H TYR 10 40.437 19.995 -18.384 75 HA TYR 10 HA TYR 10 40.802 18.292 -15.914 76 1HB TYR 10 2HB TYR 10 41.875 20.960 -16.002 77 2HB TYR 10 1HB TYR 10 40.351 21.201 -15.225 78 HD1 TYR 10 HD1 TYR 10 43.692 19.582 -14.928 79 HD2 TYR 10 HD2 TYR 10 39.899 20.115 -12.948 80 HE1 TYR 10 HE1 TYR 10 44.637 18.770 -12.856 81 HE2 TYR 10 HE2 TYR 10 40.891 19.296 -10.893 82 HH TYR 10 HH TYR 10 44.293 18.305 -10.723 83 H THR 11 H THR 11 39.040 17.374 -16.314 84 HA THR 11 HA THR 11 36.422 18.604 -17.064 85 HB THR 11 HB THR 11 36.978 15.686 -16.331 86 HG1 THR 11 HG1 THR 11 38.357 16.473 -17.948 87 1HG2 THR 11 1HG2 THR 11 35.150 15.110 -17.918 88 2HG2 THR 11 2HG2 THR 11 34.872 16.832 -18.276 89 3HG2 THR 11 3HG2 THR 11 34.508 16.198 -16.654 90 H PHE 12 H PHE 12 35.440 19.830 -15.429 91 HA PHE 12 HA PHE 12 35.800 18.988 -12.532 92 1HB PHE 12 1HB PHE 12 34.601 21.484 -13.760 93 2HB PHE 12 2HB PHE 12 34.623 21.179 -12.048 94 HD1 PHE 12 HD1 PHE 12 36.784 21.232 -10.730 95 HD2 PHE 12 HD2 PHE 12 36.776 22.089 -14.956 96 HE1 PHE 12 HE1 PHE 12 38.981 22.244 -10.553 97 HE2 PHE 12 HE2 PHE 12 38.969 23.095 -14.728 98 HZ PHE 12 HZ PHE 12 40.090 23.184 -12.540 99 H ARG 13 H ARG 13 34.527 17.158 -12.517 100 HA ARG 13 HA ARG 13 31.546 17.387 -13.012 101 1HB ARG 13 1HB ARG 13 33.335 14.940 -12.405 102 2HB ARG 13 2HB ARG 13 31.579 14.826 -12.485 103 1HG ARG 13 1HG ARG 13 31.591 15.601 -14.857 104 2HG ARG 13 2HG ARG 13 33.345 15.710 -14.799 105 1HD ARG 13 2HD ARG 13 32.980 13.687 -15.909 106 2HD ARG 13 1HD ARG 13 33.406 13.154 -14.286 107 HE ARG 13 HE ARG 13 30.495 13.355 -14.461 108 1HH1 ARG 13 1HH1 ARG 13 33.050 11.230 -15.853 109 2HH1 ARG 13 2HH1 ARG 13 31.800 9.904 -16.067 110 1HH2 ARG 13 2HH2 ARG 13 29.228 11.767 -14.764 111 2HH2 ARG 13 1HH2 ARG 13 29.809 10.189 -15.498 112 H GLY 14 H GLY 14 30.172 17.498 -11.332 113 1HA GLY 14 2HA GLY 14 30.480 16.290 -8.699 114 2HA GLY 14 1HA GLY 14 30.980 17.972 -8.565 115 HA PRO 15 HA PRO 15 26.198 17.903 -8.500 116 1HB PRO 15 2HB PRO 15 25.374 17.804 -5.884 117 2HB PRO 15 1HB PRO 15 25.879 16.371 -6.802 118 1HG PRO 15 2HG PRO 15 27.515 17.962 -4.796 119 2HG PRO 15 1HG PRO 15 27.318 16.183 -4.895 120 1HD PRO 15 2HD PRO 15 29.487 17.614 -6.015 121 2HD PRO 15 1HD PRO 15 28.929 16.041 -6.646 122 H GLY 16 H GLY 16 24.868 19.627 -8.288 123 1HA GLY 16 2HA GLY 16 24.028 21.823 -7.816 124 2HA GLY 16 1HA GLY 16 25.234 21.950 -6.542 125 H CYS 17 H CYS 17 24.273 23.613 -9.098 126 HA CYS 17 HA CYS 17 26.582 23.889 -10.811 127 1HB CYS 17 2HB CYS 17 24.700 26.263 -10.779 128 2HB CYS 17 1HB CYS 17 25.450 25.397 -12.115 129 HA PRO 18 HA PRO 18 28.522 26.754 -7.638 130 1HB PRO 18 1HB PRO 18 31.115 26.101 -7.709 131 2HB PRO 18 2HB PRO 18 29.853 24.930 -7.246 132 1HG PRO 18 2HG PRO 18 31.290 25.165 -9.922 133 2HG PRO 18 1HG PRO 18 30.919 23.687 -8.994 134 1HD PRO 18 2HD PRO 18 29.347 24.780 -11.123 135 2HD PRO 18 1HD PRO 18 28.741 23.600 -9.942 136 H THR 19 H THR 19 30.928 27.118 -10.265 137 HA THR 19 HA THR 19 30.374 30.085 -10.400 138 HB THR 19 HB THR 19 32.400 30.022 -11.959 139 HG1 THR 19 HG1 THR 19 32.668 27.425 -10.904 140 1HG2 THR 19 1HG2 THR 19 34.155 29.894 -10.258 141 2HG2 THR 19 2HG2 THR 19 33.021 29.108 -9.118 142 3HG2 THR 19 3HG2 THR 19 32.734 30.788 -9.649 143 H VAL 20 H VAL 20 29.680 31.010 -12.229 144 HA VAL 20 HA VAL 20 28.909 29.368 -14.696 145 HB VAL 20 HB VAL 20 27.007 31.165 -13.342 146 1HG1 VAL 20 1HG1 VAL 20 25.162 30.376 -14.950 147 2HG1 VAL 20 2HG1 VAL 20 26.561 31.008 -15.828 148 3HG1 VAL 20 3HG1 VAL 20 26.333 29.256 -15.711 149 1HG2 VAL 20 1HG2 VAL 20 25.467 29.227 -12.651 150 2HG2 VAL 20 2HG2 VAL 20 27.089 29.053 -11.959 151 3HG2 VAL 20 3HG2 VAL 20 26.635 28.068 -13.358 152 H LYS 21 H LYS 21 30.794 30.732 -14.494 153 HA LYS 21 HA LYS 21 30.989 33.508 -15.394 154 1HB LYS 21 1HB LYS 21 33.061 31.300 -15.917 155 2HB LYS 21 2HB LYS 21 33.390 32.979 -16.243 156 1HG LYS 21 2HG LYS 21 32.805 31.868 -13.436 157 2HG LYS 21 1HG LYS 21 34.410 31.983 -14.148 158 1HD LYS 21 1HD LYS 21 34.170 34.496 -14.317 159 2HD LYS 21 2HD LYS 21 32.568 34.384 -13.583 160 1HE LYS 21 2HE LYS 21 33.589 33.430 -11.469 161 2HE LYS 21 1HE LYS 21 35.201 33.535 -12.201 162 1HZ LYS 21 1HZ LYS 21 34.716 35.479 -10.840 163 2HZ LYS 21 2HZ LYS 21 33.378 35.849 -11.735 164 3HZ LYS 21 3HZ LYS 21 34.880 35.947 -12.416 165 HA PRO 22 HA PRO 22 29.540 33.614 -19.454 166 1HB PRO 22 1HB PRO 22 31.349 35.838 -20.352 167 2HB PRO 22 2HB PRO 22 29.580 35.793 -20.156 168 1HG PRO 22 1HG PRO 22 31.086 37.087 -18.266 169 2HG PRO 22 2HG PRO 22 29.758 36.019 -17.719 170 1HD PRO 22 2HD PRO 22 32.731 35.252 -17.986 171 2HD PRO 22 1HD PRO 22 31.679 35.214 -16.548 172 H DAL 23 H ALA 23 30.036 31.690 -20.315 173 HA DAL 23 HA ALA 23 32.485 31.320 -22.110 174 1HB DAL 23 1HB ALA 23 29.593 30.648 -22.920 175 2HB DAL 23 2HB ALA 23 30.519 32.058 -23.497 176 3HB DAL 23 3HB ALA 23 31.050 30.415 -23.923 177 H ILE 24 H ILE 24 30.300 29.550 -19.915 178 HA ILE 24 HA ILE 24 31.791 27.009 -20.522 179 HB ILE 24 HB ILE 24 29.773 27.371 -18.311 180 1HG1 ILE 24 1HG1 ILE 24 32.850 27.422 -17.818 181 2HG1 ILE 24 2HG1 ILE 24 31.914 28.885 -18.000 182 1HG2 ILE 24 1HG2 ILE 24 30.911 25.250 -17.331 183 2HG2 ILE 24 2HG2 ILE 24 31.789 25.121 -18.872 184 3HG2 ILE 24 3HG2 ILE 24 29.999 25.045 -18.845 185 1HD1 ILE 24 1HD1 ILE 24 31.434 26.832 -15.809 186 2HD1 ILE 24 2HD1 ILE 24 30.474 28.310 -16.055 187 3HD1 ILE 24 3HD1 ILE 24 32.228 28.433 -15.612 188 H SER 25 H SER 25 30.743 25.368 -21.194 189 HA SER 25 HA SER 25 27.894 25.405 -22.372 190 1HB SER 25 1HB SER 25 29.723 24.944 -24.024 191 2HB SER 25 2HB SER 25 30.332 23.621 -23.010 192 HG SER 25 HG SER 25 27.719 23.822 -24.128 193 H LEU 26 H LEU 26 27.295 25.369 -20.130 194 HA LEU 26 HA LEU 26 28.326 23.345 -18.250 195 1HB LEU 26 2HB LEU 26 27.667 25.879 -17.827 196 2HB LEU 26 1HB LEU 26 26.037 25.291 -17.747 197 HG LEU 26 HG LEU 26 26.878 23.791 -15.681 198 1HD1 LEU 26 1HD1 LEU 26 29.310 23.882 -16.204 199 2HD1 LEU 26 2HD1 LEU 26 28.972 24.384 -14.533 200 3HD1 LEU 26 3HD1 LEU 26 29.382 25.599 -15.779 201 1HD2 LEU 26 1HD2 LEU 26 26.779 25.754 -14.090 202 2HD2 LEU 26 2HD2 LEU 26 27.110 26.875 -15.438 203 3HD2 LEU 26 3HD2 LEU 26 25.590 25.962 -15.389 204 H ARG 27 H ARG 27 27.178 21.726 -17.199 205 HA ARG 27 HA ARG 27 24.508 20.817 -18.403 206 1HB ARG 27 1HB ARG 27 27.076 19.099 -18.341 207 2HB ARG 27 2HB ARG 27 25.479 18.385 -18.431 208 1HG ARG 27 1HG ARG 27 24.983 19.543 -20.552 209 2HG ARG 27 2HG ARG 27 26.543 20.347 -20.537 210 1HD ARG 27 2HD ARG 27 26.266 17.257 -20.616 211 2HD ARG 27 1HD ARG 27 26.265 18.264 -22.057 212 HE ARG 27 HE ARG 27 28.657 18.811 -20.406 213 1HH1 ARG 27 2HH2 ARG 27 27.463 16.539 -22.933 214 2HH1 ARG 27 1HH2 ARG 27 29.201 16.176 -23.394 215 1HH2 ARG 27 2HH1 ARG 27 30.534 18.295 -21.043 216 2HH2 ARG 27 1HH1 ARG 27 30.799 17.094 -22.406 217 H CYS 28 H CYS 28 24.749 22.069 -16.178 218 HA CYS 28 HA CYS 28 24.765 20.697 -13.816 219 1HB CYS 28 2HB CYS 28 24.684 23.211 -14.113 220 2HB CYS 28 1HB CYS 28 22.917 23.074 -14.264 221 H GLU 29 H GLU 29 21.682 21.039 -15.675 222 HA GLU 29 HA GLU 29 20.279 19.211 -13.667 223 1HB GLU 29 1HB GLU 29 19.264 21.499 -14.452 224 2HB GLU 29 2HB GLU 29 19.073 20.769 -16.041 225 1HG GLU 29 2HG GLU 29 17.522 19.030 -14.983 226 2HG GLU 29 1HG GLU 29 17.740 19.821 -13.416 227 HE2 GLU 29 HE2 GLU 29 15.830 22.621 -14.153 Start of MODEL 19 1 1H SER 1 1H SER 1 20.183 18.066 -8.855 2 2H SER 1 2H SER 1 20.902 16.743 -9.536 3 3H SER 1 3H SER 1 21.380 17.267 -8.044 4 HA SER 1 HA SER 1 21.682 18.779 -10.579 5 1HB SER 1 1HB SER 1 22.986 20.404 -9.242 6 2HB SER 1 2HB SER 1 21.317 20.265 -8.666 7 HG SER 1 HG SER 1 23.598 18.962 -7.579 8 H LYS 2 H LYS 2 23.305 17.972 -11.741 9 HA LYS 2 HA LYS 2 25.843 16.954 -10.532 10 1HB LYS 2 1HB LYS 2 26.057 14.839 -11.611 11 2HB LYS 2 2HB LYS 2 24.763 14.872 -10.430 12 1HG LYS 2 1HG LYS 2 23.054 14.927 -12.302 13 2HG LYS 2 2HG LYS 2 24.359 14.878 -13.488 14 1HD LYS 2 1HD LYS 2 25.106 12.626 -12.581 15 2HD LYS 2 2HD LYS 2 23.803 12.672 -11.390 16 1HE LYS 2 1HE LYS 2 22.088 12.684 -13.258 17 2HE LYS 2 2HE LYS 2 23.395 12.638 -14.456 18 1HZ LYS 2 1HZ LYS 2 24.127 10.520 -13.490 19 2HZ LYS 2 2HZ LYS 2 22.550 10.422 -13.971 20 3HZ LYS 2 3HZ LYS 2 22.916 10.565 -12.366 21 H TYR 3 H TYR 3 26.712 18.732 -11.445 22 HA TYR 3 HA TYR 3 26.463 19.339 -14.381 23 1HB TYR 3 1HB TYR 3 27.426 21.450 -13.928 24 2HB TYR 3 2HB TYR 3 26.269 21.148 -12.672 25 HD1 TYR 3 HD1 TYR 3 27.048 20.851 -10.274 26 HD2 TYR 3 HD2 TYR 3 29.924 21.419 -13.430 27 HE1 TYR 3 HE1 TYR 3 28.828 21.074 -8.655 28 HE2 TYR 3 HE2 TYR 3 31.661 21.665 -11.779 29 HH TYR 3 HH TYR 3 30.976 21.432 -8.295 30 H GLU 4 H GLU 4 28.218 19.497 -15.814 31 HA GLU 4 HA GLU 4 30.943 18.345 -15.023 32 1HB GLU 4 1HB GLU 4 29.637 16.565 -16.187 33 2HB GLU 4 2HB GLU 4 29.396 17.613 -17.580 34 1HG GLU 4 2HG GLU 4 31.853 17.577 -18.054 35 2HG GLU 4 1HG GLU 4 32.154 16.613 -16.615 36 HE2 GLU 4 HE2 GLU 4 30.461 15.042 -19.955 37 H TYR 5 H TYR 5 32.347 19.930 -15.401 38 HA TYR 5 HA TYR 5 32.029 21.688 -17.899 39 1HB TYR 5 2HB TYR 5 32.717 23.654 -17.047 40 2HB TYR 5 1HB TYR 5 31.332 23.081 -16.177 41 HD1 TYR 5 HD1 TYR 5 31.390 23.073 -13.700 42 HD2 TYR 5 HD2 TYR 5 35.014 23.805 -15.907 43 HE1 TYR 5 HE1 TYR 5 32.466 23.923 -11.704 44 HE2 TYR 5 HE2 TYR 5 36.035 24.674 -13.892 45 HH TYR 5 HH TYR 5 34.286 24.785 -10.810 46 H THR 6 H THR 6 33.488 20.889 -19.192 47 HA THR 6 HA THR 6 36.211 20.056 -18.233 48 HB THR 6 HB THR 6 35.006 19.799 -21.051 49 HG1 THR 6 HG1 THR 6 34.334 17.756 -20.390 50 1HG2 THR 6 1HG2 THR 6 37.070 18.026 -19.605 51 2HG2 THR 6 2HG2 THR 6 37.434 19.162 -20.934 52 3HG2 THR 6 3HG2 THR 6 36.401 17.731 -21.234 53 H VAL 7 H VAL 7 37.220 21.872 -17.825 54 HA VAL 7 HA VAL 7 37.669 23.950 -20.047 55 HB VAL 7 HB VAL 7 37.953 24.248 -17.014 56 1HG1 VAL 7 1HG2 VAL 7 39.831 25.538 -18.057 57 2HG1 VAL 7 2HG2 VAL 7 38.686 26.488 -19.020 58 3HG1 VAL 7 3HG2 VAL 7 38.694 26.616 -17.233 59 1HG2 VAL 7 1HG1 VAL 7 36.121 25.887 -18.914 60 2HG2 VAL 7 2HG1 VAL 7 36.169 25.988 -17.128 61 3HG2 VAL 7 3HG1 VAL 7 35.590 24.519 -17.933 62 HA DPR 8 HA PRO 8 42.098 22.605 -19.879 63 1HB DPR 8 2HB PRO 8 42.575 23.817 -21.797 64 2HB DPR 8 1HB PRO 8 42.703 22.205 -22.539 65 1HG DPR 8 2HG PRO 8 41.016 23.988 -23.620 66 2HG DPR 8 1HG PRO 8 40.466 22.295 -23.372 67 1HD DPR 8 2HD PRO 8 39.763 24.750 -21.696 68 2HD DPR 8 1HD PRO 8 38.727 23.366 -22.135 69 H SER 9 H SER 9 43.207 20.679 -20.329 70 HA SER 9 HA SER 9 41.576 18.103 -20.499 71 1HB SER 9 1HB SER 9 44.537 18.559 -19.811 72 2HB SER 9 2HB SER 9 43.753 16.983 -19.957 73 HG SER 9 HG SER 9 43.846 18.982 -21.975 74 H TYR 10 H TYR 10 40.371 19.750 -18.598 75 HA TYR 10 HA TYR 10 40.747 18.116 -16.083 76 1HB TYR 10 2HB TYR 10 41.746 20.818 -16.231 77 2HB TYR 10 1HB TYR 10 40.217 21.023 -15.453 78 HD1 TYR 10 HD1 TYR 10 43.611 19.525 -15.135 79 HD2 TYR 10 HD2 TYR 10 39.801 19.951 -13.160 80 HE1 TYR 10 HE1 TYR 10 44.583 18.776 -13.051 81 HE2 TYR 10 HE2 TYR 10 40.821 19.196 -11.094 82 HH TYR 10 HH TYR 10 44.256 18.330 -10.912 83 H THR 11 H THR 11 39.009 17.150 -16.468 84 HA THR 11 HA THR 11 36.348 18.291 -17.214 85 HB THR 11 HB THR 11 36.984 15.424 -16.364 86 HG1 THR 11 HG1 THR 11 37.041 16.627 -18.927 87 1HG2 THR 11 1HG2 THR 11 34.788 16.433 -18.286 88 2HG2 THR 11 2HG2 THR 11 35.118 14.737 -17.861 89 3HG2 THR 11 3HG2 THR 11 34.496 15.866 -16.624 90 H PHE 12 H PHE 12 35.452 19.622 -15.581 91 HA PHE 12 HA PHE 12 35.755 18.800 -12.670 92 1HB PHE 12 1HB PHE 12 34.645 21.308 -13.974 93 2HB PHE 12 2HB PHE 12 34.537 21.021 -12.266 94 HD1 PHE 12 HD1 PHE 12 36.923 21.829 -15.025 95 HD2 PHE 12 HD2 PHE 12 36.576 21.080 -10.792 96 HE1 PHE 12 HE1 PHE 12 39.090 22.837 -14.639 97 HE2 PHE 12 HE2 PHE 12 38.747 22.091 -10.455 98 HZ PHE 12 HZ PHE 12 40.028 22.979 -12.367 99 H ARG 13 H ARG 13 34.494 16.927 -12.771 100 HA ARG 13 HA ARG 13 31.497 17.217 -13.099 101 1HB ARG 13 2HB ARG 13 33.229 14.730 -12.461 102 2HB ARG 13 1HB ARG 13 31.470 14.690 -12.441 103 1HG ARG 13 1HG ARG 13 31.412 15.367 -14.876 104 2HG ARG 13 2HG ARG 13 33.166 15.340 -14.884 105 1HD ARG 13 1HD ARG 13 32.572 13.289 -15.867 106 2HD ARG 13 2HD ARG 13 33.066 12.824 -14.242 107 HE ARG 13 HE ARG 13 30.095 13.262 -14.750 108 1HH1 ARG 13 2HH1 ARG 13 32.645 10.775 -14.215 109 2HH1 ARG 13 1HH1 ARG 13 31.332 9.527 -13.921 110 1HH2 ARG 13 1HH2 ARG 13 28.758 11.750 -14.393 111 2HH2 ARG 13 2HH2 ARG 13 29.306 10.040 -14.015 112 H GLY 14 H GLY 14 30.241 17.447 -11.334 113 1HA GLY 14 1HA GLY 14 30.817 16.478 -8.601 114 2HA GLY 14 2HA GLY 14 31.187 18.198 -8.720 115 HA PRO 15 HA PRO 15 26.398 17.715 -8.490 116 1HB PRO 15 1HB PRO 15 25.562 17.266 -5.903 117 2HB PRO 15 2HB PRO 15 26.083 15.977 -7.006 118 1HG PRO 15 1HG PRO 15 27.712 17.323 -4.817 119 2HG PRO 15 2HG PRO 15 27.531 15.568 -5.130 120 1HD PRO 15 2HD PRO 15 29.693 17.099 -6.069 121 2HD PRO 15 1HD PRO 15 29.095 15.660 -6.936 122 H GLY 16 H GLY 16 25.001 19.341 -8.067 123 1HA GLY 16 2HA GLY 16 24.091 21.425 -7.228 124 2HA GLY 16 1HA GLY 16 25.450 21.559 -6.122 125 H CYS 17 H CYS 17 24.112 22.912 -8.865 126 HA CYS 17 HA CYS 17 26.307 23.384 -10.599 127 1HB CYS 17 1HB CYS 17 23.809 23.698 -11.105 128 2HB CYS 17 2HB CYS 17 23.975 25.343 -10.433 129 HA PRO 18 HA PRO 18 28.258 26.620 -7.888 130 1HB PRO 18 1HB PRO 18 30.817 26.517 -8.685 131 2HB PRO 18 2HB PRO 18 29.964 25.059 -8.127 132 1HG PRO 18 2HG PRO 18 30.543 25.899 -11.010 133 2HG PRO 18 1HG PRO 18 30.788 24.295 -10.254 134 1HD PRO 18 1HD PRO 18 28.447 25.094 -11.700 135 2HD PRO 18 2HD PRO 18 28.509 23.745 -10.543 136 H THR 19 H THR 19 30.420 28.479 -9.253 137 HA THR 19 HA THR 19 28.655 30.722 -10.041 138 HB THR 19 HB THR 19 30.890 31.841 -10.578 139 HG1 THR 19 HG1 THR 19 31.917 29.516 -9.358 140 1HG2 THR 19 1HG2 THR 19 30.702 30.888 -7.687 141 2HG2 THR 19 2HG2 THR 19 31.667 32.263 -8.297 142 3HG2 THR 19 3HG2 THR 19 29.885 32.314 -8.384 143 H VAL 20 H VAL 20 28.598 31.653 -12.112 144 HA VAL 20 HA VAL 20 29.218 29.772 -14.469 145 HB VAL 20 HB VAL 20 26.649 31.158 -14.063 146 1HG1 VAL 20 1HG1 VAL 20 27.074 30.485 -16.481 147 2HG1 VAL 20 2HG1 VAL 20 27.136 28.783 -16.020 148 3HG1 VAL 20 3HG1 VAL 20 25.606 29.698 -15.901 149 1HG2 VAL 20 1HG2 VAL 20 25.340 29.027 -13.442 150 2HG2 VAL 20 2HG2 VAL 20 26.593 29.440 -12.265 151 3HG2 VAL 20 3HG2 VAL 20 26.895 28.138 -13.419 152 H LYS 21 H LYS 21 30.538 31.798 -13.799 153 HA LYS 21 HA LYS 21 30.452 34.240 -15.337 154 1HB LYS 21 1HB LYS 21 32.263 33.357 -13.528 155 2HB LYS 21 2HB LYS 21 33.030 32.623 -14.907 156 1HG LYS 21 2HG LYS 21 34.248 34.526 -14.497 157 2HG LYS 21 1HG LYS 21 33.313 34.944 -15.926 158 1HD LYS 21 1HD LYS 21 31.699 36.244 -14.411 159 2HD LYS 21 2HD LYS 21 32.695 35.820 -13.020 160 1HE LYS 21 2HE LYS 21 34.656 37.081 -14.034 161 2HE LYS 21 1HE LYS 21 33.654 37.506 -15.435 162 1HZ LYS 21 1HZ LYS 21 32.123 38.650 -13.915 163 2HZ LYS 21 2HZ LYS 21 33.056 38.255 -12.610 164 3HZ LYS 21 3HZ LYS 21 33.648 39.268 -13.774 165 HA PRO 22 HA PRO 22 30.196 33.035 -19.468 166 1HB PRO 22 1HB PRO 22 31.683 35.461 -20.530 167 2HB PRO 22 2HB PRO 22 30.021 34.902 -20.837 168 1HG PRO 22 2HG PRO 22 30.393 36.956 -19.061 169 2HG PRO 22 1HG PRO 22 29.274 35.640 -18.590 170 1HD PRO 22 1HD PRO 22 32.240 35.893 -17.833 171 2HD PRO 22 2HD PRO 22 30.804 35.772 -16.786 172 H DAL 23 H ALA 23 31.026 31.727 -20.954 173 HA DAL 23 HA ALA 23 33.927 30.924 -20.729 174 1HB DAL 23 1HB ALA 23 33.928 32.426 -22.722 175 2HB DAL 23 2HB ALA 23 32.651 31.441 -23.487 176 3HB DAL 23 3HB ALA 23 34.265 30.740 -23.195 177 H ILE 24 H ILE 24 31.758 29.639 -19.497 178 HA ILE 24 HA ILE 24 32.333 26.955 -20.322 179 HB ILE 24 HB ILE 24 30.184 27.539 -18.290 180 1HG1 ILE 24 2HG1 ILE 24 33.164 27.271 -17.431 181 2HG1 ILE 24 1HG1 ILE 24 32.395 28.816 -17.676 182 1HG2 ILE 24 1HG2 ILE 24 32.103 25.142 -18.598 183 2HG2 ILE 24 2HG2 ILE 24 30.904 25.295 -17.282 184 3HG2 ILE 24 3HG2 ILE 24 30.357 25.153 -18.959 185 1HD1 ILE 24 1HD1 ILE 24 31.432 26.769 -15.651 186 2HD1 ILE 24 2HD1 ILE 24 30.674 28.349 -15.959 187 3HD1 ILE 24 3HD1 ILE 24 32.358 28.270 -15.286 188 H SER 25 H SER 25 31.105 25.514 -21.135 189 HA SER 25 HA SER 25 28.316 25.986 -22.355 190 1HB SER 25 1HB SER 25 30.103 25.525 -24.066 191 2HB SER 25 2HB SER 25 30.567 24.046 -23.201 192 HG SER 25 HG SER 25 27.996 24.634 -24.281 193 H LEU 26 H LEU 26 27.682 25.755 -20.142 194 HA LEU 26 HA LEU 26 28.576 23.468 -18.471 195 1HB LEU 26 2HB LEU 26 28.367 25.891 -17.727 196 2HB LEU 26 1HB LEU 26 26.627 25.708 -17.858 197 HG LEU 26 HG LEU 26 26.784 23.975 -15.891 198 1HD1 LEU 26 1HD1 LEU 26 29.162 23.303 -16.147 199 2HD1 LEU 26 2HD1 LEU 26 28.764 23.790 -14.489 200 3HD1 LEU 26 3HD1 LEU 26 29.704 24.885 -15.528 201 1HD2 LEU 26 1HD2 LEU 26 26.178 26.407 -15.502 202 2HD2 LEU 26 2HD2 LEU 26 27.090 25.758 -14.127 203 3HD2 LEU 26 3HD2 LEU 26 27.901 26.800 -15.316 204 H ARG 27 H ARG 27 27.178 22.044 -17.330 205 HA ARG 27 HA ARG 27 24.550 21.330 -18.730 206 1HB ARG 27 1HB ARG 27 26.967 19.419 -18.472 207 2HB ARG 27 2HB ARG 27 25.333 18.819 -18.671 208 1HG ARG 27 1HG ARG 27 25.060 19.984 -20.817 209 2HG ARG 27 2HG ARG 27 26.659 20.695 -20.700 210 1HD ARG 27 1HD ARG 27 26.211 17.625 -20.793 211 2HD ARG 27 2HD ARG 27 26.361 18.622 -22.234 212 HE ARG 27 HE ARG 27 28.668 19.057 -20.443 213 1HH1 ARG 27 2HH2 ARG 27 27.513 16.797 -23.000 214 2HH1 ARG 27 1HH2 ARG 27 29.256 16.339 -23.346 215 1HH2 ARG 27 2HH1 ARG 27 30.550 18.435 -20.955 216 2HH2 ARG 27 1HH1 ARG 27 30.835 17.195 -22.278 217 H CYS 28 H CYS 28 24.703 22.577 -16.466 218 HA CYS 28 HA CYS 28 23.837 20.966 -14.276 219 1HB CYS 28 1HB CYS 28 23.223 23.899 -14.886 220 2HB CYS 28 2HB CYS 28 22.855 23.099 -13.347 221 H GLU 29 H GLU 29 20.180 20.452 -15.322 222 HA GLU 29 HA GLU 29 22.381 19.453 -13.503 223 1HB GLU 29 1HB GLU 29 20.841 17.925 -12.507 224 2HB GLU 29 2HB GLU 29 20.264 19.572 -12.400 225 1HG GLU 29 2HG GLU 29 18.515 19.089 -14.164 226 2HG GLU 29 1HG GLU 29 19.099 17.424 -14.280 227 HE2 GLU 29 HE2 GLU 29 19.156 16.249 -12.405 Start of MODEL 20 1 1H SER 1 1H SER 1 21.901 18.899 -11.802 2 2H SER 1 2H SER 1 22.612 20.092 -10.909 3 3H SER 1 3H SER 1 20.981 19.848 -10.811 4 HA SER 1 HA SER 1 22.053 19.004 -8.854 5 1HB SER 1 2HB SER 1 19.946 17.978 -9.675 6 2HB SER 1 1HB SER 1 20.876 16.815 -10.638 7 HG SER 1 HG SER 1 21.014 17.173 -7.821 8 H LYS 2 H LYS 2 23.442 17.332 -11.714 9 HA LYS 2 HA LYS 2 25.940 16.756 -10.096 10 1HB LYS 2 1HB LYS 2 24.476 14.670 -10.198 11 2HB LYS 2 2HB LYS 2 24.529 14.741 -11.960 12 1HG LYS 2 2HG LYS 2 27.031 14.448 -11.868 13 2HG LYS 2 1HG LYS 2 26.957 14.396 -10.101 14 1HD LYS 2 2HD LYS 2 25.498 12.292 -10.259 15 2HD LYS 2 1HD LYS 2 25.621 12.376 -12.010 16 1HE LYS 2 1HE LYS 2 27.186 10.740 -11.449 17 2HE LYS 2 2HE LYS 2 28.213 12.131 -11.755 18 1HZ LYS 2 1HZ LYS 2 28.858 10.955 -9.739 19 2HZ LYS 2 2HZ LYS 2 27.363 11.141 -9.062 20 3HZ LYS 2 3HZ LYS 2 28.327 12.459 -9.309 21 H TYR 3 H TYR 3 26.714 18.588 -11.070 22 HA TYR 3 HA TYR 3 26.636 19.091 -13.990 23 1HB TYR 3 2HB TYR 3 27.606 21.209 -13.577 24 2HB TYR 3 1HB TYR 3 26.422 20.924 -12.351 25 HD1 TYR 3 HD1 TYR 3 27.100 20.907 -9.939 26 HD2 TYR 3 HD2 TYR 3 30.123 21.086 -12.997 27 HE1 TYR 3 HE1 TYR 3 28.777 21.431 -8.285 28 HE2 TYR 3 HE2 TYR 3 31.756 21.685 -11.332 29 HH TYR 3 HH TYR 3 30.905 21.910 -7.881 30 H GLU 4 H GLU 4 28.242 18.982 -15.477 31 HA GLU 4 HA GLU 4 31.074 18.098 -14.731 32 1HB GLU 4 2HB GLU 4 29.866 16.065 -15.419 33 2HB GLU 4 1HB GLU 4 29.329 16.810 -16.918 34 1HG GLU 4 1HG GLU 4 31.701 16.890 -17.733 35 2HG GLU 4 2HG GLU 4 32.274 16.164 -16.245 36 HE2 GLU 4 HE2 GLU 4 31.165 13.905 -19.217 37 H TYR 5 H TYR 5 32.261 19.759 -15.409 38 HA TYR 5 HA TYR 5 31.731 20.989 -18.167 39 1HB TYR 5 2HB TYR 5 32.194 23.166 -17.647 40 2HB TYR 5 1HB TYR 5 30.830 22.557 -16.724 41 HD1 TYR 5 HD1 TYR 5 30.826 22.759 -14.243 42 HD2 TYR 5 HD2 TYR 5 34.305 23.925 -16.493 43 HE1 TYR 5 HE1 TYR 5 31.715 23.918 -12.307 44 HE2 TYR 5 HE2 TYR 5 35.142 25.093 -14.541 45 HH TYR 5 HH TYR 5 33.356 25.134 -11.479 46 H THR 6 H THR 6 33.384 20.418 -19.378 47 HA THR 6 HA THR 6 36.026 19.825 -18.174 48 HB THR 6 HB THR 6 35.191 19.497 -21.118 49 HG1 THR 6 HG1 THR 6 33.729 18.498 -19.706 50 1HG2 THR 6 1HG2 THR 6 37.637 19.026 -20.695 51 2HG2 THR 6 2HG2 THR 6 37.186 17.850 -19.431 52 3HG2 THR 6 3HG2 THR 6 36.746 17.539 -21.135 53 H VAL 7 H VAL 7 37.473 21.302 -17.997 54 HA VAL 7 HA VAL 7 37.926 23.459 -20.153 55 HB VAL 7 HB VAL 7 39.007 23.459 -17.305 56 1HG1 VAL 7 1HG2 VAL 7 40.633 24.517 -18.895 57 2HG1 VAL 7 2HG2 VAL 7 39.399 25.666 -19.443 58 3HG1 VAL 7 3HG2 VAL 7 39.999 25.716 -17.757 59 1HG2 VAL 7 1HG1 VAL 7 37.578 25.474 -16.843 60 2HG2 VAL 7 2HG1 VAL 7 36.927 25.424 -18.510 61 3HG2 VAL 7 3HG1 VAL 7 36.573 24.113 -17.369 62 HA DPR 8 HA PRO 8 41.828 21.487 -21.251 63 1HB DPR 8 2HB PRO 8 41.896 20.683 -23.516 64 2HB DPR 8 1HB PRO 8 40.292 19.911 -23.423 65 1HG DPR 8 2HG PRO 8 40.956 22.898 -23.388 66 2HG DPR 8 1HG PRO 8 39.804 22.022 -24.452 67 1HD DPR 8 2HD PRO 8 38.873 23.296 -22.202 68 2HD DPR 8 1HD PRO 8 38.229 21.679 -22.610 69 H SER 9 H SER 9 42.934 19.949 -20.778 70 HA SER 9 HA SER 9 42.359 17.134 -20.083 71 1HB SER 9 1HB SER 9 44.539 19.023 -18.975 72 2HB SER 9 2HB SER 9 44.552 17.273 -18.782 73 HG SER 9 HG SER 9 44.524 17.073 -21.059 74 H TYR 10 H TYR 10 40.908 19.688 -18.356 75 HA TYR 10 HA TYR 10 41.175 18.248 -15.668 76 1HB TYR 10 1HB TYR 10 42.665 20.405 -16.035 77 2HB TYR 10 2HB TYR 10 41.164 21.294 -15.924 78 HD1 TYR 10 HD1 TYR 10 39.955 21.399 -13.671 79 HD2 TYR 10 HD2 TYR 10 43.625 19.173 -14.077 80 HE1 TYR 10 HE1 TYR 10 40.192 21.292 -11.266 81 HE2 TYR 10 HE2 TYR 10 43.824 19.086 -11.681 82 HH TYR 10 HH TYR 10 42.940 19.651 -9.723 83 H THR 11 H THR 11 39.345 17.381 -16.033 84 HA THR 11 HA THR 11 36.810 18.637 -16.806 85 HB THR 11 HB THR 11 37.124 15.834 -15.619 86 HG1 THR 11 HG1 THR 11 38.575 16.241 -17.312 87 1HG2 THR 11 1HG2 THR 11 35.272 15.155 -17.148 88 2HG2 THR 11 2HG2 THR 11 34.705 16.459 -16.068 89 3HG2 THR 11 3HG2 THR 11 35.127 16.824 -17.760 90 H PHE 12 H PHE 12 35.403 19.821 -15.466 91 HA PHE 12 HA PHE 12 35.787 19.591 -12.446 92 1HB PHE 12 1HB PHE 12 34.376 21.662 -14.170 93 2HB PHE 12 2HB PHE 12 34.288 21.654 -12.435 94 HD1 PHE 12 HD1 PHE 12 36.565 22.332 -15.317 95 HD2 PHE 12 HD2 PHE 12 36.304 22.198 -11.017 96 HE1 PHE 12 HE1 PHE 12 38.585 23.667 -15.117 97 HE2 PHE 12 HE2 PHE 12 38.329 23.528 -10.871 98 HZ PHE 12 HZ PHE 12 39.483 24.273 -12.915 99 H ARG 13 H ARG 13 34.779 17.567 -12.237 100 HA ARG 13 HA ARG 13 31.783 17.417 -12.677 101 1HB ARG 13 2HB ARG 13 33.780 15.264 -11.722 102 2HB ARG 13 1HB ARG 13 32.035 15.013 -11.739 103 1HG ARG 13 1HG ARG 13 31.972 15.389 -14.209 104 2HG ARG 13 2HG ARG 13 33.729 15.604 -14.221 105 1HD ARG 13 1HD ARG 13 33.972 13.206 -13.346 106 2HD ARG 13 2HD ARG 13 32.204 13.039 -13.430 107 HE ARG 13 HE ARG 13 32.997 13.914 -16.035 108 1HH1 ARG 13 1HH1 ARG 13 33.744 10.973 -14.093 109 2HH1 ARG 13 2HH1 ARG 13 33.999 10.039 -15.652 110 1HH2 ARG 13 1HH2 ARG 13 33.318 12.729 -17.674 111 2HH2 ARG 13 2HH2 ARG 13 33.776 10.959 -17.516 112 H GLY 14 H GLY 14 30.433 17.664 -10.985 113 1HA GLY 14 1HA GLY 14 31.015 17.029 -8.167 114 2HA GLY 14 2HA GLY 14 31.167 18.766 -8.416 115 HA PRO 15 HA PRO 15 26.481 17.796 -8.157 116 1HB PRO 15 1HB PRO 15 25.691 17.664 -5.528 117 2HB PRO 15 2HB PRO 15 26.416 16.296 -6.396 118 1HG PRO 15 2HG PRO 15 27.783 18.199 -4.460 119 2HG PRO 15 1HG PRO 15 27.875 16.411 -4.499 120 1HD PRO 15 2HD PRO 15 29.777 18.135 -5.689 121 2HD PRO 15 1HD PRO 15 29.483 16.469 -6.253 122 H GLY 16 H GLY 16 24.851 19.286 -7.933 123 1HA GLY 16 2HA GLY 16 23.702 21.348 -7.544 124 2HA GLY 16 1HA GLY 16 24.921 21.736 -6.336 125 H CYS 17 H CYS 17 23.638 22.981 -9.041 126 HA CYS 17 HA CYS 17 25.906 23.543 -10.767 127 1HB CYS 17 2HB CYS 17 23.418 25.304 -10.840 128 2HB CYS 17 1HB CYS 17 24.501 24.836 -12.153 129 HA PRO 18 HA PRO 18 26.988 27.130 -7.909 130 1HB PRO 18 2HB PRO 18 29.598 26.737 -7.483 131 2HB PRO 18 1HB PRO 18 28.370 25.524 -7.041 132 1HG PRO 18 2HG PRO 18 30.293 25.463 -9.387 133 2HG PRO 18 1HG PRO 18 29.715 24.112 -8.376 134 1HD PRO 18 2HD PRO 18 28.631 25.047 -10.925 135 2HD PRO 18 1HD PRO 18 27.960 23.758 -9.908 136 H THR 19 H THR 19 29.526 27.185 -10.427 137 HA THR 19 HA THR 19 29.313 30.206 -10.581 138 HB THR 19 HB THR 19 31.689 29.950 -11.462 139 HG1 THR 19 HG1 THR 19 31.513 27.783 -12.037 140 1HG2 THR 19 1HG2 THR 19 32.866 29.587 -9.338 141 2HG2 THR 19 2HG2 THR 19 31.386 28.903 -8.608 142 3HG2 THR 19 3HG2 THR 19 31.429 30.618 -9.099 143 H VAL 20 H VAL 20 29.580 31.224 -12.578 144 HA VAL 20 HA VAL 20 29.727 29.843 -15.090 145 HB VAL 20 HB VAL 20 27.600 29.366 -14.881 146 1HG1 VAL 20 1HG1 VAL 20 25.516 30.787 -14.940 147 2HG1 VAL 20 2HG1 VAL 20 26.526 32.267 -14.989 148 3HG1 VAL 20 3HG1 VAL 20 26.531 31.222 -13.549 149 1HG2 VAL 20 1HG2 VAL 20 27.700 31.331 -17.229 150 2HG2 VAL 20 2HG2 VAL 20 28.399 29.695 -17.188 151 3HG2 VAL 20 3HG2 VAL 20 26.639 29.892 -17.120 152 H LYS 21 H LYS 21 31.235 30.886 -14.682 153 HA LYS 21 HA LYS 21 31.782 33.846 -15.252 154 1HB LYS 21 1HB LYS 21 33.815 31.551 -15.498 155 2HB LYS 21 2HB LYS 21 34.222 33.245 -15.578 156 1HG LYS 21 2HG LYS 21 33.221 31.804 -13.057 157 2HG LYS 21 1HG LYS 21 34.907 32.065 -13.486 158 1HD LYS 21 2HD LYS 21 34.537 34.577 -13.378 159 2HD LYS 21 1HD LYS 21 32.860 34.284 -12.907 160 1HE LYS 21 2HE LYS 21 33.637 33.106 -10.805 161 2HE LYS 21 1HE LYS 21 35.326 33.386 -11.272 162 1HZ LYS 21 1HZ LYS 21 33.306 35.526 -10.789 163 2HZ LYS 21 2HZ LYS 21 34.527 35.102 -9.761 164 3HZ LYS 21 3HZ LYS 21 34.878 35.787 -11.223 165 HA PRO 22 HA PRO 22 31.036 33.904 -19.489 166 1HB PRO 22 2HB PRO 22 33.218 35.894 -20.138 167 2HB PRO 22 1HB PRO 22 31.451 36.023 -20.304 168 1HG PRO 22 2HG PRO 22 32.662 37.285 -18.194 169 2HG PRO 22 1HG PRO 22 31.164 36.359 -17.876 170 1HD PRO 22 1HD PRO 22 34.052 35.356 -17.524 171 2HD PRO 22 2HD PRO 22 32.737 35.472 -16.326 172 H DAL 23 H ALA 23 31.381 32.088 -20.575 173 HA DAL 23 HA ALA 23 33.931 30.774 -20.951 174 1HB DAL 23 1HB ALA 23 34.096 30.578 -23.427 175 2HB DAL 23 2HB ALA 23 32.745 31.724 -23.632 176 3HB DAL 23 3HB ALA 23 34.281 32.276 -22.911 177 H ILE 24 H ILE 24 32.425 29.550 -19.586 178 HA ILE 24 HA ILE 24 31.529 27.247 -20.970 179 HB ILE 24 HB ILE 24 30.746 27.674 -18.107 180 1HG1 ILE 24 2HG1 ILE 24 33.558 26.460 -18.695 181 2HG1 ILE 24 1HG1 ILE 24 33.348 28.169 -18.453 182 1HG2 ILE 24 1HG2 ILE 24 29.874 25.570 -19.149 183 2HG2 ILE 24 2HG2 ILE 24 31.089 25.109 -17.933 184 3HG2 ILE 24 3HG2 ILE 24 31.517 25.100 -19.667 185 1HD1 ILE 24 1HD1 ILE 24 32.459 26.131 -16.396 186 2HD1 ILE 24 2HD1 ILE 24 32.378 27.900 -16.242 187 3HD1 ILE 24 3HD1 ILE 24 33.995 27.078 -16.343 188 H SER 25 H SER 25 29.611 26.406 -21.252 189 HA SER 25 HA SER 25 26.969 27.869 -20.722 190 1HB SER 25 1HB SER 25 27.603 28.077 -23.143 191 2HB SER 25 2HB SER 25 27.807 26.318 -23.260 192 HG SER 25 HG SER 25 25.426 27.693 -22.509 193 H LEU 26 H LEU 26 26.669 26.643 -18.868 194 HA LEU 26 HA LEU 26 27.697 23.962 -18.475 195 1HB LEU 26 1HB LEU 26 25.747 25.605 -16.785 196 2HB LEU 26 2HB LEU 26 26.209 24.004 -16.312 197 HG LEU 26 HG LEU 26 27.358 25.513 -14.961 198 1HD1 LEU 26 1HD2 LEU 26 29.450 24.271 -16.754 199 2HD1 LEU 26 2HD2 LEU 26 28.604 23.474 -15.413 200 3HD1 LEU 26 3HD2 LEU 26 29.712 24.823 -15.074 201 1HD2 LEU 26 1HD1 LEU 26 27.431 27.547 -16.431 202 2HD2 LEU 26 2HD1 LEU 26 28.786 26.835 -17.343 203 3HD2 LEU 26 3HD1 LEU 26 28.983 27.250 -15.620 204 H ARG 27 H ARG 27 26.671 22.013 -18.161 205 HA ARG 27 HA ARG 27 23.815 21.601 -19.167 206 1HB ARG 27 1HB ARG 27 26.238 19.902 -20.045 207 2HB ARG 27 2HB ARG 27 24.596 19.295 -20.084 208 1HG ARG 27 2HG ARG 27 23.891 21.069 -21.656 209 2HG ARG 27 1HG ARG 27 25.497 21.777 -21.654 210 1HD ARG 27 1HD ARG 27 24.959 18.873 -22.605 211 2HD ARG 27 2HD ARG 27 24.838 20.275 -23.659 212 HE ARG 27 HE ARG 27 27.426 20.589 -22.653 213 1HH1 ARG 27 1HH1 ARG 27 25.895 17.747 -24.252 214 2HH1 ARG 27 2HH1 ARG 27 27.545 17.234 -24.868 215 1HH2 ARG 27 2HH2 ARG 27 29.189 19.877 -23.417 216 2HH2 ARG 27 1HH2 ARG 27 29.260 18.349 -24.430 217 H CYS 28 H CYS 28 24.398 22.135 -16.769 218 HA CYS 28 HA CYS 28 25.035 20.327 -14.901 219 1HB CYS 28 2HB CYS 28 24.665 22.747 -14.517 220 2HB CYS 28 1HB CYS 28 22.911 22.494 -14.572 221 H GLU 29 H GLU 29 21.574 20.507 -15.951 222 HA GLU 29 HA GLU 29 21.116 17.747 -14.708 223 1HB GLU 29 1HB GLU 29 20.182 19.730 -13.245 224 2HB GLU 29 2HB GLU 29 19.080 20.068 -14.573 225 1HG GLU 29 2HG GLU 29 18.092 17.729 -14.268 226 2HG GLU 29 1HG GLU 29 19.213 17.453 -12.927 227 HE2 GLU 29 HE2 GLU 29 17.630 19.588 -10.691 Start of MODEL 21 1 1H SER 1 1H SER 1 21.100 16.616 -8.939 2 2H SER 1 2H SER 1 20.307 18.035 -8.647 3 3H SER 1 3H SER 1 21.583 17.591 -7.696 4 HA SER 1 HA SER 1 21.702 18.287 -10.583 5 1HB SER 1 1HB SER 1 22.677 19.816 -8.098 6 2HB SER 1 2HB SER 1 23.033 20.283 -9.770 7 HG SER 1 HG SER 1 21.205 21.330 -8.940 8 H LYS 2 H LYS 2 23.509 17.594 -11.552 9 HA LYS 2 HA LYS 2 26.038 16.929 -10.073 10 1HB LYS 2 1HB LYS 2 26.463 14.764 -10.936 11 2HB LYS 2 2HB LYS 2 25.063 14.791 -9.885 12 1HG LYS 2 2HG LYS 2 23.539 14.553 -11.899 13 2HG LYS 2 1HG LYS 2 24.947 14.525 -12.957 14 1HD LYS 2 1HD LYS 2 25.771 12.436 -11.831 15 2HD LYS 2 2HD LYS 2 24.396 12.439 -10.738 16 1HE LYS 2 2HE LYS 2 24.084 12.233 -13.819 17 2HE LYS 2 1HE LYS 2 24.344 10.847 -12.772 18 1HZ LYS 2 1HZ LYS 2 22.298 11.375 -11.577 19 2HZ LYS 2 2HZ LYS 2 22.001 11.172 -13.190 20 3HZ LYS 2 3HZ LYS 2 22.023 12.690 -12.538 21 H TYR 3 H TYR 3 26.839 18.676 -11.063 22 HA TYR 3 HA TYR 3 26.645 19.201 -13.977 23 1HB TYR 3 1HB TYR 3 27.651 21.299 -13.556 24 2HB TYR 3 2HB TYR 3 26.534 21.009 -12.266 25 HD1 TYR 3 HD1 TYR 3 27.373 20.838 -9.892 26 HD2 TYR 3 HD2 TYR 3 30.179 21.142 -13.138 27 HE1 TYR 3 HE1 TYR 3 29.202 21.156 -8.330 28 HE2 TYR 3 HE2 TYR 3 31.950 21.563 -11.559 29 HH TYR 3 HH TYR 3 31.348 21.564 -8.049 30 H GLU 4 H GLU 4 28.307 19.273 -15.498 31 HA GLU 4 HA GLU 4 31.085 18.189 -14.821 32 1HB GLU 4 2HB GLU 4 29.789 16.300 -15.771 33 2HB GLU 4 1HB GLU 4 29.353 17.244 -17.187 34 1HG GLU 4 2HG GLU 4 31.749 17.280 -17.905 35 2HG GLU 4 1HG GLU 4 32.229 16.400 -16.471 36 HE2 GLU 4 HE2 GLU 4 32.259 13.825 -18.774 37 H TYR 5 H TYR 5 32.476 19.708 -15.451 38 HA TYR 5 HA TYR 5 31.999 21.220 -18.068 39 1HB TYR 5 1HB TYR 5 32.721 23.319 -17.428 40 2HB TYR 5 2HB TYR 5 31.298 22.796 -16.593 41 HD1 TYR 5 HD1 TYR 5 31.225 22.788 -14.105 42 HD2 TYR 5 HD2 TYR 5 34.871 23.791 -16.157 43 HE1 TYR 5 HE1 TYR 5 32.083 23.837 -12.101 44 HE2 TYR 5 HE2 TYR 5 35.681 24.854 -14.136 45 HH TYR 5 HH TYR 5 35.289 25.359 -12.029 46 H THR 6 H THR 6 33.494 20.516 -19.350 47 HA THR 6 HA THR 6 36.228 19.765 -18.397 48 HB THR 6 HB THR 6 35.076 19.485 -21.234 49 HG1 THR 6 HG1 THR 6 34.392 17.444 -20.576 50 1HG2 THR 6 1HG2 THR 6 36.474 17.416 -21.367 51 2HG2 THR 6 2HG2 THR 6 37.090 17.709 -19.719 52 3HG2 THR 6 3HG2 THR 6 37.506 18.842 -21.036 53 H VAL 7 H VAL 7 37.411 21.465 -18.096 54 HA VAL 7 HA VAL 7 37.844 23.512 -20.349 55 HB VAL 7 HB VAL 7 37.939 24.033 -17.336 56 1HG1 VAL 7 1HG2 VAL 7 39.732 25.386 -18.460 57 2HG1 VAL 7 2HG2 VAL 7 38.495 26.435 -17.749 58 3HG1 VAL 7 3HG2 VAL 7 38.535 26.153 -19.518 59 1HG2 VAL 7 1HG1 VAL 7 35.593 24.035 -18.279 60 2HG2 VAL 7 2HG1 VAL 7 36.022 25.334 -19.403 61 3HG2 VAL 7 3HG1 VAL 7 36.029 25.626 -17.636 62 HA DPR 8 HA PRO 8 42.295 22.428 -19.665 63 1HB DPR 8 2HB PRO 8 42.900 23.574 -21.586 64 2HB DPR 8 1HB PRO 8 43.203 21.939 -22.221 65 1HG DPR 8 1HG PRO 8 41.538 23.552 -23.568 66 2HG DPR 8 2HG PRO 8 41.066 21.840 -23.283 67 1HD DPR 8 1HD PRO 8 40.045 24.326 -21.828 68 2HD DPR 8 2HD PRO 8 39.143 22.859 -22.295 69 H SER 9 H SER 9 43.554 20.565 -19.875 70 HA SER 9 HA SER 9 42.125 17.877 -20.088 71 1HB SER 9 1HB SER 9 44.532 18.064 -20.702 72 2HB SER 9 2HB SER 9 44.929 18.557 -19.040 73 HG SER 9 HG SER 9 43.656 16.142 -19.825 74 H TYR 10 H TYR 10 40.596 19.526 -18.443 75 HA TYR 10 HA TYR 10 40.692 18.033 -15.825 76 1HB TYR 10 2HB TYR 10 41.378 20.945 -16.060 77 2HB TYR 10 1HB TYR 10 39.926 20.780 -15.148 78 HD1 TYR 10 HD1 TYR 10 43.562 19.967 -15.164 79 HD2 TYR 10 HD2 TYR 10 39.899 19.587 -12.919 80 HE1 TYR 10 HE1 TYR 10 44.806 19.329 -13.188 81 HE2 TYR 10 HE2 TYR 10 41.183 18.955 -10.972 82 HH TYR 10 HH TYR 10 43.188 18.583 -10.117 83 H THR 11 H THR 11 39.025 16.998 -16.342 84 HA THR 11 HA THR 11 36.380 18.116 -17.266 85 HB THR 11 HB THR 11 36.987 15.272 -16.321 86 HG1 THR 11 HG1 THR 11 37.085 16.392 -18.921 87 1HG2 THR 11 1HG2 THR 11 34.510 15.718 -16.623 88 2HG2 THR 11 2HG2 THR 11 35.135 14.570 -17.843 89 3HG2 THR 11 3HG2 THR 11 34.825 16.266 -18.289 90 H PHE 12 H PHE 12 35.544 19.528 -15.690 91 HA PHE 12 HA PHE 12 35.987 18.946 -12.760 92 1HB PHE 12 1HB PHE 12 34.677 21.296 -14.179 93 2HB PHE 12 2HB PHE 12 34.707 21.143 -12.450 94 HD1 PHE 12 HD1 PHE 12 36.733 22.132 -15.353 95 HD2 PHE 12 HD2 PHE 12 36.928 21.182 -11.151 96 HE1 PHE 12 HE1 PHE 12 38.812 23.353 -15.144 97 HE2 PHE 12 HE2 PHE 12 39.016 22.396 -10.997 98 HZ PHE 12 HZ PHE 12 39.979 23.494 -12.982 99 H ARG 13 H ARG 13 34.768 17.018 -12.666 100 HA ARG 13 HA ARG 13 31.753 17.196 -12.887 101 1HB ARG 13 1HB ARG 13 33.563 14.785 -12.205 102 2HB ARG 13 2HB ARG 13 31.803 14.718 -12.141 103 1HG ARG 13 2HG ARG 13 31.680 15.284 -14.598 104 2HG ARG 13 1HG ARG 13 33.443 15.276 -14.675 105 1HD ARG 13 1HD ARG 13 33.444 12.829 -13.965 106 2HD ARG 13 2HD ARG 13 31.668 12.863 -13.926 107 HE ARG 13 HE ARG 13 32.376 13.794 -16.535 108 1HH1 ARG 13 1HH2 ARG 13 32.899 10.682 -14.795 109 2HH1 ARG 13 2HH2 ARG 13 32.932 9.812 -16.411 110 1HH2 ARG 13 2HH1 ARG 13 32.439 12.670 -18.249 111 2HH2 ARG 13 1HH1 ARG 13 32.692 10.853 -18.208 112 H GLY 14 H GLY 14 30.551 17.438 -11.076 113 1HA GLY 14 2HA GLY 14 31.256 16.544 -8.354 114 2HA GLY 14 1HA GLY 14 31.564 18.274 -8.506 115 HA PRO 15 HA PRO 15 26.805 17.694 -8.084 116 1HB PRO 15 1HB PRO 15 26.089 17.244 -5.463 117 2HB PRO 15 2HB PRO 15 26.589 15.955 -6.576 118 1HG PRO 15 2HG PRO 15 28.276 17.337 -4.455 119 2HG PRO 15 1HG PRO 15 28.120 15.580 -4.763 120 1HD PRO 15 1HD PRO 15 30.205 17.173 -5.787 121 2HD PRO 15 2HD PRO 15 29.624 15.701 -6.612 122 H GLY 16 H GLY 16 25.380 19.303 -7.556 123 1HA GLY 16 2HA GLY 16 24.509 21.377 -6.661 124 2HA GLY 16 1HA GLY 16 25.957 21.554 -5.680 125 H CYS 17 H CYS 17 24.367 22.793 -8.353 126 HA CYS 17 HA CYS 17 26.419 23.283 -10.256 127 1HB CYS 17 1HB CYS 17 23.885 23.491 -10.589 128 2HB CYS 17 2HB CYS 17 24.015 25.142 -9.935 129 HA PRO 18 HA PRO 18 28.400 26.722 -7.812 130 1HB PRO 18 2HB PRO 18 30.896 26.733 -8.809 131 2HB PRO 18 1HB PRO 18 30.192 25.262 -8.100 132 1HG PRO 18 1HG PRO 18 30.467 25.966 -11.066 133 2HG PRO 18 2HG PRO 18 30.907 24.432 -10.257 134 1HD PRO 18 2HD PRO 18 28.398 24.938 -11.529 135 2HD PRO 18 1HD PRO 18 28.640 23.709 -10.265 136 H THR 19 H THR 19 30.306 28.634 -9.432 137 HA THR 19 HA THR 19 28.313 30.665 -10.319 138 HB THR 19 HB THR 19 30.430 31.936 -10.951 139 HG1 THR 19 HG1 THR 19 32.362 31.157 -10.120 140 1HG2 THR 19 1HG2 THR 19 29.424 32.466 -8.756 141 2HG2 THR 19 2HG2 THR 19 30.378 31.164 -7.994 142 3HG2 THR 19 3HG2 THR 19 31.204 32.576 -8.707 143 H VAL 20 H VAL 20 28.476 31.600 -12.545 144 HA VAL 20 HA VAL 20 29.430 29.823 -14.702 145 HB VAL 20 HB VAL 20 27.511 28.775 -14.284 146 1HG1 VAL 20 1HG2 VAL 20 25.659 31.062 -15.244 147 2HG1 VAL 20 2HG2 VAL 20 25.123 29.427 -14.750 148 3HG1 VAL 20 3HG2 VAL 20 25.841 30.528 -13.555 149 1HG2 VAL 20 1HG1 VAL 20 27.236 29.925 -17.106 150 2HG2 VAL 20 2HG1 VAL 20 26.635 28.330 -16.566 151 3HG2 VAL 20 3HG1 VAL 20 28.375 28.661 -16.589 152 H LYS 21 H LYS 21 30.457 31.412 -14.407 153 HA LYS 21 HA LYS 21 30.165 34.165 -15.699 154 1HB LYS 21 2HB LYS 21 32.804 32.664 -15.193 155 2HB LYS 21 1HB LYS 21 32.706 34.334 -15.687 156 1HG LYS 21 2HG LYS 21 31.772 33.264 -12.963 157 2HG LYS 21 1HG LYS 21 33.361 33.937 -13.305 158 1HD LYS 21 2HD LYS 21 32.285 36.160 -13.901 159 2HD LYS 21 1HD LYS 21 30.704 35.472 -13.515 160 1HE LYS 21 2HE LYS 21 31.430 35.110 -11.116 161 2HE LYS 21 1HE LYS 21 33.024 35.790 -11.494 162 1HZ LYS 21 1HZ LYS 21 30.432 37.240 -11.775 163 2HZ LYS 21 2HZ LYS 21 31.540 37.466 -10.570 164 3HZ LYS 21 3HZ LYS 21 31.917 37.874 -12.126 165 HA PRO 22 HA PRO 22 30.085 33.205 -19.874 166 1HB PRO 22 1HB PRO 22 31.774 35.569 -20.755 167 2HB PRO 22 2HB PRO 22 30.084 35.156 -21.131 168 1HG PRO 22 1HG PRO 22 30.564 37.092 -19.253 169 2HG PRO 22 2HG PRO 22 29.327 35.853 -18.881 170 1HD PRO 22 1HD PRO 22 32.280 35.819 -18.021 171 2HD PRO 22 2HD PRO 22 30.803 35.775 -17.021 172 H DAL 23 H ALA 23 30.974 31.604 -20.972 173 HA DAL 23 HA ALA 23 33.766 30.778 -20.571 174 1HB DAL 23 1HB ALA 23 34.492 30.468 -22.932 175 2HB DAL 23 2HB ALA 23 33.010 31.270 -23.518 176 3HB DAL 23 3HB ALA 23 34.213 32.194 -22.579 177 H ILE 24 H ILE 24 32.110 29.439 -19.384 178 HA ILE 24 HA ILE 24 32.120 26.838 -20.501 179 HB ILE 24 HB ILE 24 30.408 27.477 -18.110 180 1HG1 ILE 24 1HG1 ILE 24 33.418 26.757 -17.751 181 2HG1 ILE 24 2HG1 ILE 24 32.854 28.405 -17.788 182 1HG2 ILE 24 1HG2 ILE 24 31.922 24.883 -18.861 183 2HG2 ILE 24 2HG2 ILE 24 30.158 25.148 -18.953 184 3HG2 ILE 24 3HG2 ILE 24 30.959 25.085 -17.378 185 1HD1 ILE 24 1HD1 ILE 24 31.352 28.053 -15.858 186 2HD1 ILE 24 2HD1 ILE 24 33.084 27.688 -15.457 187 3HD1 ILE 24 3HD1 ILE 24 31.901 26.362 -15.758 188 H SER 25 H SER 25 30.616 25.608 -21.197 189 HA SER 25 HA SER 25 27.749 26.480 -21.913 190 1HB SER 25 2HB SER 25 29.184 25.990 -23.921 191 2HB SER 25 1HB SER 25 29.602 24.400 -23.252 192 HG SER 25 HG SER 25 27.356 23.911 -23.246 193 H LEU 26 H LEU 26 27.391 26.107 -19.668 194 HA LEU 26 HA LEU 26 28.327 23.668 -18.291 195 1HB LEU 26 2HB LEU 26 28.304 26.046 -17.373 196 2HB LEU 26 1HB LEU 26 26.562 25.892 -17.243 197 HG LEU 26 HG LEU 26 26.973 24.029 -15.457 198 1HD1 LEU 26 1HD2 LEU 26 29.956 24.838 -15.506 199 2HD1 LEU 26 2HD2 LEU 26 29.163 23.671 -14.428 200 3HD1 LEU 26 3HD2 LEU 26 29.270 23.327 -16.164 201 1HD2 LEU 26 1HD1 LEU 26 27.634 25.646 -13.633 202 2HD2 LEU 26 2HD1 LEU 26 26.553 26.442 -14.794 203 3HD2 LEU 26 3HD1 LEU 26 28.296 26.757 -14.860 204 H ARG 27 H ARG 27 27.084 22.098 -17.254 205 HA ARG 27 HA ARG 27 24.234 21.631 -18.245 206 1HB ARG 27 2HB ARG 27 26.602 19.759 -18.895 207 2HB ARG 27 1HB ARG 27 24.942 19.197 -18.889 208 1HG ARG 27 1HG ARG 27 24.304 20.808 -20.649 209 2HG ARG 27 2HG ARG 27 25.930 21.466 -20.705 210 1HD ARG 27 2HD ARG 27 25.315 18.492 -21.343 211 2HD ARG 27 1HD ARG 27 25.244 19.773 -22.545 212 HE ARG 27 HE ARG 27 27.839 20.088 -21.487 213 1HH1 ARG 27 1HH1 ARG 27 26.209 17.269 -23.028 214 2HH1 ARG 27 2HH1 ARG 27 27.844 16.669 -23.604 215 1HH2 ARG 27 1HH2 ARG 27 29.580 19.281 -22.205 216 2HH2 ARG 27 2HH2 ARG 27 29.599 17.722 -23.173 217 H CYS 28 H CYS 28 24.793 22.379 -15.887 218 HA CYS 28 HA CYS 28 24.902 20.639 -13.792 219 1HB CYS 28 1HB CYS 28 23.162 23.144 -14.039 220 2HB CYS 28 2HB CYS 28 23.347 22.280 -12.506 221 H GLU 29 H GLU 29 21.782 21.061 -15.555 222 HA GLU 29 HA GLU 29 20.495 18.899 -13.818 223 1HB GLU 29 1HB GLU 29 19.346 21.210 -14.287 224 2HB GLU 29 2HB GLU 29 19.191 20.695 -15.962 225 1HG GLU 29 2HG GLU 29 17.748 18.741 -15.157 226 2HG GLU 29 1HG GLU 29 17.926 19.321 -13.496 227 HE2 GLU 29 HE2 GLU 29 17.108 21.178 -12.941 Start of MODEL 22 1 1H SER 1 1H SER 1 22.027 19.806 -11.366 2 2H SER 1 2H SER 1 22.821 20.533 -10.113 3 3H SER 1 3H SER 1 21.172 20.429 -10.097 4 HA SER 1 HA SER 1 22.098 18.852 -8.572 5 1HB SER 1 2HB SER 1 20.848 16.876 -9.327 6 2HB SER 1 1HB SER 1 19.943 18.364 -9.653 7 HG SER 1 HG SER 1 21.587 16.947 -11.492 8 H LYS 2 H LYS 2 23.396 18.155 -11.831 9 HA LYS 2 HA LYS 2 25.893 17.090 -10.574 10 1HB LYS 2 2HB LYS 2 26.132 15.006 -11.691 11 2HB LYS 2 1HB LYS 2 24.781 15.013 -10.576 12 1HG LYS 2 1HG LYS 2 23.162 15.108 -12.525 13 2HG LYS 2 2HG LYS 2 24.518 15.102 -13.650 14 1HD LYS 2 2HD LYS 2 25.233 12.848 -12.801 15 2HD LYS 2 1HD LYS 2 23.908 12.822 -11.648 16 1HE LYS 2 2HE LYS 2 23.454 12.989 -14.713 17 2HE LYS 2 1HE LYS 2 23.656 11.479 -13.841 18 1HZ LYS 2 1HZ LYS 2 21.327 12.009 -14.102 19 2HZ LYS 2 2HZ LYS 2 21.487 13.435 -13.285 20 3HZ LYS 2 3HZ LYS 2 21.706 12.001 -12.494 21 H TYR 3 H TYR 3 26.826 18.853 -11.408 22 HA TYR 3 HA TYR 3 26.682 19.595 -14.306 23 1HB TYR 3 1HB TYR 3 27.783 21.621 -13.740 24 2HB TYR 3 2HB TYR 3 26.609 21.333 -12.501 25 HD1 TYR 3 HD1 TYR 3 27.346 20.919 -10.127 26 HD2 TYR 3 HD2 TYR 3 30.282 21.331 -13.248 27 HE1 TYR 3 HE1 TYR 3 29.099 21.016 -8.490 28 HE2 TYR 3 HE2 TYR 3 32.008 21.505 -11.588 29 HH TYR 3 HH TYR 3 31.284 21.232 -8.103 30 H GLU 4 H GLU 4 28.414 19.711 -15.742 31 HA GLU 4 HA GLU 4 31.097 18.436 -15.044 32 1HB GLU 4 2HB GLU 4 29.730 16.678 -16.160 33 2HB GLU 4 1HB GLU 4 29.448 17.725 -17.545 34 1HG GLU 4 2HG GLU 4 31.886 17.657 -18.116 35 2HG GLU 4 1HG GLU 4 32.229 16.679 -16.698 36 HE2 GLU 4 HE2 GLU 4 30.956 16.875 -19.747 37 H TYR 5 H TYR 5 32.445 20.104 -15.353 38 HA TYR 5 HA TYR 5 32.103 21.885 -17.836 39 1HB TYR 5 2HB TYR 5 32.668 23.858 -16.913 40 2HB TYR 5 1HB TYR 5 31.310 23.167 -16.070 41 HD1 TYR 5 HD1 TYR 5 31.295 23.249 -13.633 42 HD2 TYR 5 HD2 TYR 5 34.980 23.992 -15.723 43 HE1 TYR 5 HE1 TYR 5 32.310 24.062 -11.591 44 HE2 TYR 5 HE2 TYR 5 35.940 24.847 -13.670 45 HH TYR 5 HH TYR 5 34.107 24.914 -10.637 46 H THR 6 H THR 6 33.616 21.247 -19.134 47 HA THR 6 HA THR 6 36.316 20.374 -18.159 48 HB THR 6 HB THR 6 35.179 20.249 -21.011 49 HG1 THR 6 HG1 THR 6 34.936 18.349 -18.927 50 1HG2 THR 6 1HG2 THR 6 36.572 18.190 -21.256 51 2HG2 THR 6 2HG2 THR 6 37.606 19.595 -20.852 52 3HG2 THR 6 3HG2 THR 6 37.192 18.394 -19.595 53 H VAL 7 H VAL 7 37.329 22.167 -17.643 54 HA VAL 7 HA VAL 7 37.830 24.344 -19.755 55 HB VAL 7 HB VAL 7 38.144 24.457 -16.713 56 1HG1 VAL 7 1HG1 VAL 7 38.937 26.787 -18.589 57 2HG1 VAL 7 2HG1 VAL 7 40.056 25.747 -17.690 58 3HG1 VAL 7 3HG1 VAL 7 38.956 26.810 -16.798 59 1HG2 VAL 7 1HG2 VAL 7 36.356 26.263 -18.499 60 2HG2 VAL 7 2HG2 VAL 7 36.413 26.250 -16.710 61 3HG2 VAL 7 3HG2 VAL 7 35.786 24.853 -17.603 62 HA DPR 8 HA PRO 8 42.224 22.919 -19.735 63 1HB DPR 8 1HB PRO 8 42.661 24.143 -21.649 64 2HB DPR 8 2HB PRO 8 42.761 22.540 -22.413 65 1HG DPR 8 2HG PRO 8 41.057 24.341 -23.431 66 2HG DPR 8 1HG PRO 8 40.502 22.649 -23.184 67 1HD DPR 8 2HD PRO 8 39.868 25.093 -21.460 68 2HD DPR 8 1HD PRO 8 38.802 23.730 -21.895 69 H SER 9 H SER 9 43.312 21.000 -20.211 70 HA SER 9 HA SER 9 41.692 18.420 -20.393 71 1HB SER 9 2HB SER 9 44.653 18.884 -19.708 72 2HB SER 9 1HB SER 9 43.877 17.306 -19.872 73 HG SER 9 HG SER 9 44.851 18.000 -21.799 74 H TYR 10 H TYR 10 40.513 20.074 -18.437 75 HA TYR 10 HA TYR 10 40.896 18.379 -15.965 76 1HB TYR 10 1HB TYR 10 41.949 21.057 -16.062 77 2HB TYR 10 2HB TYR 10 40.428 21.284 -15.274 78 HD1 TYR 10 HD1 TYR 10 39.999 20.190 -12.996 79 HD2 TYR 10 HD2 TYR 10 43.785 19.693 -15.000 80 HE1 TYR 10 HE1 TYR 10 41.010 19.375 -10.949 81 HE2 TYR 10 HE2 TYR 10 44.748 18.883 -12.935 82 HH TYR 10 HH TYR 10 42.827 18.619 -9.958 83 H THR 11 H THR 11 39.138 17.450 -16.354 84 HA THR 11 HA THR 11 36.505 18.660 -17.084 85 HB THR 11 HB THR 11 37.087 15.752 -16.338 86 HG1 THR 11 HG1 THR 11 37.195 17.049 -18.853 87 1HG2 THR 11 1HG2 THR 11 34.936 16.881 -18.243 88 2HG2 THR 11 2HG2 THR 11 34.612 16.228 -16.618 89 3HG2 THR 11 3HG2 THR 11 35.240 15.160 -17.905 90 H PHE 12 H PHE 12 35.543 19.900 -15.439 91 HA PHE 12 HA PHE 12 35.907 19.050 -12.543 92 1HB PHE 12 2HB PHE 12 34.711 21.550 -13.768 93 2HB PHE 12 1HB PHE 12 34.721 21.240 -12.057 94 HD1 PHE 12 HD1 PHE 12 36.896 22.154 -14.949 95 HD2 PHE 12 HD2 PHE 12 36.870 21.296 -10.723 96 HE1 PHE 12 HE1 PHE 12 39.086 23.159 -14.704 97 HE2 PHE 12 HE2 PHE 12 39.063 22.310 -10.528 98 HZ PHE 12 HZ PHE 12 40.190 23.249 -12.507 99 H ARG 13 H ARG 13 34.643 17.191 -12.594 100 HA ARG 13 HA ARG 13 31.657 17.433 -13.019 101 1HB ARG 13 2HB ARG 13 33.441 14.985 -12.388 102 2HB ARG 13 1HB ARG 13 31.684 14.885 -12.404 103 1HG ARG 13 2HG ARG 13 31.638 15.616 -14.810 104 2HG ARG 13 1HG ARG 13 33.394 15.663 -14.800 105 1HD ARG 13 2HD ARG 13 32.894 13.617 -15.845 106 2HD ARG 13 1HD ARG 13 33.380 13.124 -14.225 107 HE ARG 13 HE ARG 13 30.411 13.473 -14.625 108 1HH1 ARG 13 1HH2 ARG 13 33.048 11.019 -14.657 109 2HH1 ARG 13 2HH2 ARG 13 31.787 9.696 -14.500 110 1HH2 ARG 13 1HH1 ARG 13 29.135 11.877 -14.450 111 2HH2 ARG 13 2HH1 ARG 13 29.747 10.148 -14.392 112 H GLY 14 H GLY 14 30.313 17.591 -11.325 113 1HA GLY 14 2HA GLY 14 30.698 16.475 -8.647 114 2HA GLY 14 1HA GLY 14 31.127 18.183 -8.596 115 HA PRO 15 HA PRO 15 26.347 17.926 -8.519 116 1HB PRO 15 2HB PRO 15 25.506 17.776 -5.908 117 2HB PRO 15 1HB PRO 15 26.048 16.367 -6.841 118 1HG PRO 15 1HG PRO 15 27.638 17.967 -4.805 119 2HG PRO 15 2HG PRO 15 27.479 16.186 -4.927 120 1HD PRO 15 1HD PRO 15 29.625 17.673 -6.015 121 2HD PRO 15 2HD PRO 15 29.101 16.100 -6.672 122 H GLY 16 H GLY 16 24.976 19.618 -8.293 123 1HA GLY 16 1HA GLY 16 24.083 21.787 -7.796 124 2HA GLY 16 2HA GLY 16 25.276 21.923 -6.510 125 H CYS 17 H CYS 17 24.296 23.599 -9.052 126 HA CYS 17 HA CYS 17 26.613 23.955 -10.740 127 1HB CYS 17 2HB CYS 17 24.677 26.282 -10.704 128 2HB CYS 17 1HB CYS 17 25.447 25.435 -12.040 129 HA PRO 18 HA PRO 18 28.436 26.865 -7.533 130 1HB PRO 18 1HB PRO 18 31.026 26.200 -7.508 131 2HB PRO 18 2HB PRO 18 29.743 25.038 -7.082 132 1HG PRO 18 1HG PRO 18 31.297 25.231 -9.692 133 2HG PRO 18 2HG PRO 18 30.846 23.768 -8.777 134 1HD PRO 18 1HD PRO 18 29.406 24.923 -10.983 135 2HD PRO 18 2HD PRO 18 28.746 23.704 -9.874 136 H THR 19 H THR 19 30.917 27.186 -10.098 137 HA THR 19 HA THR 19 30.429 30.163 -10.238 138 HB THR 19 HB THR 19 32.492 30.062 -11.745 139 HG1 THR 19 HG1 THR 19 32.353 27.864 -12.210 140 1HG2 THR 19 1HG2 THR 19 33.015 29.122 -8.892 141 2HG2 THR 19 2HG2 THR 19 34.200 29.881 -9.999 142 3HG2 THR 19 3HG2 THR 19 32.787 30.810 -9.425 143 H VAL 20 H VAL 20 29.811 31.114 -12.087 144 HA VAL 20 HA VAL 20 29.075 29.514 -14.584 145 HB VAL 20 HB VAL 20 27.132 31.273 -13.241 146 1HG1 VAL 20 1HG1 VAL 20 26.526 29.420 -15.671 147 2HG1 VAL 20 2HG1 VAL 20 26.750 31.176 -15.737 148 3HG1 VAL 20 3HG1 VAL 20 25.331 30.516 -14.912 149 1HG2 VAL 20 1HG2 VAL 20 27.195 29.129 -11.909 150 2HG2 VAL 20 2HG2 VAL 20 26.780 28.175 -13.341 151 3HG2 VAL 20 3HG2 VAL 20 25.588 29.309 -12.634 152 H LYS 21 H LYS 21 30.940 30.860 -14.354 153 HA LYS 21 HA LYS 21 31.132 33.664 -15.259 154 1HB LYS 21 1HB LYS 21 33.232 31.450 -15.660 155 2HB LYS 21 2HB LYS 21 33.546 33.112 -16.097 156 1HG LYS 21 2HG LYS 21 32.887 32.264 -13.237 157 2HG LYS 21 1HG LYS 21 34.512 32.274 -13.873 158 1HD LYS 21 1HD LYS 21 32.770 34.802 -13.764 159 2HD LYS 21 2HD LYS 21 33.717 34.270 -12.396 160 1HE LYS 21 1HE LYS 21 35.003 34.938 -15.118 161 2HE LYS 21 2HE LYS 21 34.713 36.145 -13.865 162 1HZ LYS 21 1HZ LYS 21 36.139 34.875 -12.354 163 2HZ LYS 21 2HZ LYS 21 36.959 35.285 -13.728 164 3HZ LYS 21 3HZ LYS 21 36.427 33.736 -13.516 165 HA PRO 22 HA PRO 22 29.703 33.685 -19.323 166 1HB PRO 22 1HB PRO 22 31.497 35.909 -20.254 167 2HB PRO 22 2HB PRO 22 29.728 35.850 -20.066 168 1HG PRO 22 2HG PRO 22 31.213 37.191 -18.193 169 2HG PRO 22 1HG PRO 22 29.892 36.122 -17.633 170 1HD PRO 22 2HD PRO 22 32.872 35.377 -17.871 171 2HD PRO 22 1HD PRO 22 31.814 35.355 -16.438 172 H DAL 23 H ALA 23 30.159 31.800 -20.256 173 HA DAL 23 HA ALA 23 32.652 31.413 -21.991 174 1HB DAL 23 1HB ALA 23 30.721 32.195 -23.401 175 2HB DAL 23 2HB ALA 23 31.236 30.549 -23.838 176 3HB DAL 23 3HB ALA 23 29.766 30.791 -22.856 177 H ILE 24 H ILE 24 30.419 29.648 -19.845 178 HA ILE 24 HA ILE 24 31.896 27.099 -20.456 179 HB ILE 24 HB ILE 24 29.872 27.465 -18.252 180 1HG1 ILE 24 2HG1 ILE 24 32.947 27.503 -17.745 181 2HG1 ILE 24 1HG1 ILE 24 32.017 28.970 -17.927 182 1HG2 ILE 24 1HG2 ILE 24 31.880 25.209 -18.814 183 2HG2 ILE 24 2HG2 ILE 24 31.001 25.336 -17.274 184 3HG2 ILE 24 3HG2 ILE 24 30.091 25.139 -18.790 185 1HD1 ILE 24 1HD1 ILE 24 32.318 28.510 -15.539 186 2HD1 ILE 24 2HD1 ILE 24 31.518 26.913 -15.744 187 3HD1 ILE 24 3HD1 ILE 24 30.566 28.396 -15.991 188 H SER 25 H SER 25 30.841 25.467 -21.137 189 HA SER 25 HA SER 25 27.994 25.523 -22.319 190 1HB SER 25 2HB SER 25 29.820 25.067 -23.975 191 2HB SER 25 1HB SER 25 30.425 23.735 -22.970 192 HG SER 25 HG SER 25 27.812 23.953 -24.083 193 H LEU 26 H LEU 26 27.388 25.470 -20.082 194 HA LEU 26 HA LEU 26 28.425 23.442 -18.208 195 1HB LEU 26 1HB LEU 26 27.766 25.971 -17.774 196 2HB LEU 26 2HB LEU 26 26.135 25.384 -17.702 197 HG LEU 26 HG LEU 26 26.965 23.874 -15.641 198 1HD1 LEU 26 1HD2 LEU 26 29.401 23.962 -16.153 199 2HD1 LEU 26 2HD2 LEU 26 29.473 25.677 -15.720 200 3HD1 LEU 26 3HD2 LEU 26 29.056 24.458 -14.482 201 1HD2 LEU 26 1HD1 LEU 26 26.864 25.827 -14.040 202 2HD2 LEU 26 2HD1 LEU 26 25.680 26.045 -15.343 203 3HD2 LEU 26 3HD1 LEU 26 27.202 26.956 -15.380 204 H ARG 27 H ARG 27 27.273 21.825 -17.146 205 HA ARG 27 HA ARG 27 24.618 20.898 -18.366 206 1HB ARG 27 1HB ARG 27 27.197 19.198 -18.304 207 2HB ARG 27 2HB ARG 27 25.605 18.475 -18.411 208 1HG ARG 27 1HG ARG 27 25.129 19.691 -20.554 209 2HG ARG 27 2HG ARG 27 26.714 20.440 -20.464 210 1HD ARG 27 1HD ARG 27 27.030 18.692 -22.009 211 2HD ARG 27 2HD ARG 27 27.758 18.040 -20.547 212 HE ARG 27 HE ARG 27 24.898 17.238 -20.863 213 1HH1 ARG 27 1HH1 ARG 27 28.212 16.248 -21.868 214 2HH1 ARG 27 2HH1 ARG 27 27.584 14.552 -22.182 215 1HH2 ARG 27 1HH2 ARG 27 24.362 15.302 -21.262 216 2HH2 ARG 27 2HH2 ARG 27 25.575 14.064 -21.865 217 H CYS 28 H CYS 28 24.831 22.135 -16.133 218 HA CYS 28 HA CYS 28 24.860 20.759 -13.776 219 1HB CYS 28 1HB CYS 28 24.718 23.267 -14.055 220 2HB CYS 28 2HB CYS 28 22.956 23.088 -14.216 221 H GLU 29 H GLU 29 21.758 21.068 -15.620 222 HA GLU 29 HA GLU 29 20.412 19.145 -13.661 223 1HB GLU 29 2HB GLU 29 19.326 21.392 -14.345 224 2HB GLU 29 1HB GLU 29 19.159 20.766 -15.972 225 1HG GLU 29 2HG GLU 29 17.884 19.450 -13.476 226 2HG GLU 29 1HG GLU 29 17.115 20.751 -14.382 227 HE2 GLU 29 HE2 GLU 29 17.119 16.977 -15.730 Start of MODEL 23 1 1H SER 1 1H SER 1 20.197 17.261 -9.024 2 2H SER 1 2H SER 1 21.115 15.936 -9.387 3 3H SER 1 3H SER 1 21.440 16.819 -8.029 4 HA SER 1 HA SER 1 21.687 17.798 -10.823 5 1HB SER 1 2HB SER 1 21.030 19.565 -9.186 6 2HB SER 1 1HB SER 1 22.407 19.142 -8.152 7 HG SER 1 HG SER 1 22.524 20.013 -10.857 8 H LYS 2 H LYS 2 23.599 17.312 -11.724 9 HA LYS 2 HA LYS 2 26.110 16.764 -10.180 10 1HB LYS 2 2HB LYS 2 24.910 14.546 -11.954 11 2HB LYS 2 1HB LYS 2 26.623 14.637 -11.569 12 1HG LYS 2 1HG LYS 2 26.145 14.433 -9.141 13 2HG LYS 2 2HG LYS 2 24.421 14.339 -9.441 14 1HD LYS 2 1HD LYS 2 26.428 12.283 -10.591 15 2HD LYS 2 2HD LYS 2 25.790 12.151 -8.977 16 1HE LYS 2 1HE LYS 2 23.949 12.184 -11.445 17 2HE LYS 2 2HE LYS 2 24.683 10.713 -10.807 18 1HZ LYS 2 1HZ LYS 2 22.459 11.017 -9.930 19 2HZ LYS 2 2HZ LYS 2 22.847 12.479 -9.267 20 3HZ LYS 2 3HZ LYS 2 23.546 11.099 -8.689 21 H TYR 3 H TYR 3 26.889 18.504 -11.139 22 HA TYR 3 HA TYR 3 26.638 19.102 -14.057 23 1HB TYR 3 2HB TYR 3 27.572 21.241 -13.607 24 2HB TYR 3 1HB TYR 3 26.444 20.897 -12.347 25 HD1 TYR 3 HD1 TYR 3 30.128 21.056 -13.126 26 HD2 TYR 3 HD2 TYR 3 27.206 20.910 -9.977 27 HE1 TYR 3 HE1 TYR 3 31.831 21.593 -11.516 28 HE2 TYR 3 HE2 TYR 3 28.949 21.382 -8.373 29 HH TYR 3 HH TYR 3 32.323 21.909 -9.369 30 H GLU 4 H GLU 4 28.254 19.090 -15.585 31 HA GLU 4 HA GLU 4 31.090 18.199 -14.880 32 1HB GLU 4 2HB GLU 4 29.882 16.177 -15.611 33 2HB GLU 4 1HB GLU 4 29.391 16.945 -17.116 34 1HG GLU 4 2HG GLU 4 31.748 17.000 -17.907 35 2HG GLU 4 1HG GLU 4 32.334 16.367 -16.378 36 HE2 GLU 4 HE2 GLU 4 30.422 14.034 -19.098 37 H TYR 5 H TYR 5 32.366 19.738 -15.638 38 HA TYR 5 HA TYR 5 31.832 20.978 -18.380 39 1HB TYR 5 1HB TYR 5 32.394 23.171 -17.902 40 2HB TYR 5 2HB TYR 5 31.002 22.611 -16.999 41 HD1 TYR 5 HD1 TYR 5 34.350 24.141 -16.717 42 HD2 TYR 5 HD2 TYR 5 31.087 22.482 -14.459 43 HE1 TYR 5 HE1 TYR 5 35.137 25.259 -14.714 44 HE2 TYR 5 HE2 TYR 5 31.898 23.634 -12.482 45 HH TYR 5 HH TYR 5 34.811 25.654 -12.572 46 H THR 6 H THR 6 33.468 20.355 -19.597 47 HA THR 6 HA THR 6 36.126 19.783 -18.407 48 HB THR 6 HB THR 6 35.277 19.403 -21.343 49 HG1 THR 6 HG1 THR 6 34.667 17.333 -20.702 50 1HG2 THR 6 1HG2 THR 6 37.720 18.931 -20.905 51 2HG2 THR 6 2HG2 THR 6 37.259 17.776 -19.624 52 3HG2 THR 6 3HG2 THR 6 36.823 17.440 -21.324 53 H VAL 7 H VAL 7 37.524 21.301 -18.233 54 HA VAL 7 HA VAL 7 37.934 23.452 -20.398 55 HB VAL 7 HB VAL 7 38.968 23.507 -17.533 56 1HG1 VAL 7 1HG2 VAL 7 39.880 25.798 -17.981 57 2HG1 VAL 7 2HG2 VAL 7 40.578 24.621 -19.104 58 3HG1 VAL 7 3HG2 VAL 7 39.309 25.719 -19.676 59 1HG2 VAL 7 1HG1 VAL 7 36.513 24.068 -17.639 60 2HG2 VAL 7 2HG1 VAL 7 36.834 25.387 -18.779 61 3HG2 VAL 7 3HG1 VAL 7 37.457 25.467 -17.102 62 HA DPR 8 HA PRO 8 41.931 21.596 -21.396 63 1HB DPR 8 1HB PRO 8 42.089 20.858 -23.676 64 2HB DPR 8 2HB PRO 8 40.503 20.045 -23.657 65 1HG DPR 8 1HG PRO 8 41.089 23.044 -23.535 66 2HG DPR 8 2HG PRO 8 39.996 22.163 -24.654 67 1HD DPR 8 1HD PRO 8 38.953 23.365 -22.417 68 2HD DPR 8 2HD PRO 8 38.372 21.735 -22.868 69 H SER 9 H SER 9 43.051 20.029 -20.969 70 HA SER 9 HA SER 9 42.443 17.208 -20.330 71 1HB SER 9 1HB SER 9 44.646 19.050 -19.190 72 2HB SER 9 2HB SER 9 44.636 17.297 -19.026 73 HG SER 9 HG SER 9 44.626 18.725 -21.480 74 H TYR 10 H TYR 10 40.951 19.701 -18.577 75 HA TYR 10 HA TYR 10 41.228 18.231 -15.908 76 1HB TYR 10 1HB TYR 10 42.690 20.424 -16.239 77 2HB TYR 10 2HB TYR 10 41.175 21.282 -16.096 78 HD1 TYR 10 HD1 TYR 10 43.685 19.158 -14.320 79 HD2 TYR 10 HD2 TYR 10 39.978 21.304 -13.832 80 HE1 TYR 10 HE1 TYR 10 43.900 19.008 -11.928 81 HE2 TYR 10 HE2 TYR 10 40.231 21.134 -11.433 82 HH TYR 10 HH TYR 10 43.017 19.502 -9.950 83 H THR 11 H THR 11 39.411 17.351 -16.272 84 HA THR 11 HA THR 11 36.860 18.578 -17.032 85 HB THR 11 HB THR 11 37.178 15.791 -15.812 86 HG1 THR 11 HG1 THR 11 38.623 16.172 -17.515 87 1HG2 THR 11 1HG2 THR 11 35.178 16.743 -17.970 88 2HG2 THR 11 2HG2 THR 11 34.755 16.447 -16.268 89 3HG2 THR 11 3HG2 THR 11 35.304 15.096 -17.298 90 H PHE 12 H PHE 12 35.497 19.794 -15.700 91 HA PHE 12 HA PHE 12 35.861 19.587 -12.678 92 1HB PHE 12 1HB PHE 12 34.497 21.672 -14.438 93 2HB PHE 12 2HB PHE 12 34.374 21.665 -12.705 94 HD1 PHE 12 HD1 PHE 12 36.378 22.169 -11.252 95 HD2 PHE 12 HD2 PHE 12 36.698 22.327 -15.547 96 HE1 PHE 12 HE1 PHE 12 38.406 23.487 -11.068 97 HE2 PHE 12 HE2 PHE 12 38.721 23.650 -15.312 98 HZ PHE 12 HZ PHE 12 39.595 24.237 -13.093 99 H ARG 13 H ARG 13 34.859 17.534 -12.534 100 HA ARG 13 HA ARG 13 31.849 17.426 -12.871 101 1HB ARG 13 2HB ARG 13 33.890 15.262 -12.009 102 2HB ARG 13 1HB ARG 13 32.152 14.996 -11.927 103 1HG ARG 13 1HG ARG 13 31.952 15.395 -14.405 104 2HG ARG 13 2HG ARG 13 33.697 15.595 -14.480 105 1HD ARG 13 2HD ARG 13 33.352 13.396 -15.231 106 2HD ARG 13 1HD ARG 13 33.936 13.166 -13.584 107 HE ARG 13 HE ARG 13 30.932 13.192 -13.940 108 1HH1 ARG 13 1HH2 ARG 13 33.788 11.023 -13.605 109 2HH1 ARG 13 2HH2 ARG 13 32.658 9.635 -13.202 110 1HH2 ARG 13 2HH1 ARG 13 29.812 11.538 -13.471 111 2HH2 ARG 13 1HH1 ARG 13 30.585 9.909 -13.134 112 H GLY 14 H GLY 14 30.558 17.657 -11.126 113 1HA GLY 14 2HA GLY 14 31.273 17.058 -8.318 114 2HA GLY 14 1HA GLY 14 31.358 18.794 -8.606 115 HA PRO 15 HA PRO 15 26.712 17.662 -8.188 116 1HB PRO 15 1HB PRO 15 26.010 17.411 -5.538 117 2HB PRO 15 2HB PRO 15 26.708 16.087 -6.493 118 1HG PRO 15 2HG PRO 15 28.139 17.912 -4.525 119 2HG PRO 15 1HG PRO 15 28.235 16.128 -4.643 120 1HD PRO 15 1HD PRO 15 30.093 17.897 -5.822 121 2HD PRO 15 2HD PRO 15 29.766 16.265 -6.464 122 H GLY 16 H GLY 16 25.066 19.118 -7.830 123 1HA GLY 16 1HA GLY 16 23.916 21.143 -7.286 124 2HA GLY 16 2HA GLY 16 25.212 21.531 -6.161 125 H CYS 17 H CYS 17 23.723 22.795 -8.739 126 HA CYS 17 HA CYS 17 25.854 23.435 -10.621 127 1HB CYS 17 2HB CYS 17 23.272 25.080 -10.383 128 2HB CYS 17 1HB CYS 17 24.274 24.809 -11.812 129 HA PRO 18 HA PRO 18 27.077 26.926 -7.712 130 1HB PRO 18 1HB PRO 18 29.744 26.808 -7.714 131 2HB PRO 18 2HB PRO 18 28.733 25.440 -7.185 132 1HG PRO 18 1HG PRO 18 30.182 25.772 -9.842 133 2HG PRO 18 2HG PRO 18 30.056 24.311 -8.825 134 1HD PRO 18 2HD PRO 18 28.371 24.996 -11.054 135 2HD PRO 18 1HD PRO 18 28.009 23.742 -9.847 136 H THR 19 H THR 19 29.197 27.440 -10.553 137 HA THR 19 HA THR 19 28.381 30.374 -10.647 138 HB THR 19 HB THR 19 30.831 30.650 -11.321 139 HG1 THR 19 HG1 THR 19 32.248 29.041 -10.682 140 1HG2 THR 19 1HG2 THR 19 30.493 29.679 -8.444 141 2HG2 THR 19 2HG2 THR 19 31.843 30.661 -9.081 142 3HG2 THR 19 3HG2 THR 19 30.191 31.336 -9.036 143 H VAL 20 H VAL 20 28.776 31.457 -12.773 144 HA VAL 20 HA VAL 20 29.306 29.921 -15.116 145 HB VAL 20 HB VAL 20 27.618 30.827 -16.409 146 1HG1 VAL 20 1HG1 VAL 20 27.617 28.399 -15.962 147 2HG1 VAL 20 2HG1 VAL 20 26.453 28.623 -14.634 148 3HG1 VAL 20 3HG1 VAL 20 25.971 28.930 -16.328 149 1HG2 VAL 20 1HG2 VAL 20 25.241 31.366 -15.815 150 2HG2 VAL 20 2HG2 VAL 20 25.626 31.137 -14.082 151 3HG2 VAL 20 3HG2 VAL 20 26.365 32.473 -14.995 152 H LYS 21 H LYS 21 30.870 31.112 -14.522 153 HA LYS 21 HA LYS 21 31.206 34.060 -15.217 154 1HB LYS 21 1HB LYS 21 33.414 31.924 -15.014 155 2HB LYS 21 2HB LYS 21 33.713 33.633 -15.196 156 1HG LYS 21 1HG LYS 21 32.478 32.344 -12.692 157 2HG LYS 21 2HG LYS 21 34.185 32.689 -12.922 158 1HD LYS 21 1HD LYS 21 33.629 35.176 -13.120 159 2HD LYS 21 2HD LYS 21 31.947 34.765 -12.820 160 1HE LYS 21 1HE LYS 21 32.696 35.518 -10.722 161 2HE LYS 21 2HE LYS 21 32.682 33.773 -10.516 162 1HZ LYS 21 1HZ LYS 21 35.117 33.803 -10.922 163 2HZ LYS 21 2HZ LYS 21 34.711 34.770 -9.646 164 3HZ LYS 21 3HZ LYS 21 35.093 35.444 -11.106 165 HA PRO 22 HA PRO 22 31.009 33.812 -19.498 166 1HB PRO 22 2HB PRO 22 33.170 35.872 -20.010 167 2HB PRO 22 1HB PRO 22 31.439 35.890 -20.421 168 1HG PRO 22 2HG PRO 22 32.279 37.358 -18.266 169 2HG PRO 22 1HG PRO 22 30.803 36.365 -18.079 170 1HD PRO 22 2HD PRO 22 33.664 35.572 -17.278 171 2HD PRO 22 1HD PRO 22 32.192 35.682 -16.277 172 H DAL 23 H ALA 23 31.561 32.007 -20.501 173 HA DAL 23 HA ALA 23 34.148 30.732 -20.393 174 1HB DAL 23 1HB ALA 23 33.456 31.583 -23.273 175 2HB DAL 23 2HB ALA 23 34.830 32.182 -22.305 176 3HB DAL 23 3HB ALA 23 34.762 30.467 -22.792 177 H ILE 24 H ILE 24 32.427 29.512 -19.281 178 HA ILE 24 HA ILE 24 31.878 27.148 -20.709 179 HB ILE 24 HB ILE 24 30.479 27.655 -18.103 180 1HG1 ILE 24 1HG1 ILE 24 33.381 26.543 -18.069 181 2HG1 ILE 24 2HG1 ILE 24 33.034 28.241 -17.865 182 1HG2 ILE 24 1HG2 ILE 24 31.475 25.066 -19.489 183 2HG2 ILE 24 2HG2 ILE 24 30.950 25.049 -17.803 184 3HG2 ILE 24 3HG2 ILE 24 29.799 25.533 -19.066 185 1HD1 ILE 24 1HD1 ILE 24 31.597 27.825 -15.896 186 2HD1 ILE 24 2HD1 ILE 24 31.917 26.082 -16.046 187 3HD1 ILE 24 3HD1 ILE 24 33.282 27.193 -15.656 188 H SER 25 H SER 25 30.136 26.262 -21.395 189 HA SER 25 HA SER 25 27.388 27.632 -21.613 190 1HB SER 25 2HB SER 25 28.531 27.352 -23.840 191 2HB SER 25 1HB SER 25 28.767 25.623 -23.516 192 HG SER 25 HG SER 25 26.485 25.438 -23.316 193 H LEU 26 H LEU 26 27.055 26.873 -19.485 194 HA LEU 26 HA LEU 26 27.931 24.231 -18.586 195 1HB LEU 26 2HB LEU 26 27.803 26.497 -17.246 196 2HB LEU 26 1HB LEU 26 26.135 26.086 -16.980 197 HG LEU 26 HG LEU 26 27.007 23.922 -15.726 198 1HD1 LEU 26 1HD1 LEU 26 29.282 23.826 -16.815 199 2HD1 LEU 26 2HD1 LEU 26 29.804 25.245 -15.906 200 3HD1 LEU 26 3HD1 LEU 26 29.368 23.744 -15.039 201 1HD2 LEU 26 1HD2 LEU 26 27.989 26.626 -14.625 202 2HD2 LEU 26 2HD2 LEU 26 26.338 26.000 -14.475 203 3HD2 LEU 26 3HD2 LEU 26 27.674 25.166 -13.650 204 H ARG 27 H ARG 27 26.784 22.398 -18.125 205 HA ARG 27 HA ARG 27 23.877 22.218 -18.961 206 1HB ARG 27 1HB ARG 27 24.195 20.420 -20.401 207 2HB ARG 27 2HB ARG 27 25.265 21.709 -20.919 208 1HG ARG 27 1HG ARG 27 27.245 20.406 -19.958 209 2HG ARG 27 2HG ARG 27 26.131 19.135 -19.485 210 1HD ARG 27 2HD ARG 27 27.076 18.317 -21.475 211 2HD ARG 27 1HD ARG 27 25.494 18.872 -22.007 212 HE ARG 27 HE ARG 27 27.259 21.087 -22.471 213 1HH1 ARG 27 2HH2 ARG 27 27.199 17.699 -23.693 214 2HH1 ARG 27 1HH2 ARG 27 28.066 18.256 -25.211 215 1HH2 ARG 27 2HH1 ARG 27 28.222 21.541 -24.222 216 2HH2 ARG 27 1HH1 ARG 27 28.597 20.261 -25.482 217 H CYS 28 H CYS 28 24.596 22.464 -16.534 218 HA CYS 28 HA CYS 28 25.114 20.565 -14.787 219 1HB CYS 28 2HB CYS 28 24.500 22.951 -14.244 220 2HB CYS 28 1HB CYS 28 22.787 22.495 -14.317 221 H GLU 29 H GLU 29 21.750 20.546 -16.081 222 HA GLU 29 HA GLU 29 21.085 18.056 -14.424 223 1HB GLU 29 1HB GLU 29 19.309 19.881 -16.142 224 2HB GLU 29 2HB GLU 29 18.726 18.365 -15.498 225 1HG GLU 29 2HG GLU 29 19.729 20.633 -13.683 226 2HG GLU 29 1HG GLU 29 18.063 20.480 -14.234 227 HE2 GLU 29 HE2 GLU 29 16.819 19.066 -13.501 Start of MODEL 24 1 1H SER 1 1H SER 1 19.844 18.635 -9.554 2 2H SER 1 2H SER 1 20.905 17.926 -8.505 3 3H SER 1 3H SER 1 20.538 17.185 -9.935 4 HA SER 1 HA SER 1 21.539 18.979 -11.205 5 1HB SER 1 1HB SER 1 22.824 20.735 -10.013 6 2HB SER 1 2HB SER 1 21.103 20.777 -9.599 7 HG SER 1 HG SER 1 21.616 19.585 -7.710 8 H LYS 2 H LYS 2 23.406 18.228 -12.015 9 HA LYS 2 HA LYS 2 25.666 17.180 -10.364 10 1HB LYS 2 2HB LYS 2 24.243 15.279 -12.326 11 2HB LYS 2 1HB LYS 2 25.919 15.063 -11.832 12 1HG LYS 2 1HG LYS 2 25.234 14.831 -9.434 13 2HG LYS 2 2HG LYS 2 23.543 15.057 -9.883 14 1HD LYS 2 2HD LYS 2 23.638 12.958 -11.315 15 2HD LYS 2 1HD LYS 2 25.331 12.729 -10.869 16 1HE LYS 2 1HE LYS 2 24.659 12.472 -8.437 17 2HE LYS 2 2HE LYS 2 22.958 12.702 -8.886 18 1HZ LYS 2 1HZ LYS 2 23.134 10.734 -10.320 19 2HZ LYS 2 2HZ LYS 2 24.718 10.520 -9.903 20 3HZ LYS 2 3HZ LYS 2 23.534 10.356 -8.763 21 H TYR 3 H TYR 3 26.816 18.764 -11.191 22 HA TYR 3 HA TYR 3 26.782 19.625 -14.033 23 1HB TYR 3 2HB TYR 3 28.304 21.369 -13.426 24 2HB TYR 3 1HB TYR 3 26.962 21.290 -12.327 25 HD1 TYR 3 HD1 TYR 3 30.632 20.399 -12.649 26 HD2 TYR 3 HD2 TYR 3 27.442 21.256 -9.895 27 HE1 TYR 3 HE1 TYR 3 32.217 20.491 -10.823 28 HE2 TYR 3 HE2 TYR 3 29.068 21.330 -8.087 29 HH TYR 3 HH TYR 3 32.520 20.790 -8.653 30 H GLU 4 H GLU 4 28.343 19.419 -15.568 31 HA GLU 4 HA GLU 4 31.026 18.111 -15.008 32 1HB GLU 4 1HB GLU 4 29.587 16.245 -15.793 33 2HB GLU 4 2HB GLU 4 29.131 17.149 -17.232 34 1HG GLU 4 1HG GLU 4 31.528 17.054 -18.029 35 2HG GLU 4 2HG GLU 4 31.987 16.132 -16.611 36 HE2 GLU 4 HE2 GLU 4 30.265 13.216 -17.555 37 H TYR 5 H TYR 5 32.034 20.022 -15.313 38 HA TYR 5 HA TYR 5 31.521 21.597 -17.912 39 1HB TYR 5 2HB TYR 5 31.900 23.649 -17.007 40 2HB TYR 5 1HB TYR 5 30.572 22.834 -16.211 41 HD1 TYR 5 HD1 TYR 5 33.899 24.406 -15.706 42 HD2 TYR 5 HD2 TYR 5 30.663 22.357 -13.743 43 HE1 TYR 5 HE1 TYR 5 34.667 25.213 -13.555 44 HE2 TYR 5 HE2 TYR 5 31.466 23.199 -11.608 45 HH TYR 5 HH TYR 5 32.978 24.391 -10.547 46 H THR 6 H THR 6 33.101 21.144 -19.204 47 HA THR 6 HA THR 6 35.878 20.598 -18.213 48 HB THR 6 HB THR 6 34.796 20.273 -21.074 49 HG1 THR 6 HG1 THR 6 34.662 18.417 -18.942 50 1HG2 THR 6 1HG2 THR 6 36.925 18.654 -19.545 51 2HG2 THR 6 2HG2 THR 6 37.263 19.835 -20.842 52 3HG2 THR 6 3HG2 THR 6 36.365 18.327 -21.207 53 H VAL 7 H VAL 7 36.735 22.475 -17.775 54 HA VAL 7 HA VAL 7 36.927 24.673 -19.910 55 HB VAL 7 HB VAL 7 37.428 24.828 -16.898 56 1HG1 VAL 7 1HG1 VAL 7 37.941 27.266 -17.051 57 2HG1 VAL 7 2HG1 VAL 7 37.778 27.220 -18.835 58 3HG1 VAL 7 3HG1 VAL 7 39.085 26.333 -18.030 59 1HG2 VAL 7 1HG2 VAL 7 35.500 26.409 -16.758 60 2HG2 VAL 7 2HG2 VAL 7 35.293 26.379 -18.536 61 3HG2 VAL 7 3HG2 VAL 7 34.984 24.925 -17.579 62 HA DPR 8 HA PRO 8 41.432 23.632 -20.126 63 1HB DPR 8 1HB PRO 8 41.658 24.866 -22.071 64 2HB DPR 8 2HB PRO 8 41.849 23.267 -22.828 65 1HG DPR 8 1HG PRO 8 39.948 24.910 -23.760 66 2HG DPR 8 2HG PRO 8 39.550 23.181 -23.471 67 1HD DPR 8 2HD PRO 8 38.808 25.584 -21.733 68 2HD DPR 8 1HD PRO 8 37.839 24.130 -22.096 69 H SER 9 H SER 9 42.645 21.805 -20.641 70 HA SER 9 HA SER 9 41.239 19.097 -20.717 71 1HB SER 9 1HB SER 9 44.180 19.814 -20.184 72 2HB SER 9 2HB SER 9 43.533 18.175 -20.294 73 HG SER 9 HG SER 9 44.351 18.925 -22.274 74 H TYR 10 H TYR 10 40.023 20.666 -18.725 75 HA TYR 10 HA TYR 10 40.681 19.074 -16.241 76 1HB TYR 10 2HB TYR 10 41.484 21.831 -16.464 77 2HB TYR 10 1HB TYR 10 39.991 21.949 -15.602 78 HD1 TYR 10 HD1 TYR 10 43.485 20.651 -15.474 79 HD2 TYR 10 HD2 TYR 10 39.788 20.920 -13.270 80 HE1 TYR 10 HE1 TYR 10 44.624 19.999 -13.443 81 HE2 TYR 10 HE2 TYR 10 40.974 20.264 -11.260 82 HH TYR 10 HH TYR 10 42.899 19.696 -10.352 83 H THR 11 H THR 11 38.987 17.984 -16.515 84 HA THR 11 HA THR 11 36.222 18.951 -17.100 85 HB THR 11 HB THR 11 37.010 16.120 -16.253 86 HG1 THR 11 HG1 THR 11 38.264 16.872 -17.982 87 1HG2 THR 11 1HG2 THR 11 35.135 15.363 -17.722 88 2HG2 THR 11 2HG2 THR 11 34.742 17.050 -18.132 89 3HG2 THR 11 3HG2 THR 11 34.505 16.469 -16.467 90 H PHE 12 H PHE 12 35.218 20.137 -15.458 91 HA PHE 12 HA PHE 12 35.834 19.464 -12.552 92 1HB PHE 12 2HB PHE 12 34.361 21.803 -13.828 93 2HB PHE 12 1HB PHE 12 34.443 21.565 -12.105 94 HD1 PHE 12 HD1 PHE 12 36.617 21.855 -10.841 95 HD2 PHE 12 HD2 PHE 12 36.444 22.553 -15.093 96 HE1 PHE 12 HE1 PHE 12 38.721 23.051 -10.753 97 HE2 PHE 12 HE2 PHE 12 38.550 23.740 -14.956 98 HZ PHE 12 HZ PHE 12 39.710 24.000 -12.801 99 H ARG 13 H ARG 13 34.672 17.682 -12.085 100 HA ARG 13 HA ARG 13 31.683 17.578 -12.661 101 1HB ARG 13 2HB ARG 13 33.667 15.310 -11.991 102 2HB ARG 13 1HB ARG 13 31.920 15.074 -12.104 103 1HG ARG 13 2HG ARG 13 31.940 15.814 -14.475 104 2HG ARG 13 1HG ARG 13 33.697 16.019 -14.405 105 1HD ARG 13 1HD ARG 13 33.930 13.522 -13.903 106 2HD ARG 13 2HD ARG 13 32.167 13.358 -14.042 107 HE ARG 13 HE ARG 13 33.194 14.646 -16.459 108 1HH1 ARG 13 2HH1 ARG 13 33.160 11.342 -15.022 109 2HH1 ARG 13 1HH1 ARG 13 33.324 10.634 -16.707 110 1HH2 ARG 13 2HH2 ARG 13 33.374 13.694 -18.264 111 2HH2 ARG 13 1HH2 ARG 13 33.435 11.865 -18.394 112 H GLY 14 H GLY 14 30.299 17.543 -10.981 113 1HA GLY 14 2HA GLY 14 30.715 16.430 -8.336 114 2HA GLY 14 1HA GLY 14 31.089 18.147 -8.221 115 HA PRO 15 HA PRO 15 26.291 17.725 -8.182 116 1HB PRO 15 2HB PRO 15 25.463 17.403 -5.577 117 2HB PRO 15 1HB PRO 15 25.960 16.062 -6.627 118 1HG PRO 15 2HG PRO 15 27.615 17.465 -4.496 119 2HG PRO 15 1HG PRO 15 27.408 15.702 -4.744 120 1HD PRO 15 2HD PRO 15 29.587 17.173 -5.744 121 2HD PRO 15 1HD PRO 15 28.973 15.705 -6.549 122 H GLY 16 H GLY 16 24.904 19.416 -7.776 123 1HA GLY 16 2HA GLY 16 24.090 21.582 -7.100 124 2HA GLY 16 1HA GLY 16 25.411 21.682 -5.947 125 H CYS 17 H CYS 17 24.296 22.769 -8.989 126 HA CYS 17 HA CYS 17 26.836 23.376 -10.281 127 1HB CYS 17 2HB CYS 17 24.082 24.493 -10.963 128 2HB CYS 17 1HB CYS 17 25.511 24.483 -12.016 129 HA PRO 18 HA PRO 18 27.064 27.273 -7.730 130 1HB PRO 18 2HB PRO 18 29.675 27.487 -7.174 131 2HB PRO 18 1HB PRO 18 28.691 26.101 -6.629 132 1HG PRO 18 2HG PRO 18 30.640 26.209 -8.968 133 2HG PRO 18 1HG PRO 18 30.448 24.917 -7.751 134 1HD PRO 18 2HD PRO 18 29.218 24.988 -10.338 135 2HD PRO 18 1HD PRO 18 28.686 23.951 -8.995 136 H THR 19 H THR 19 29.625 27.550 -10.190 137 HA THR 19 HA THR 19 28.836 30.472 -10.582 138 HB THR 19 HB THR 19 30.889 30.295 -9.459 139 HG1 THR 19 HG1 THR 19 30.457 31.900 -10.943 140 1HG2 THR 19 1HG2 THR 19 32.247 28.971 -11.903 141 2HG2 THR 19 2HG2 THR 19 32.047 28.199 -10.307 142 3HG2 THR 19 3HG2 THR 19 33.082 29.642 -10.477 143 H VAL 20 H VAL 20 29.391 31.471 -12.564 144 HA VAL 20 HA VAL 20 29.250 29.845 -15.117 145 HB VAL 20 HB VAL 20 27.204 31.866 -14.585 146 1HG1 VAL 20 1HG2 VAL 20 27.721 31.743 -17.042 147 2HG1 VAL 20 2HG2 VAL 20 26.030 31.292 -16.783 148 3HG1 VAL 20 3HG2 VAL 20 27.262 30.032 -17.093 149 1HG2 VAL 20 1HG1 VAL 20 25.318 30.121 -14.580 150 2HG2 VAL 20 2HG1 VAL 20 26.532 28.830 -14.844 151 3HG2 VAL 20 3HG1 VAL 20 26.532 29.768 -13.339 152 H LYS 21 H LYS 21 31.097 30.933 -14.391 153 HA LYS 21 HA LYS 21 31.991 33.639 -15.237 154 1HB LYS 21 2HB LYS 21 34.205 33.093 -14.880 155 2HB LYS 21 1HB LYS 21 33.216 32.434 -13.600 156 1HG LYS 21 1HG LYS 21 33.525 30.094 -14.698 157 2HG LYS 21 2HG LYS 21 34.617 30.843 -15.865 158 1HD LYS 21 2HD LYS 21 36.080 31.633 -13.914 159 2HD LYS 21 1HD LYS 21 34.967 30.815 -12.819 160 1HE LYS 21 1HE LYS 21 36.755 29.300 -12.996 161 2HE LYS 21 2HE LYS 21 35.547 28.573 -14.044 162 1HZ LYS 21 1HZ LYS 21 36.756 29.562 -15.957 163 2HZ LYS 21 2HZ LYS 21 37.876 30.226 -14.940 164 3HZ LYS 21 3HZ LYS 21 37.744 28.584 -15.065 165 HA PRO 22 HA PRO 22 32.065 33.637 -19.563 166 1HB PRO 22 1HB PRO 22 34.578 35.266 -19.869 167 2HB PRO 22 2HB PRO 22 32.887 35.659 -20.264 168 1HG PRO 22 1HG PRO 22 33.997 36.758 -18.010 169 2HG PRO 22 2HG PRO 22 32.342 36.086 -17.902 170 1HD PRO 22 2HD PRO 22 34.961 34.630 -17.172 171 2HD PRO 22 1HD PRO 22 33.538 34.982 -16.153 172 H DAL 23 H ALA 23 32.306 31.730 -20.509 173 HA DAL 23 HA ALA 23 35.018 30.369 -20.816 174 1HB DAL 23 1HB ALA 23 34.496 31.435 -22.990 175 2HB DAL 23 2HB ALA 23 32.952 30.543 -23.072 176 3HB DAL 23 3HB ALA 23 34.499 29.655 -23.118 177 H ILE 24 H ILE 24 31.507 29.749 -20.843 178 HA ILE 24 HA ILE 24 32.034 27.183 -19.325 179 HB ILE 24 HB ILE 24 29.849 29.290 -19.387 180 1HG1 ILE 24 2HG1 ILE 24 31.767 29.445 -17.782 181 2HG1 ILE 24 1HG1 ILE 24 30.179 29.663 -17.120 182 1HG2 ILE 24 1HG2 ILE 24 28.180 28.159 -17.929 183 2HG2 ILE 24 2HG2 ILE 24 28.261 27.657 -19.632 184 3HG2 ILE 24 3HG2 ILE 24 28.973 26.620 -18.393 185 1HD1 ILE 24 1HD1 ILE 24 30.379 27.663 -15.764 186 2HD1 ILE 24 2HD1 ILE 24 31.707 26.998 -16.748 187 3HD1 ILE 24 3HD1 ILE 24 31.974 28.414 -15.682 188 H SER 25 H SER 25 30.710 25.630 -19.466 189 HA SER 25 HA SER 25 29.165 24.713 -21.781 190 1HB SER 25 2HB SER 25 31.421 24.363 -22.793 191 2HB SER 25 1HB SER 25 31.887 23.319 -21.439 192 HG SER 25 HG SER 25 29.702 22.889 -23.223 193 H LEU 26 H LEU 26 27.846 24.691 -19.841 194 HA LEU 26 HA LEU 26 28.366 22.513 -17.795 195 1HB LEU 26 1HB LEU 26 26.805 25.139 -17.724 196 2HB LEU 26 2HB LEU 26 25.937 23.818 -17.059 197 HG LEU 26 HG LEU 26 28.015 23.337 -15.518 198 1HD1 LEU 26 1HD1 LEU 26 29.560 25.213 -15.002 199 2HD1 LEU 26 2HD1 LEU 26 29.682 24.837 -16.733 200 3HD1 LEU 26 3HD1 LEU 26 28.758 26.254 -16.212 201 1HD2 LEU 26 1HD2 LEU 26 27.256 24.965 -13.789 202 2HD2 LEU 26 2HD2 LEU 26 25.869 24.295 -14.664 203 3HD2 LEU 26 3HD2 LEU 26 26.430 25.940 -15.037 204 H ARG 27 H ARG 27 26.824 21.018 -17.245 205 HA ARG 27 HA ARG 27 24.410 20.511 -18.957 206 1HB ARG 27 1HB ARG 27 26.643 18.396 -18.704 207 2HB ARG 27 2HB ARG 27 24.971 17.966 -19.019 208 1HG ARG 27 2HG ARG 27 24.952 19.301 -21.135 209 2HG ARG 27 1HG ARG 27 26.623 19.790 -20.858 210 1HD ARG 27 2HD ARG 27 27.365 17.369 -21.005 211 2HD ARG 27 1HD ARG 27 25.684 16.874 -21.283 212 HE ARG 27 HE ARG 27 26.154 18.838 -23.281 213 1HH1 ARG 27 1HH1 ARG 27 27.796 15.715 -22.551 214 2HH1 ARG 27 2HH1 ARG 27 28.266 15.577 -24.320 215 1HH2 ARG 27 1HH2 ARG 27 26.758 18.529 -25.214 216 2HH2 ARG 27 2HH2 ARG 27 27.722 17.047 -25.704 217 H CYS 28 H CYS 28 24.320 21.635 -16.752 218 HA CYS 28 HA CYS 28 24.367 20.439 -14.352 219 1HB CYS 28 1HB CYS 28 24.010 22.883 -14.745 220 2HB CYS 28 2HB CYS 28 22.291 22.568 -15.071 221 H GLU 29 H GLU 29 21.293 20.267 -16.258 222 HA GLU 29 HA GLU 29 20.388 17.954 -14.468 223 1HB GLU 29 2HB GLU 29 19.227 20.248 -13.894 224 2HB GLU 29 1HB GLU 29 18.515 20.183 -15.501 225 1HG GLU 29 2HG GLU 29 17.354 18.005 -14.831 226 2HG GLU 29 1HG GLU 29 18.084 18.134 -13.225 227 HE2 GLU 29 HE2 GLU 29 15.917 20.467 -12.014 Start of MODEL 25 1 1H SER 1 1H SER 1 20.976 17.590 -8.455 2 2H SER 1 2H SER 1 20.652 16.761 -9.847 3 3H SER 1 3H SER 1 19.899 18.201 -9.549 4 HA SER 1 HA SER 1 21.604 18.522 -11.206 5 1HB SER 1 2HB SER 1 22.238 19.761 -8.462 6 2HB SER 1 1HB SER 1 22.889 20.345 -10.004 7 HG SER 1 HG SER 1 20.140 20.098 -9.333 8 H LYS 2 H LYS 2 23.522 17.816 -11.936 9 HA LYS 2 HA LYS 2 25.783 16.940 -10.194 10 1HB LYS 2 1HB LYS 2 24.477 14.880 -12.079 11 2HB LYS 2 2HB LYS 2 26.150 14.759 -11.544 12 1HG LYS 2 2HG LYS 2 25.424 14.611 -9.146 13 2HG LYS 2 1HG LYS 2 23.737 14.745 -9.637 14 1HD LYS 2 2HD LYS 2 23.973 12.576 -10.977 15 2HD LYS 2 1HD LYS 2 25.645 12.468 -10.445 16 1HE LYS 2 2HE LYS 2 24.541 10.987 -9.022 17 2HE LYS 2 1HE LYS 2 24.770 12.384 -7.984 18 1HZ LYS 2 1HZ LYS 2 22.424 12.996 -8.454 19 2HZ LYS 2 2HZ LYS 2 22.245 11.668 -9.421 20 3HZ LYS 2 3HZ LYS 2 22.530 11.481 -7.805 21 H TYR 3 H TYR 3 26.900 18.504 -11.085 22 HA TYR 3 HA TYR 3 26.861 19.246 -13.956 23 1HB TYR 3 2HB TYR 3 28.275 21.091 -13.402 24 2HB TYR 3 1HB TYR 3 26.960 20.973 -12.276 25 HD1 TYR 3 HD1 TYR 3 30.674 20.304 -12.653 26 HD2 TYR 3 HD2 TYR 3 27.465 20.900 -9.856 27 HE1 TYR 3 HE1 TYR 3 32.272 20.498 -10.843 28 HE2 TYR 3 HE2 TYR 3 29.106 21.072 -8.059 29 HH TYR 3 HH TYR 3 31.227 21.046 -7.493 30 H GLU 4 H GLU 4 28.443 19.073 -15.473 31 HA GLU 4 HA GLU 4 31.154 17.852 -14.874 32 1HB GLU 4 1HB GLU 4 29.760 15.921 -15.598 33 2HB GLU 4 2HB GLU 4 29.298 16.766 -17.071 34 1HG GLU 4 2HG GLU 4 31.711 16.687 -17.838 35 2HG GLU 4 1HG GLU 4 32.162 15.810 -16.388 36 HE2 GLU 4 HE2 GLU 4 30.858 13.969 -15.944 37 H TYR 5 H TYR 5 32.221 19.677 -15.353 38 HA TYR 5 HA TYR 5 31.707 21.063 -18.058 39 1HB TYR 5 1HB TYR 5 32.137 23.209 -17.324 40 2HB TYR 5 2HB TYR 5 30.740 22.501 -16.557 41 HD1 TYR 5 HD1 TYR 5 33.956 24.179 -15.951 42 HD2 TYR 5 HD2 TYR 5 30.743 22.037 -14.047 43 HE1 TYR 5 HE1 TYR 5 34.579 25.112 -13.802 44 HE2 TYR 5 HE2 TYR 5 31.399 23.008 -11.918 45 HH TYR 5 HH TYR 5 32.795 24.320 -10.842 46 H THR 6 H THR 6 33.326 20.563 -19.285 47 HA THR 6 HA THR 6 36.074 20.090 -18.200 48 HB THR 6 HB THR 6 35.093 19.634 -21.079 49 HG1 THR 6 HG1 THR 6 33.687 18.646 -19.608 50 1HG2 THR 6 1HG2 THR 6 37.156 18.069 -19.405 51 2HG2 THR 6 2HG2 THR 6 36.671 17.700 -21.082 52 3HG2 THR 6 3HG2 THR 6 37.556 19.215 -20.718 53 H VAL 7 H VAL 7 36.977 21.961 -17.848 54 HA VAL 7 HA VAL 7 37.211 24.063 -20.073 55 HB VAL 7 HB VAL 7 37.666 24.363 -17.065 56 1HG1 VAL 7 1HG2 VAL 7 38.176 26.793 -17.345 57 2HG1 VAL 7 2HG2 VAL 7 39.330 25.811 -18.264 58 3HG1 VAL 7 3HG2 VAL 7 38.027 26.650 -19.124 59 1HG2 VAL 7 1HG1 VAL 7 35.231 24.418 -17.764 60 2HG2 VAL 7 2HG1 VAL 7 35.540 25.817 -18.801 61 3HG2 VAL 7 3HG1 VAL 7 35.734 25.948 -17.026 62 HA DPR 8 HA PRO 8 41.708 22.997 -20.156 63 1HB DPR 8 1HB PRO 8 41.955 24.069 -22.189 64 2HB DPR 8 2HB PRO 8 42.164 22.417 -22.813 65 1HG DPR 8 2HG PRO 8 40.268 23.968 -23.898 66 2HG DPR 8 1HG PRO 8 39.874 22.265 -23.476 67 1HD DPR 8 2HD PRO 8 39.101 24.796 -21.944 68 2HD DPR 8 1HD PRO 8 38.140 23.314 -22.205 69 H SER 9 H SER 9 42.937 21.147 -20.495 70 HA SER 9 HA SER 9 41.575 18.423 -20.403 71 1HB SER 9 2HB SER 9 44.481 19.235 -19.813 72 2HB SER 9 1HB SER 9 43.867 17.580 -19.826 73 HG SER 9 HG SER 9 43.733 19.421 -21.989 74 H TYR 10 H TYR 10 40.293 20.156 -18.536 75 HA TYR 10 HA TYR 10 40.884 18.712 -15.947 76 1HB TYR 10 1HB TYR 10 41.759 21.418 -16.304 77 2HB TYR 10 2HB TYR 10 40.235 21.640 -15.518 78 HD1 TYR 10 HD1 TYR 10 39.905 20.780 -13.131 79 HD2 TYR 10 HD2 TYR 10 43.677 20.252 -15.154 80 HE1 TYR 10 HE1 TYR 10 40.987 20.222 -11.035 81 HE2 TYR 10 HE2 TYR 10 44.711 19.701 -13.040 82 HH TYR 10 HH TYR 10 44.441 19.434 -10.862 83 H THR 11 H THR 11 39.179 17.631 -16.188 84 HA THR 11 HA THR 11 36.458 18.598 -16.919 85 HB THR 11 HB THR 11 37.154 15.811 -15.875 86 HG1 THR 11 HG1 THR 11 38.488 16.440 -17.595 87 1HG2 THR 11 1HG2 THR 11 34.659 16.215 -16.221 88 2HG2 THR 11 2HG2 THR 11 34.988 16.656 -17.910 89 3HG2 THR 11 3HG2 THR 11 35.315 14.998 -17.353 90 H PHE 12 H PHE 12 35.352 19.842 -15.421 91 HA PHE 12 HA PHE 12 35.880 19.442 -12.454 92 1HB PHE 12 1HB PHE 12 34.407 21.618 -13.998 93 2HB PHE 12 2HB PHE 12 34.413 21.541 -12.259 94 HD1 PHE 12 HD1 PHE 12 36.514 22.001 -10.932 95 HD2 PHE 12 HD2 PHE 12 36.534 22.293 -15.234 96 HE1 PHE 12 HE1 PHE 12 38.583 23.255 -10.857 97 HE2 PHE 12 HE2 PHE 12 38.603 23.544 -15.111 98 HZ PHE 12 HZ PHE 12 39.651 24.036 -12.938 99 H ARG 13 H ARG 13 34.785 17.606 -11.977 100 HA ARG 13 HA ARG 13 31.797 17.424 -12.517 101 1HB ARG 13 1HB ARG 13 33.817 15.224 -11.736 102 2HB ARG 13 2HB ARG 13 32.073 14.956 -11.824 103 1HG ARG 13 1HG ARG 13 32.070 15.565 -14.235 104 2HG ARG 13 2HG ARG 13 33.824 15.798 -14.182 105 1HD ARG 13 1HD ARG 13 34.097 13.337 -13.549 106 2HD ARG 13 2HD ARG 13 32.336 13.139 -13.669 107 HE ARG 13 HE ARG 13 33.351 14.314 -16.156 108 1HH1 ARG 13 1HH2 ARG 13 33.297 11.087 -14.553 109 2HH1 ARG 13 2HH2 ARG 13 33.451 10.294 -16.200 110 1HH2 ARG 13 1HH1 ARG 13 33.519 13.270 -17.910 111 2HH2 ARG 13 2HH1 ARG 13 33.566 11.436 -17.948 112 H GLY 14 H GLY 14 30.423 17.445 -10.810 113 1HA GLY 14 2HA GLY 14 30.931 16.462 -8.124 114 2HA GLY 14 1HA GLY 14 31.219 18.197 -8.092 115 HA PRO 15 HA PRO 15 26.464 17.559 -7.872 116 1HB PRO 15 2HB PRO 15 25.749 17.499 -5.218 117 2HB PRO 15 1HB PRO 15 26.306 16.075 -6.120 118 1HG PRO 15 1HG PRO 15 27.924 17.830 -4.236 119 2HG PRO 15 2HG PRO 15 27.834 16.040 -4.269 120 1HD PRO 15 2HD PRO 15 29.868 17.534 -5.523 121 2HD PRO 15 1HD PRO 15 29.348 15.933 -6.112 122 H GLY 16 H GLY 16 24.998 19.201 -7.626 123 1HA GLY 16 1HA GLY 16 24.049 21.360 -7.174 124 2HA GLY 16 2HA GLY 16 25.361 21.658 -6.042 125 H CYS 17 H CYS 17 24.057 22.886 -8.766 126 HA CYS 17 HA CYS 17 26.341 23.252 -10.546 127 1HB CYS 17 2HB CYS 17 23.905 25.080 -10.715 128 2HB CYS 17 1HB CYS 17 24.950 24.489 -12.007 129 HA PRO 18 HA PRO 18 27.654 26.812 -7.821 130 1HB PRO 18 1HB PRO 18 30.327 26.737 -7.894 131 2HB PRO 18 2HB PRO 18 29.351 25.390 -7.249 132 1HG PRO 18 1HG PRO 18 30.649 25.601 -10.005 133 2HG PRO 18 2HG PRO 18 30.687 24.214 -8.879 134 1HD PRO 18 1HD PRO 18 28.844 24.516 -11.009 135 2HD PRO 18 2HD PRO 18 28.542 23.511 -9.573 136 H THR 19 H THR 19 29.685 27.202 -10.748 137 HA THR 19 HA THR 19 28.954 30.155 -10.835 138 HB THR 19 HB THR 19 31.288 30.308 -11.858 139 HG1 THR 19 HG1 THR 19 31.534 27.700 -10.830 140 1HG2 THR 19 1HG2 THR 19 31.324 29.329 -8.966 141 2HG2 THR 19 2HG2 THR 19 32.616 30.243 -9.795 142 3HG2 THR 19 3HG2 THR 19 31.027 31.004 -9.506 143 H VAL 20 H VAL 20 29.058 31.239 -12.974 144 HA VAL 20 HA VAL 20 29.178 29.718 -15.392 145 HB VAL 20 HB VAL 20 27.363 30.645 -16.408 146 1HG1 VAL 20 1HG2 VAL 20 27.311 28.208 -15.835 147 2HG1 VAL 20 2HG2 VAL 20 25.664 28.828 -16.032 148 3HG1 VAL 20 3HG2 VAL 20 26.330 28.563 -14.397 149 1HG2 VAL 20 1HG1 VAL 20 25.745 31.124 -13.832 150 2HG2 VAL 20 2HG1 VAL 20 25.118 31.314 -15.495 151 3HG2 VAL 20 3HG1 VAL 20 26.393 32.392 -14.895 152 H LYS 21 H LYS 21 30.866 30.859 -14.974 153 HA LYS 21 HA LYS 21 31.215 33.830 -15.610 154 1HB LYS 21 2HB LYS 21 33.276 31.537 -15.330 155 2HB LYS 21 1HB LYS 21 33.740 33.172 -15.757 156 1HG LYS 21 2HG LYS 21 32.945 34.127 -13.650 157 2HG LYS 21 1HG LYS 21 32.278 32.577 -13.128 158 1HD LYS 21 1HD LYS 21 34.550 31.547 -13.115 159 2HD LYS 21 2HD LYS 21 35.271 33.069 -13.670 160 1HE LYS 21 2HE LYS 21 34.502 34.207 -11.537 161 2HE LYS 21 1HE LYS 21 33.788 32.680 -10.982 162 1HZ LYS 21 1HZ LYS 21 36.674 33.092 -11.613 163 2HZ LYS 21 2HZ LYS 21 36.020 32.987 -10.099 164 3HZ LYS 21 3HZ LYS 21 36.009 31.670 -11.097 165 HA PRO 22 HA PRO 22 30.934 33.832 -19.866 166 1HB PRO 22 1HB PRO 22 33.284 35.692 -20.354 167 2HB PRO 22 2HB PRO 22 31.554 35.898 -20.718 168 1HG PRO 22 2HG PRO 22 32.575 37.167 -18.518 169 2HG PRO 22 1HG PRO 22 31.017 36.306 -18.335 170 1HD PRO 22 1HD PRO 22 33.812 35.213 -17.658 171 2HD PRO 22 2HD PRO 22 32.380 35.406 -16.611 172 H DAL 23 H ALA 23 31.340 32.695 -21.658 173 HA DAL 23 HA ALA 23 34.016 31.431 -22.304 174 1HB DAL 23 1HB ALA 23 31.293 31.159 -23.695 175 2HB DAL 23 2HB ALA 23 32.607 32.270 -24.170 176 3HB DAL 23 3HB ALA 23 32.844 30.511 -24.293 177 H ILE 24 H ILE 24 31.112 30.424 -20.597 178 HA ILE 24 HA ILE 24 32.383 27.885 -19.892 179 HB ILE 24 HB ILE 24 30.344 29.797 -18.885 180 1HG1 ILE 24 2HG1 ILE 24 32.512 29.450 -17.849 181 2HG1 ILE 24 1HG1 ILE 24 31.158 29.496 -16.770 182 1HG2 ILE 24 1HG2 ILE 24 28.845 28.562 -17.452 183 2HG2 ILE 24 2HG2 ILE 24 29.277 27.079 -18.364 184 3HG2 ILE 24 3HG2 ILE 24 28.517 28.445 -19.196 185 1HD1 ILE 24 1HD1 ILE 24 32.338 26.742 -17.490 186 2HD1 ILE 24 2HD1 ILE 24 31.476 27.254 -16.024 187 3HD1 ILE 24 3HD1 ILE 24 33.141 27.784 -16.275 188 H SER 25 H SER 25 30.974 26.143 -19.484 189 HA SER 25 HA SER 25 29.239 25.069 -21.652 190 1HB SER 25 2HB SER 25 31.428 24.683 -22.754 191 2HB SER 25 1HB SER 25 32.005 23.765 -21.352 192 HG SER 25 HG SER 25 30.245 22.322 -21.683 193 H LEU 26 H LEU 26 27.835 24.785 -19.970 194 HA LEU 26 HA LEU 26 28.407 22.504 -18.011 195 1HB LEU 26 1HB LEU 26 27.017 25.198 -17.402 196 2HB LEU 26 2HB LEU 26 26.416 23.757 -16.652 197 HG LEU 26 HG LEU 26 28.791 23.295 -15.733 198 1HD1 LEU 26 1HD1 LEU 26 30.403 25.128 -15.481 199 2HD1 LEU 26 2HD1 LEU 26 30.069 24.950 -17.208 200 3HD1 LEU 26 3HD1 LEU 26 29.337 26.291 -16.299 201 1HD2 LEU 26 1HD2 LEU 26 28.479 24.754 -13.743 202 2HD2 LEU 26 2HD2 LEU 26 26.927 24.103 -14.293 203 3HD2 LEU 26 3HD2 LEU 26 27.346 25.793 -14.657 204 H ARG 27 H ARG 27 26.812 21.123 -17.694 205 HA ARG 27 HA ARG 27 24.124 21.300 -19.003 206 1HB ARG 27 2HB ARG 27 26.065 19.020 -19.753 207 2HB ARG 27 1HB ARG 27 24.321 18.828 -19.830 208 1HG ARG 27 2HG ARG 27 24.121 20.700 -21.479 209 2HG ARG 27 1HG ARG 27 25.864 20.955 -21.423 210 1HD ARG 27 1HD ARG 27 26.240 18.610 -22.332 211 2HD ARG 27 2HD ARG 27 24.488 18.366 -22.397 212 HE ARG 27 HE ARG 27 24.302 20.072 -24.182 213 1HH1 ARG 27 1HH2 ARG 27 27.766 19.427 -23.438 214 2HH1 ARG 27 2HH2 ARG 27 28.227 20.184 -25.044 215 1HH2 ARG 27 1HH1 ARG 27 24.985 20.884 -25.934 216 2HH2 ARG 27 2HH1 ARG 27 26.772 20.943 -26.343 217 H CYS 28 H CYS 28 24.517 21.768 -16.609 218 HA CYS 28 HA CYS 28 24.876 19.945 -14.680 219 1HB CYS 28 2HB CYS 28 24.740 22.469 -14.426 220 2HB CYS 28 1HB CYS 28 22.976 22.301 -14.306 221 H GLU 29 H GLU 29 21.511 20.515 -15.866 222 HA GLU 29 HA GLU 29 20.479 18.295 -14.015 223 1HB GLU 29 2HB GLU 29 18.977 20.373 -15.735 224 2HB GLU 29 1HB GLU 29 18.164 19.018 -14.966 225 1HG GLU 29 1HG GLU 29 18.810 19.822 -12.695 226 2HG GLU 29 2HG GLU 29 19.663 21.197 -13.410 227 HE2 GLU 29 HE2 GLU 29 18.508 22.524 -14.737 Start of MODEL 26 1 1H SER 1 1H SER 1 23.253 20.882 -10.727 2 2H SER 1 2H SER 1 22.375 20.105 -11.891 3 3H SER 1 3H SER 1 21.604 20.978 -10.720 4 HA SER 1 HA SER 1 22.346 19.501 -9.001 5 1HB SER 1 2HB SER 1 20.133 19.169 -10.063 6 2HB SER 1 1HB SER 1 20.859 18.090 -11.270 7 HG SER 1 HG SER 1 21.548 16.764 -9.532 8 H LYS 2 H LYS 2 23.473 18.176 -12.155 9 HA LYS 2 HA LYS 2 25.811 16.896 -10.717 10 1HB LYS 2 1HB LYS 2 23.980 15.151 -11.075 11 2HB LYS 2 2HB LYS 2 24.045 15.469 -12.809 12 1HG LYS 2 2HG LYS 2 26.448 14.709 -12.830 13 2HG LYS 2 1HG LYS 2 26.367 14.415 -11.087 14 1HD LYS 2 1HD LYS 2 24.542 12.660 -11.504 15 2HD LYS 2 2HD LYS 2 24.679 12.974 -13.228 16 1HE LYS 2 2HE LYS 2 25.912 11.014 -12.950 17 2HE LYS 2 1HE LYS 2 27.180 12.222 -13.081 18 1HZ LYS 2 1HZ LYS 2 27.595 10.667 -11.272 19 2HZ LYS 2 2HZ LYS 2 26.160 11.023 -10.536 20 3HZ LYS 2 3HZ LYS 2 27.352 12.164 -10.617 21 H TYR 3 H TYR 3 26.932 18.667 -11.453 22 HA TYR 3 HA TYR 3 26.978 19.529 -14.306 23 1HB TYR 3 2HB TYR 3 28.346 21.361 -13.651 24 2HB TYR 3 1HB TYR 3 27.058 21.163 -12.517 25 HD1 TYR 3 HD1 TYR 3 27.628 21.410 -10.183 26 HD2 TYR 3 HD2 TYR 3 30.747 20.349 -12.947 27 HE1 TYR 3 HE1 TYR 3 29.281 21.633 -8.442 28 HE2 TYR 3 HE2 TYR 3 32.369 20.572 -11.195 29 HH TYR 3 HH TYR 3 32.736 21.035 -9.042 30 H GLU 4 H GLU 4 28.581 19.282 -15.783 31 HA GLU 4 HA GLU 4 31.229 17.932 -15.101 32 1HB GLU 4 1HB GLU 4 29.748 16.127 -15.983 33 2HB GLU 4 2HB GLU 4 29.418 17.072 -17.432 34 1HG GLU 4 2HG GLU 4 31.877 16.876 -18.058 35 2HG GLU 4 1HG GLU 4 32.163 15.882 -16.641 36 HE2 GLU 4 HE2 GLU 4 30.687 14.124 -16.402 37 H TYR 5 H TYR 5 32.432 19.723 -15.440 38 HA TYR 5 HA TYR 5 32.120 21.251 -18.086 39 1HB TYR 5 2HB TYR 5 32.653 23.316 -17.223 40 2HB TYR 5 1HB TYR 5 31.145 22.679 -16.609 41 HD1 TYR 5 HD1 TYR 5 30.843 22.311 -14.126 42 HD2 TYR 5 HD2 TYR 5 34.468 24.026 -15.700 43 HE1 TYR 5 HE1 TYR 5 31.347 23.296 -11.973 44 HE2 TYR 5 HE2 TYR 5 34.942 24.967 -13.518 45 HH TYR 5 HH TYR 5 32.746 24.501 -10.774 46 H THR 6 H THR 6 33.777 20.777 -19.253 47 HA THR 6 HA THR 6 36.423 20.068 -18.064 48 HB THR 6 HB THR 6 35.602 19.891 -21.023 49 HG1 THR 6 HG1 THR 6 34.896 17.811 -20.547 50 1HG2 THR 6 1HG2 THR 6 37.061 17.869 -21.086 51 2HG2 THR 6 2HG2 THR 6 38.010 19.290 -20.545 52 3HG2 THR 6 3HG2 THR 6 37.454 18.074 -19.358 53 H VAL 7 H VAL 7 37.579 21.756 -17.603 54 HA VAL 7 HA VAL 7 37.997 24.029 -19.626 55 HB VAL 7 HB VAL 7 38.569 24.025 -16.625 56 1HG1 VAL 7 1HG2 VAL 7 39.292 26.415 -16.758 57 2HG1 VAL 7 2HG2 VAL 7 40.303 25.406 -17.805 58 3HG1 VAL 7 3HG2 VAL 7 39.044 26.421 -18.532 59 1HG2 VAL 7 1HG1 VAL 7 36.505 25.780 -18.139 60 2HG2 VAL 7 2HG1 VAL 7 36.127 24.346 -17.170 61 3HG2 VAL 7 3HG1 VAL 7 36.800 25.778 -16.372 62 HA DPR 8 HA PRO 8 42.346 22.528 -19.919 63 1HB DPR 8 2HB PRO 8 42.621 23.637 -21.922 64 2HB DPR 8 1HB PRO 8 42.671 21.996 -22.607 65 1HG DPR 8 2HG PRO 8 40.881 23.732 -23.575 66 2HG DPR 8 1HG PRO 8 40.356 22.055 -23.192 67 1HD DPR 8 1HD PRO 8 39.852 24.589 -21.554 68 2HD DPR 8 2HD PRO 8 38.756 23.208 -21.834 69 H SER 9 H SER 9 43.403 20.611 -20.314 70 HA SER 9 HA SER 9 41.896 17.978 -20.343 71 1HB SER 9 1HB SER 9 44.814 18.620 -19.602 72 2HB SER 9 2HB SER 9 44.125 17.000 -19.711 73 HG SER 9 HG SER 9 45.118 17.654 -21.644 74 H TYR 10 H TYR 10 40.726 19.783 -18.352 75 HA TYR 10 HA TYR 10 41.155 18.128 -15.856 76 1HB TYR 10 1HB TYR 10 42.353 20.697 -16.044 77 2HB TYR 10 2HB TYR 10 40.840 21.101 -15.307 78 HD1 TYR 10 HD1 TYR 10 44.045 19.242 -14.878 79 HD2 TYR 10 HD2 TYR 10 40.306 20.217 -12.962 80 HE1 TYR 10 HE1 TYR 10 44.914 18.482 -12.758 81 HE2 TYR 10 HE2 TYR 10 41.220 19.442 -10.856 82 HH TYR 10 HH TYR 10 44.526 18.179 -10.600 83 H THR 11 H THR 11 39.349 17.249 -16.164 84 HA THR 11 HA THR 11 36.765 18.520 -16.878 85 HB THR 11 HB THR 11 37.143 15.627 -15.966 86 HG1 THR 11 HG1 THR 11 37.470 15.207 -18.159 87 1HG2 THR 11 1HG2 THR 11 35.289 15.083 -17.548 88 2HG2 THR 11 2HG2 THR 11 34.716 16.293 -16.363 89 3HG2 THR 11 3HG2 THR 11 35.146 16.795 -18.014 90 H PHE 12 H PHE 12 35.632 19.733 -15.358 91 HA PHE 12 HA PHE 12 36.093 19.162 -12.396 92 1HB PHE 12 2HB PHE 12 34.902 21.557 -13.864 93 2HB PHE 12 1HB PHE 12 34.833 21.383 -12.133 94 HD1 PHE 12 HD1 PHE 12 36.918 21.571 -10.716 95 HD2 PHE 12 HD2 PHE 12 37.141 22.037 -14.997 96 HE1 PHE 12 HE1 PHE 12 39.118 22.568 -10.516 97 HE2 PHE 12 HE2 PHE 12 39.341 23.025 -14.746 98 HZ PHE 12 HZ PHE 12 40.348 23.300 -12.519 99 H ARG 13 H ARG 13 34.873 17.310 -12.229 100 HA ARG 13 HA ARG 13 31.879 17.428 -12.732 101 1HB ARG 13 1HB ARG 13 33.700 15.048 -11.997 102 2HB ARG 13 2HB ARG 13 31.939 14.932 -12.079 103 1HG ARG 13 2HG ARG 13 31.975 15.587 -14.482 104 2HG ARG 13 1HG ARG 13 33.741 15.672 -14.436 105 1HD ARG 13 1HD ARG 13 33.802 13.181 -13.843 106 2HD ARG 13 2HD ARG 13 32.030 13.144 -13.972 107 HE ARG 13 HE ARG 13 32.979 14.263 -16.444 108 1HH1 ARG 13 1HH2 ARG 13 33.328 11.050 -14.852 109 2HH1 ARG 13 2HH2 ARG 13 33.530 10.280 -16.505 110 1HH2 ARG 13 1HH1 ARG 13 33.221 13.246 -18.206 111 2HH2 ARG 13 2HH1 ARG 13 33.473 11.430 -18.251 112 H GLY 14 H GLY 14 30.536 17.617 -11.075 113 1HA GLY 14 1HA GLY 14 30.925 16.653 -8.323 114 2HA GLY 14 2HA GLY 14 31.253 18.387 -8.384 115 HA PRO 15 HA PRO 15 26.489 17.762 -8.634 116 1HB PRO 15 2HB PRO 15 25.398 17.333 -6.133 117 2HB PRO 15 1HB PRO 15 26.069 16.044 -7.152 118 1HG PRO 15 1HG PRO 15 27.423 17.477 -4.837 119 2HG PRO 15 2HG PRO 15 27.331 15.712 -5.135 120 1HD PRO 15 2HD PRO 15 29.529 17.303 -5.874 121 2HD PRO 15 1HD PRO 15 29.072 15.830 -6.771 122 H GLY 16 H GLY 16 25.007 19.359 -8.396 123 1HA GLY 16 1HA GLY 16 24.031 21.501 -7.922 124 2HA GLY 16 2HA GLY 16 25.081 21.602 -6.515 125 H CYS 17 H CYS 17 24.469 23.023 -9.487 126 HA CYS 17 HA CYS 17 27.145 23.602 -10.479 127 1HB CYS 17 2HB CYS 17 24.466 24.902 -11.150 128 2HB CYS 17 1HB CYS 17 26.008 25.301 -11.948 129 HA PRO 18 HA PRO 18 27.525 27.190 -7.428 130 1HB PRO 18 1HB PRO 18 30.153 27.283 -6.886 131 2HB PRO 18 2HB PRO 18 29.129 25.902 -6.414 132 1HG PRO 18 1HG PRO 18 31.013 26.092 -8.808 133 2HG PRO 18 2HG PRO 18 30.853 24.748 -7.642 134 1HD PRO 18 1HD PRO 18 29.531 24.876 -10.158 135 2HD PRO 18 2HD PRO 18 28.951 23.903 -8.785 136 H THR 19 H THR 19 30.220 27.653 -9.762 137 HA THR 19 HA THR 19 29.311 30.479 -10.285 138 HB THR 19 HB THR 19 31.537 30.581 -11.525 139 HG1 THR 19 HG1 THR 19 31.751 28.361 -11.831 140 1HG2 THR 19 1HG2 THR 19 31.466 31.503 -9.240 141 2HG2 THR 19 2HG2 THR 19 33.045 30.753 -9.599 142 3HG2 THR 19 3HG2 THR 19 31.863 29.898 -8.568 143 H VAL 20 H VAL 20 28.978 31.240 -12.350 144 HA VAL 20 HA VAL 20 29.099 29.615 -14.740 145 HB VAL 20 HB VAL 20 27.217 28.702 -14.100 146 1HG1 VAL 20 1HG2 VAL 20 24.863 29.585 -13.904 147 2HG1 VAL 20 2HG2 VAL 20 25.448 31.236 -14.280 148 3HG1 VAL 20 3HG2 VAL 20 25.942 30.428 -12.773 149 1HG2 VAL 20 1HG1 VAL 20 25.842 28.647 -16.150 150 2HG2 VAL 20 2HG1 VAL 20 27.546 28.936 -16.558 151 3HG2 VAL 20 3HG1 VAL 20 26.401 30.288 -16.594 152 H LYS 21 H LYS 21 30.370 31.043 -14.622 153 HA LYS 21 HA LYS 21 30.030 33.949 -15.597 154 1HB LYS 21 2HB LYS 21 32.566 32.204 -15.335 155 2HB LYS 21 1HB LYS 21 32.610 33.833 -15.978 156 1HG LYS 21 1HG LYS 21 31.851 34.868 -13.906 157 2HG LYS 21 2HG LYS 21 31.568 33.299 -13.144 158 1HD LYS 21 2HD LYS 21 33.981 32.726 -13.287 159 2HD LYS 21 1HD LYS 21 34.331 34.269 -14.092 160 1HE LYS 21 2HE LYS 21 33.561 35.518 -12.020 161 2HE LYS 21 1HE LYS 21 33.221 33.973 -11.217 162 1HZ LYS 21 1HZ LYS 21 35.423 34.801 -10.649 163 2HZ LYS 21 2HZ LYS 21 35.893 34.824 -12.233 164 3HZ LYS 21 3HZ LYS 21 35.576 33.385 -11.485 165 HA PRO 22 HA PRO 22 29.399 33.161 -19.795 166 1HB PRO 22 2HB PRO 22 30.943 35.578 -20.769 167 2HB PRO 22 1HB PRO 22 29.207 35.205 -20.863 168 1HG PRO 22 1HG PRO 22 30.075 37.030 -19.012 169 2HG PRO 22 2HG PRO 22 28.862 35.814 -18.510 170 1HD PRO 22 2HD PRO 22 31.916 35.615 -18.137 171 2HD PRO 22 1HD PRO 22 30.623 35.584 -16.912 172 H DAL 23 H ALA 23 30.221 31.545 -20.954 173 HA DAL 23 HA ALA 23 33.088 30.906 -21.051 174 1HB DAL 23 1HB ALA 23 33.413 30.638 -23.501 175 2HB DAL 23 2HB ALA 23 31.807 31.349 -23.817 176 3HB DAL 23 3HB ALA 23 33.096 32.344 -23.086 177 H ILE 24 H ILE 24 31.857 29.430 -19.632 178 HA ILE 24 HA ILE 24 31.708 26.856 -20.806 179 HB ILE 24 HB ILE 24 30.557 27.371 -18.099 180 1HG1 ILE 24 2HG1 ILE 24 33.611 26.873 -18.293 181 2HG1 ILE 24 1HG1 ILE 24 32.917 28.471 -18.220 182 1HG2 ILE 24 1HG2 ILE 24 31.300 25.052 -17.521 183 2HG2 ILE 24 2HG2 ILE 24 32.162 24.881 -19.089 184 3HG2 ILE 24 3HG2 ILE 24 30.375 24.969 -19.004 185 1HD1 ILE 24 1HD1 ILE 24 32.447 26.357 -16.089 186 2HD1 ILE 24 2HD1 ILE 24 33.574 27.759 -15.950 187 3HD1 ILE 24 3HD1 ILE 24 31.777 28.002 -16.072 188 H SER 25 H SER 25 30.099 25.517 -21.120 189 HA SER 25 HA SER 25 27.132 26.289 -20.967 190 1HB SER 25 1HB SER 25 27.946 26.244 -23.340 191 2HB SER 25 2HB SER 25 28.590 24.607 -23.107 192 HG SER 25 HG SER 25 25.877 25.415 -22.772 193 H LEU 26 H LEU 26 27.138 25.438 -18.844 194 HA LEU 26 HA LEU 26 28.429 22.887 -18.079 195 1HB LEU 26 2HB LEU 26 26.434 24.647 -16.520 196 2HB LEU 26 1HB LEU 26 27.054 23.142 -15.930 197 HG LEU 26 HG LEU 26 29.480 24.133 -16.165 198 1HD1 LEU 26 1HD1 LEU 26 29.667 26.645 -15.970 199 2HD1 LEU 26 2HD1 LEU 26 27.884 26.807 -15.999 200 3HD1 LEU 26 3HD1 LEU 26 28.760 26.266 -17.442 201 1HD2 LEU 26 1HD2 LEU 26 27.711 25.190 -13.911 202 2HD2 LEU 26 2HD2 LEU 26 28.495 23.594 -14.009 203 3HD2 LEU 26 3HD2 LEU 26 29.496 25.049 -13.909 204 H ARG 27 H ARG 27 27.267 21.093 -17.090 205 HA ARG 27 HA ARG 27 24.715 20.266 -18.605 206 1HB ARG 27 1HB ARG 27 26.946 18.501 -17.466 207 2HB ARG 27 2HB ARG 27 25.399 17.836 -17.874 208 1HG ARG 27 1HG ARG 27 27.044 19.399 -19.958 209 2HG ARG 27 2HG ARG 27 27.434 17.737 -19.538 210 1HD ARG 27 1HD ARG 27 25.131 16.987 -20.291 211 2HD ARG 27 2HD ARG 27 24.739 18.660 -20.717 212 HE ARG 27 HE ARG 27 26.406 18.597 -22.549 213 1HH1 ARG 27 1HH1 ARG 27 26.077 15.333 -21.063 214 2HH1 ARG 27 2HH1 ARG 27 26.864 14.603 -22.551 215 1HH2 ARG 27 2HH2 ARG 27 27.266 17.624 -24.133 216 2HH2 ARG 27 1HH2 ARG 27 27.483 15.802 -24.150 217 H CYS 28 H CYS 28 24.769 21.875 -16.628 218 HA CYS 28 HA CYS 28 23.952 21.168 -14.125 219 1HB CYS 28 2HB CYS 28 23.040 23.639 -15.666 220 2HB CYS 28 1HB CYS 28 22.673 23.419 -13.937 221 H GLU 29 H GLU 29 21.430 21.419 -16.709 222 HA GLU 29 HA GLU 29 19.647 19.565 -15.078 223 1HB GLU 29 2HB GLU 29 18.719 22.304 -16.168 224 2HB GLU 29 1HB GLU 29 17.588 21.011 -15.788 225 1HG GLU 29 2HG GLU 29 18.272 21.026 -13.387 226 2HG GLU 29 1HG GLU 29 19.439 22.314 -13.714 227 HE2 GLU 29 HE2 GLU 29 16.245 21.408 -13.446 Start of MODEL 27 1 1H SER 1 1H SER 1 22.047 19.548 -11.529 2 2H SER 1 2H SER 1 21.134 20.314 -10.385 3 3H SER 1 3H SER 1 22.780 20.456 -10.359 4 HA SER 1 HA SER 1 22.041 18.977 -8.628 5 1HB SER 1 1HB SER 1 19.925 18.317 -9.744 6 2HB SER 1 2HB SER 1 20.833 17.338 -10.912 7 HG SER 1 HG SER 1 20.057 16.139 -9.146 8 H LYS 2 H LYS 2 23.452 17.896 -11.730 9 HA LYS 2 HA LYS 2 25.918 17.018 -10.267 10 1HB LYS 2 2HB LYS 2 26.213 14.837 -11.151 11 2HB LYS 2 1HB LYS 2 24.814 14.943 -10.103 12 1HG LYS 2 2HG LYS 2 23.284 14.819 -12.122 13 2HG LYS 2 1HG LYS 2 24.690 14.714 -13.178 14 1HD LYS 2 2HD LYS 2 25.381 12.567 -12.071 15 2HD LYS 2 1HD LYS 2 24.006 12.644 -10.981 16 1HE LYS 2 1HE LYS 2 23.689 12.489 -14.064 17 2HE LYS 2 2HE LYS 2 23.860 11.079 -13.031 18 1HZ LYS 2 1HZ LYS 2 21.657 13.059 -12.782 19 2HZ LYS 2 2HZ LYS 2 21.543 11.552 -13.449 20 3HZ LYS 2 3HZ LYS 2 21.848 11.720 -11.834 21 H TYR 3 H TYR 3 26.859 18.699 -11.237 22 HA TYR 3 HA TYR 3 26.747 19.267 -14.145 23 1HB TYR 3 1HB TYR 3 28.063 21.218 -13.705 24 2HB TYR 3 2HB TYR 3 26.803 21.087 -12.522 25 HD1 TYR 3 HD1 TYR 3 30.523 20.687 -13.043 26 HD2 TYR 3 HD2 TYR 3 27.397 21.007 -10.103 27 HE1 TYR 3 HE1 TYR 3 32.173 20.966 -11.294 28 HE2 TYR 3 HE2 TYR 3 29.080 21.278 -8.381 29 HH TYR 3 HH TYR 3 32.549 21.260 -9.136 30 H GLU 4 H GLU 4 28.329 19.093 -15.677 31 HA GLU 4 HA GLU 4 31.073 17.937 -15.032 32 1HB GLU 4 1HB GLU 4 29.661 16.005 -15.750 33 2HB GLU 4 2HB GLU 4 29.240 16.831 -17.245 34 1HG GLU 4 1HG GLU 4 31.648 16.731 -17.979 35 2HG GLU 4 2HG GLU 4 32.100 15.933 -16.484 36 HE2 GLU 4 HE2 GLU 4 29.976 14.014 -19.366 37 H TYR 5 H TYR 5 32.152 19.772 -15.513 38 HA TYR 5 HA TYR 5 31.665 21.132 -18.222 39 1HB TYR 5 2HB TYR 5 31.894 23.329 -17.445 40 2HB TYR 5 1HB TYR 5 30.524 22.490 -16.751 41 HD1 TYR 5 HD1 TYR 5 33.989 23.773 -15.941 42 HD2 TYR 5 HD2 TYR 5 30.169 22.639 -14.322 43 HE1 TYR 5 HE1 TYR 5 34.534 24.862 -13.842 44 HE2 TYR 5 HE2 TYR 5 30.774 23.695 -12.226 45 HH TYR 5 HH TYR 5 33.886 25.341 -11.791 46 H THR 6 H THR 6 33.425 21.058 -19.449 47 HA THR 6 HA THR 6 36.179 20.881 -18.294 48 HB THR 6 HB THR 6 36.783 20.843 -20.845 49 HG1 THR 6 HG1 THR 6 34.019 20.342 -21.015 50 1HG2 THR 6 1HG2 THR 6 36.242 18.468 -21.205 51 2HG2 THR 6 2HG2 THR 6 36.919 18.772 -19.586 52 3HG2 THR 6 3HG2 THR 6 35.165 18.483 -19.776 53 H VAL 7 H VAL 7 36.829 22.699 -17.527 54 HA VAL 7 HA VAL 7 36.973 25.182 -19.340 55 HB VAL 7 HB VAL 7 37.336 24.962 -16.305 56 1HG1 VAL 7 1HG2 VAL 7 37.939 27.557 -17.877 57 2HG1 VAL 7 2HG2 VAL 7 37.965 27.361 -16.097 58 3HG1 VAL 7 3HG2 VAL 7 39.139 26.502 -17.109 59 1HG2 VAL 7 1HG1 VAL 7 35.411 26.848 -17.854 60 2HG2 VAL 7 2HG1 VAL 7 34.944 25.295 -17.172 61 3HG2 VAL 7 3HG1 VAL 7 35.470 26.590 -16.085 62 HA DPR 8 HA PRO 8 41.449 23.960 -19.613 63 1HB DPR 8 2HB PRO 8 41.801 25.586 -21.253 64 2HB DPR 8 1HB PRO 8 41.937 24.161 -22.312 65 1HG DPR 8 1HG PRO 8 40.162 26.080 -22.945 66 2HG DPR 8 2HG PRO 8 39.669 24.355 -23.037 67 1HD DPR 8 1HD PRO 8 38.940 26.388 -20.887 68 2HD DPR 8 2HD PRO 8 37.956 25.050 -21.541 69 H SER 9 H SER 9 42.540 22.175 -20.577 70 HA SER 9 HA SER 9 40.860 19.695 -21.181 71 1HB SER 9 2HB SER 9 43.873 20.008 -20.651 72 2HB SER 9 1HB SER 9 43.063 18.498 -21.077 73 HG SER 9 HG SER 9 42.304 19.519 -22.981 74 H TYR 10 H TYR 10 39.813 20.845 -18.866 75 HA TYR 10 HA TYR 10 40.574 18.866 -16.710 76 1HB TYR 10 2HB TYR 10 41.598 21.524 -16.603 77 2HB TYR 10 1HB TYR 10 40.170 21.680 -15.641 78 HD1 TYR 10 HD1 TYR 10 43.509 20.041 -15.898 79 HD2 TYR 10 HD2 TYR 10 39.980 20.378 -13.442 80 HE1 TYR 10 HE1 TYR 10 44.676 19.016 -14.048 81 HE2 TYR 10 HE2 TYR 10 41.192 19.346 -11.615 82 HH TYR 10 HH TYR 10 43.091 18.474 -10.912 83 H THR 11 H THR 11 38.791 17.928 -16.963 84 HA THR 11 HA THR 11 36.061 19.038 -17.155 85 HB THR 11 HB THR 11 36.763 16.142 -16.411 86 HG1 THR 11 HG1 THR 11 37.901 16.842 -18.232 87 1HG2 THR 11 1HG2 THR 11 34.382 17.212 -18.063 88 2HG2 THR 11 2HG2 THR 11 34.279 16.608 -16.388 89 3HG2 THR 11 3HG2 THR 11 34.734 15.499 -17.710 90 H PHE 12 H PHE 12 35.238 20.173 -15.429 91 HA PHE 12 HA PHE 12 35.942 19.392 -12.565 92 1HB PHE 12 2HB PHE 12 34.503 21.818 -13.703 93 2HB PHE 12 1HB PHE 12 34.653 21.519 -11.995 94 HD1 PHE 12 HD1 PHE 12 36.551 22.533 -15.042 95 HD2 PHE 12 HD2 PHE 12 36.891 21.699 -10.825 96 HE1 PHE 12 HE1 PHE 12 38.699 23.646 -14.967 97 HE2 PHE 12 HE2 PHE 12 39.036 22.822 -10.798 98 HZ PHE 12 HZ PHE 12 39.964 23.802 -12.861 99 H ARG 13 H ARG 13 34.787 17.512 -12.365 100 HA ARG 13 HA ARG 13 31.792 17.476 -12.732 101 1HB ARG 13 2HB ARG 13 33.803 15.257 -11.945 102 2HB ARG 13 1HB ARG 13 32.061 14.996 -11.898 103 1HG ARG 13 2HG ARG 13 31.868 15.490 -14.324 104 2HG ARG 13 1HG ARG 13 33.609 15.734 -14.410 105 1HD ARG 13 1HD ARG 13 33.306 13.559 -15.254 106 2HD ARG 13 2HD ARG 13 33.908 13.269 -13.624 107 HE ARG 13 HE ARG 13 30.925 13.254 -13.769 108 1HH1 ARG 13 2HH2 ARG 13 33.759 11.079 -14.238 109 2HH1 ARG 13 1HH2 ARG 13 32.660 9.632 -13.980 110 1HH2 ARG 13 1HH1 ARG 13 29.842 11.535 -13.505 111 2HH2 ARG 13 2HH1 ARG 13 30.618 9.875 -13.598 112 H GLY 14 H GLY 14 30.422 17.601 -11.036 113 1HA GLY 14 2HA GLY 14 30.902 16.700 -8.313 114 2HA GLY 14 1HA GLY 14 31.210 18.432 -8.344 115 HA PRO 15 HA PRO 15 26.451 17.884 -8.137 116 1HB PRO 15 1HB PRO 15 25.711 17.921 -5.493 117 2HB PRO 15 2HB PRO 15 26.275 16.462 -6.332 118 1HG PRO 15 2HG PRO 15 27.871 18.281 -4.494 119 2HG PRO 15 1HG PRO 15 27.779 16.492 -4.465 120 1HD PRO 15 1HD PRO 15 29.827 17.952 -5.749 121 2HD PRO 15 2HD PRO 15 29.331 16.319 -6.268 122 H GLY 16 H GLY 16 25.016 19.546 -7.988 123 1HA GLY 16 1HA GLY 16 24.056 21.710 -7.585 124 2HA GLY 16 2HA GLY 16 25.340 22.020 -6.424 125 H CYS 17 H CYS 17 24.090 23.303 -9.112 126 HA CYS 17 HA CYS 17 26.322 23.599 -10.935 127 1HB CYS 17 2HB CYS 17 24.105 25.670 -11.079 128 2HB CYS 17 1HB CYS 17 24.988 24.846 -12.362 129 HA PRO 18 HA PRO 18 27.994 27.021 -8.200 130 1HB PRO 18 2HB PRO 18 30.652 26.725 -8.408 131 2HB PRO 18 1HB PRO 18 29.615 25.428 -7.766 132 1HG PRO 18 1HG PRO 18 30.770 25.680 -10.589 133 2HG PRO 18 2HG PRO 18 30.814 24.251 -9.516 134 1HD PRO 18 2HD PRO 18 28.853 24.689 -11.499 135 2HD PRO 18 1HD PRO 18 28.575 23.696 -10.047 136 H THR 19 H THR 19 30.590 28.325 -9.805 137 HA THR 19 HA THR 19 29.041 30.687 -10.664 138 HB THR 19 HB THR 19 31.360 31.591 -11.200 139 HG1 THR 19 HG1 THR 19 32.324 29.582 -11.543 140 1HG2 THR 19 1HG2 THR 19 32.198 31.924 -8.921 141 2HG2 THR 19 2HG2 THR 19 30.428 32.141 -8.986 142 3HG2 THR 19 3HG2 THR 19 31.117 30.640 -8.310 143 H VAL 20 H VAL 20 29.133 31.638 -12.729 144 HA VAL 20 HA VAL 20 29.520 29.711 -15.102 145 HB VAL 20 HB VAL 20 27.464 31.817 -14.861 146 1HG1 VAL 20 1HG2 VAL 20 27.963 31.214 -17.292 147 2HG1 VAL 20 2HG2 VAL 20 27.462 29.548 -17.001 148 3HG1 VAL 20 3HG2 VAL 20 26.273 30.880 -16.927 149 1HG2 VAL 20 1HG1 VAL 20 25.540 30.148 -14.568 150 2HG2 VAL 20 2HG1 VAL 20 26.733 29.995 -13.273 151 3HG2 VAL 20 3HG1 VAL 20 26.719 28.800 -14.581 152 H LYS 21 H LYS 21 31.269 31.230 -14.114 153 HA LYS 21 HA LYS 21 32.201 33.646 -15.473 154 1HB LYS 21 1HB LYS 21 33.961 31.281 -14.575 155 2HB LYS 21 2HB LYS 21 34.638 32.792 -15.111 156 1HG LYS 21 2HG LYS 21 32.847 32.535 -12.624 157 2HG LYS 21 1HG LYS 21 34.596 32.378 -12.609 158 1HD LYS 21 1HD LYS 21 34.840 34.726 -13.441 159 2HD LYS 21 2HD LYS 21 33.095 34.927 -13.460 160 1HE LYS 21 1HE LYS 21 34.668 34.279 -10.865 161 2HE LYS 21 2HE LYS 21 34.419 35.914 -11.459 162 1HZ LYS 21 1HZ LYS 21 32.739 35.327 -9.843 163 2HZ LYS 21 2HZ LYS 21 32.214 34.049 -10.748 164 3HZ LYS 21 3HZ LYS 21 32.016 35.592 -11.304 165 HA PRO 22 HA PRO 22 32.529 32.977 -19.672 166 1HB PRO 22 2HB PRO 22 35.103 34.521 -20.069 167 2HB PRO 22 1HB PRO 22 33.469 34.809 -20.712 168 1HG PRO 22 1HG PRO 22 34.313 36.331 -18.599 169 2HG PRO 22 2HG PRO 22 32.663 35.641 -18.525 170 1HD PRO 22 1HD PRO 22 35.212 34.445 -17.283 171 2HD PRO 22 2HD PRO 22 33.680 34.920 -16.500 172 H DAL 23 H ALA 23 32.811 31.101 -20.604 173 HA DAL 23 HA ALA 23 35.437 29.553 -20.449 174 1HB DAL 23 1HB ALA 23 33.694 29.730 -22.966 175 2HB DAL 23 2HB ALA 23 35.276 30.520 -22.728 176 3HB DAL 23 3HB ALA 23 35.165 28.740 -22.766 177 H ILE 24 H ILE 24 31.912 29.203 -20.782 178 HA ILE 24 HA ILE 24 32.118 26.618 -19.221 179 HB ILE 24 HB ILE 24 30.043 28.819 -19.508 180 1HG1 ILE 24 2HG1 ILE 24 31.808 29.013 -17.765 181 2HG1 ILE 24 1HG1 ILE 24 30.184 29.222 -17.192 182 1HG2 ILE 24 1HG2 ILE 24 29.047 26.217 -18.419 183 2HG2 ILE 24 2HG2 ILE 24 28.458 27.147 -19.803 184 3HG2 ILE 24 3HG2 ILE 24 28.234 27.793 -18.162 185 1HD1 ILE 24 1HD1 ILE 24 31.582 26.523 -16.710 186 2HD1 ILE 24 2HD1 ILE 24 31.989 27.949 -15.704 187 3HD1 ILE 24 3HD1 ILE 24 30.335 27.338 -15.734 188 H SER 25 H SER 25 30.777 25.139 -19.502 189 HA SER 25 HA SER 25 29.363 24.315 -21.951 190 1HB SER 25 2HB SER 25 31.685 23.777 -22.716 191 2HB SER 25 1HB SER 25 31.928 22.739 -21.300 192 HG SER 25 HG SER 25 29.913 22.423 -23.295 193 H LEU 26 H LEU 26 27.828 24.398 -20.215 194 HA LEU 26 HA LEU 26 28.153 22.467 -17.903 195 1HB LEU 26 2HB LEU 26 27.040 25.222 -18.094 196 2HB LEU 26 1HB LEU 26 25.755 24.197 -17.661 197 HG LEU 26 HG LEU 26 27.372 23.296 -15.696 198 1HD1 LEU 26 1HD2 LEU 26 29.094 24.900 -14.869 199 2HD1 LEU 26 2HD2 LEU 26 29.488 24.443 -16.541 200 3HD1 LEU 26 3HD2 LEU 26 28.739 26.008 -16.226 201 1HD2 LEU 26 1HD1 LEU 26 25.304 24.648 -15.288 202 2HD2 LEU 26 2HD1 LEU 26 26.217 26.153 -15.527 203 3HD2 LEU 26 3HD1 LEU 26 26.588 25.084 -14.145 204 H ARG 27 H ARG 27 26.672 20.954 -17.374 205 HA ARG 27 HA ARG 27 24.082 20.605 -18.794 206 1HB ARG 27 1HB ARG 27 26.259 18.430 -19.034 207 2HB ARG 27 2HB ARG 27 24.546 18.046 -19.126 208 1HG ARG 27 1HG ARG 27 24.249 19.553 -21.102 209 2HG ARG 27 2HG ARG 27 25.955 19.993 -21.040 210 1HD ARG 27 2HD ARG 27 26.602 17.581 -21.495 211 2HD ARG 27 1HD ARG 27 24.886 17.135 -21.556 212 HE ARG 27 HE ARG 27 25.157 19.280 -23.429 213 1HH1 ARG 27 2HH2 ARG 27 26.606 15.987 -23.233 214 2HH1 ARG 27 1HH2 ARG 27 26.770 15.977 -25.060 215 1HH2 ARG 27 2HH1 ARG 27 25.411 19.105 -25.454 216 2HH2 ARG 27 1HH1 ARG 27 26.145 17.605 -26.214 217 H CYS 28 H CYS 28 24.293 21.539 -16.500 218 HA CYS 28 HA CYS 28 24.680 20.087 -14.266 219 1HB CYS 28 2HB CYS 28 24.396 22.595 -14.441 220 2HB CYS 28 1HB CYS 28 22.638 22.344 -14.373 221 H GLU 29 H GLU 29 21.353 20.251 -15.677 222 HA GLU 29 HA GLU 29 20.338 18.309 -13.537 223 1HB GLU 29 1HB GLU 29 18.842 19.947 -15.662 224 2HB GLU 29 2HB GLU 29 18.045 18.711 -14.718 225 1HG GLU 29 1HG GLU 29 19.380 21.155 -13.418 226 2HG GLU 29 2HG GLU 29 17.707 21.126 -13.966 227 HE2 GLU 29 HE2 GLU 29 19.822 20.428 -11.619 Start of MODEL 28 1 1H SER 1 1H SER 1 21.505 18.409 -8.169 2 2H SER 1 2H SER 1 20.247 18.768 -9.178 3 3H SER 1 3H SER 1 21.023 17.316 -9.310 4 HA SER 1 HA SER 1 21.670 18.798 -11.111 5 1HB SER 1 2HB SER 1 22.624 20.569 -8.784 6 2HB SER 1 1HB SER 1 23.020 20.848 -10.489 7 HG SER 1 HG SER 1 20.776 20.924 -10.918 8 H LYS 2 H LYS 2 23.461 17.863 -11.978 9 HA LYS 2 HA LYS 2 25.877 17.125 -10.311 10 1HB LYS 2 2HB LYS 2 24.286 15.133 -10.493 11 2HB LYS 2 1HB LYS 2 24.394 15.236 -12.250 12 1HG LYS 2 1HG LYS 2 26.873 14.788 -12.094 13 2HG LYS 2 2HG LYS 2 26.744 14.705 -10.331 14 1HD LYS 2 1HD LYS 2 25.206 12.719 -10.536 15 2HD LYS 2 2HD LYS 2 25.298 12.784 -12.289 16 1HE LYS 2 1HE LYS 2 27.791 12.325 -10.498 17 2HE LYS 2 2HE LYS 2 26.735 11.034 -11.046 18 1HZ LYS 2 1HZ LYS 2 27.232 11.614 -13.350 19 2HZ LYS 2 2HZ LYS 2 28.618 11.276 -12.517 20 3HZ LYS 2 3HZ LYS 2 28.229 12.842 -12.874 21 H TYR 3 H TYR 3 26.808 18.893 -11.239 22 HA TYR 3 HA TYR 3 26.902 19.459 -14.143 23 1HB TYR 3 1HB TYR 3 28.219 21.384 -13.639 24 2HB TYR 3 2HB TYR 3 26.913 21.268 -12.512 25 HD1 TYR 3 HD1 TYR 3 27.413 21.376 -10.099 26 HD2 TYR 3 HD2 TYR 3 30.645 20.649 -12.849 27 HE1 TYR 3 HE1 TYR 3 29.026 21.749 -8.345 28 HE2 TYR 3 HE2 TYR 3 32.222 21.088 -11.093 29 HH TYR 3 HH TYR 3 31.164 21.847 -7.776 30 H GLU 4 H GLU 4 28.538 19.156 -15.598 31 HA GLU 4 HA GLU 4 31.200 17.886 -14.800 32 1HB GLU 4 2HB GLU 4 29.717 16.019 -15.497 33 2HB GLU 4 1HB GLU 4 29.356 16.815 -17.023 34 1HG GLU 4 2HG GLU 4 31.769 16.558 -17.717 35 2HG GLU 4 1HG GLU 4 32.143 15.760 -16.204 36 HE2 GLU 4 HE2 GLU 4 30.777 13.706 -19.243 37 H TYR 5 H TYR 5 32.442 19.618 -15.311 38 HA TYR 5 HA TYR 5 32.129 20.925 -18.072 39 1HB TYR 5 1HB TYR 5 32.348 23.098 -17.386 40 2HB TYR 5 2HB TYR 5 30.986 22.339 -16.588 41 HD1 TYR 5 HD1 TYR 5 34.366 23.853 -16.056 42 HD2 TYR 5 HD2 TYR 5 30.806 22.440 -14.111 43 HE1 TYR 5 HE1 TYR 5 35.006 24.989 -14.011 44 HE2 TYR 5 HE2 TYR 5 31.483 23.588 -12.081 45 HH TYR 5 HH TYR 5 32.998 24.845 -11.092 46 H THR 6 H THR 6 33.948 20.620 -19.209 47 HA THR 6 HA THR 6 36.600 20.273 -17.922 48 HB THR 6 HB THR 6 37.354 20.089 -20.404 49 HG1 THR 6 HG1 THR 6 35.564 21.163 -21.243 50 1HG2 THR 6 1HG2 THR 6 37.063 18.025 -19.126 51 2HG2 THR 6 2HG2 THR 6 36.528 17.818 -20.813 52 3HG2 THR 6 3HG2 THR 6 35.319 17.998 -19.507 53 H VAL 7 H VAL 7 37.672 21.910 -17.300 54 HA VAL 7 HA VAL 7 37.971 24.413 -19.060 55 HB VAL 7 HB VAL 7 39.021 24.132 -16.203 56 1HG1 VAL 7 1HG1 VAL 7 38.941 26.702 -17.933 57 2HG1 VAL 7 2HG1 VAL 7 40.382 25.728 -17.588 58 3HG1 VAL 7 3HG1 VAL 7 39.573 26.575 -16.262 59 1HG2 VAL 7 1HG2 VAL 7 37.270 25.745 -15.411 60 2HG2 VAL 7 2HG2 VAL 7 36.578 25.829 -17.063 61 3HG2 VAL 7 3HG2 VAL 7 36.537 24.310 -16.143 62 HA DPR 8 HA PRO 8 42.170 22.571 -19.866 63 1HB DPR 8 2HB PRO 8 42.435 23.949 -21.715 64 2HB DPR 8 1HB PRO 8 42.269 22.423 -22.614 65 1HG DPR 8 1HG PRO 8 40.620 24.453 -23.206 66 2HG DPR 8 2HG PRO 8 39.947 22.795 -23.023 67 1HD DPR 8 2HD PRO 8 39.776 25.107 -21.036 68 2HD DPR 8 1HD PRO 8 38.557 23.855 -21.400 69 H SER 9 H SER 9 42.947 20.626 -20.618 70 HA SER 9 HA SER 9 41.136 18.218 -20.911 71 1HB SER 9 2HB SER 9 44.137 18.429 -20.238 72 2HB SER 9 1HB SER 9 43.270 16.925 -20.537 73 HG SER 9 HG SER 9 44.262 17.743 -22.411 74 H TYR 10 H TYR 10 40.264 19.798 -18.609 75 HA TYR 10 HA TYR 10 40.818 17.882 -16.322 76 1HB TYR 10 1HB TYR 10 42.216 20.307 -16.443 77 2HB TYR 10 2HB TYR 10 40.805 20.842 -15.588 78 HD1 TYR 10 HD1 TYR 10 43.802 18.623 -15.462 79 HD2 TYR 10 HD2 TYR 10 40.332 19.906 -13.245 80 HE1 TYR 10 HE1 TYR 10 44.703 17.640 -13.458 81 HE2 TYR 10 HE2 TYR 10 41.274 18.905 -11.254 82 HH TYR 10 HH TYR 10 44.418 17.253 -11.291 83 H THR 11 H THR 11 38.947 17.144 -16.502 84 HA THR 11 HA THR 11 36.370 18.502 -16.821 85 HB THR 11 HB THR 11 36.714 15.622 -15.828 86 HG1 THR 11 HG1 THR 11 36.789 15.082 -18.011 87 1HG2 THR 11 1HG2 THR 11 34.298 16.430 -16.013 88 2HG2 THR 11 2HG2 THR 11 34.680 15.097 -17.139 89 3HG2 THR 11 3HG2 THR 11 34.577 16.775 -17.737 90 H PHE 12 H PHE 12 35.542 19.818 -15.236 91 HA PHE 12 HA PHE 12 36.043 19.238 -12.290 92 1HB PHE 12 1HB PHE 12 34.913 21.668 -13.788 93 2HB PHE 12 2HB PHE 12 34.731 21.502 -12.068 94 HD1 PHE 12 HD1 PHE 12 37.272 22.007 -14.778 95 HD2 PHE 12 HD2 PHE 12 36.686 21.697 -10.517 96 HE1 PHE 12 HE1 PHE 12 39.485 22.915 -14.373 97 HE2 PHE 12 HE2 PHE 12 38.892 22.622 -10.166 98 HZ PHE 12 HZ PHE 12 40.315 23.236 -12.083 99 H ARG 13 H ARG 13 34.839 17.375 -12.112 100 HA ARG 13 HA ARG 13 31.838 17.471 -12.468 101 1HB ARG 13 2HB ARG 13 33.694 15.162 -11.595 102 2HB ARG 13 1HB ARG 13 31.933 15.033 -11.572 103 1HG ARG 13 2HG ARG 13 31.842 15.464 -14.031 104 2HG ARG 13 1HG ARG 13 33.608 15.540 -14.079 105 1HD ARG 13 2HD ARG 13 33.711 13.128 -13.275 106 2HD ARG 13 1HD ARG 13 31.935 13.078 -13.267 107 HE ARG 13 HE ARG 13 32.586 13.939 -15.894 108 1HH1 ARG 13 1HH1 ARG 13 33.454 10.964 -14.056 109 2HH1 ARG 13 2HH1 ARG 13 33.596 10.054 -15.643 110 1HH2 ARG 13 1HH2 ARG 13 32.787 12.778 -17.570 111 2HH2 ARG 13 2HH2 ARG 13 33.247 11.004 -17.473 112 H GLY 14 H GLY 14 30.522 17.753 -10.771 113 1HA GLY 14 2HA GLY 14 31.062 17.025 -7.967 114 2HA GLY 14 1HA GLY 14 31.299 18.761 -8.181 115 HA PRO 15 HA PRO 15 26.552 17.927 -8.159 116 1HB PRO 15 1HB PRO 15 25.605 17.556 -5.594 117 2HB PRO 15 2HB PRO 15 26.260 16.250 -6.601 118 1HG PRO 15 1HG PRO 15 27.687 17.798 -4.406 119 2HG PRO 15 2HG PRO 15 27.631 16.022 -4.640 120 1HD PRO 15 2HD PRO 15 29.742 17.644 -5.544 121 2HD PRO 15 1HD PRO 15 29.282 16.129 -6.366 122 H GLY 16 H GLY 16 25.024 19.493 -7.872 123 1HA GLY 16 2HA GLY 16 24.012 21.614 -7.329 124 2HA GLY 16 1HA GLY 16 25.233 21.839 -6.087 125 H CYS 17 H CYS 17 24.254 22.823 -9.188 126 HA CYS 17 HA CYS 17 26.807 23.497 -10.421 127 1HB CYS 17 1HB CYS 17 24.070 24.605 -11.149 128 2HB CYS 17 2HB CYS 17 25.528 24.613 -12.161 129 HA PRO 18 HA PRO 18 26.828 27.436 -7.855 130 1HB PRO 18 1HB PRO 18 29.379 27.610 -7.053 131 2HB PRO 18 2HB PRO 18 28.326 26.245 -6.595 132 1HG PRO 18 1HG PRO 18 30.521 26.291 -8.700 133 2HG PRO 18 2HG PRO 18 30.127 24.999 -7.534 134 1HD PRO 18 2HD PRO 18 29.210 25.203 -10.270 135 2HD PRO 18 1HD PRO 18 28.566 24.087 -9.049 136 H THR 19 H THR 19 29.626 27.635 -10.050 137 HA THR 19 HA THR 19 28.915 30.533 -10.642 138 HB THR 19 HB THR 19 31.016 30.336 -9.613 139 HG1 THR 19 HG1 THR 19 32.134 31.509 -11.158 140 1HG2 THR 19 1HG2 THR 19 33.123 29.517 -10.689 141 2HG2 THR 19 2HG2 THR 19 32.038 28.137 -10.369 142 3HG2 THR 19 3HG2 THR 19 32.187 28.790 -12.022 143 H VAL 20 H VAL 20 29.457 31.346 -12.742 144 HA VAL 20 HA VAL 20 29.643 29.780 -15.079 145 HB VAL 20 HB VAL 20 27.543 29.173 -14.881 146 1HG1 VAL 20 1HG1 VAL 20 25.369 30.412 -15.175 147 2HG1 VAL 20 2HG1 VAL 20 26.269 31.950 -15.362 148 3HG1 VAL 20 3HG1 VAL 20 26.291 31.078 -13.810 149 1HG2 VAL 20 1HG2 VAL 20 27.597 30.860 -17.439 150 2HG2 VAL 20 2HG2 VAL 20 26.642 29.366 -17.199 151 3HG2 VAL 20 3HG2 VAL 20 28.413 29.298 -17.188 152 H LYS 21 H LYS 21 31.049 30.928 -14.891 153 HA LYS 21 HA LYS 21 31.305 33.903 -15.724 154 1HB LYS 21 2HB LYS 21 33.444 31.793 -14.924 155 2HB LYS 21 1HB LYS 21 33.934 33.054 -16.001 156 1HG LYS 21 2HG LYS 21 34.614 33.855 -14.002 157 2HG LYS 21 1HG LYS 21 33.201 34.828 -14.388 158 1HD LYS 21 2HD LYS 21 31.825 33.455 -12.796 159 2HD LYS 21 1HD LYS 21 33.237 32.455 -12.417 160 1HE LYS 21 1HE LYS 21 34.420 34.499 -11.476 161 2HE LYS 21 2HE LYS 21 32.995 35.489 -11.849 162 1HZ LYS 21 1HZ LYS 21 31.684 34.050 -10.374 163 2HZ LYS 21 2HZ LYS 21 32.957 34.712 -9.556 164 3HZ LYS 21 3HZ LYS 21 33.010 33.129 -10.026 165 HA PRO 22 HA PRO 22 30.895 33.549 -19.928 166 1HB PRO 22 2HB PRO 22 33.100 35.507 -20.625 167 2HB PRO 22 1HB PRO 22 31.348 35.590 -20.923 168 1HG PRO 22 2HG PRO 22 32.399 37.074 -18.878 169 2HG PRO 22 1HG PRO 22 30.890 36.160 -18.573 170 1HD PRO 22 1HD PRO 22 33.750 35.237 -17.892 171 2HD PRO 22 2HD PRO 22 32.342 35.450 -16.831 172 H DAL 23 H ALA 23 31.344 31.637 -20.813 173 HA DAL 23 HA ALA 23 33.942 30.367 -20.915 174 1HB DAL 23 1HB ALA 23 34.374 31.690 -22.983 175 2HB DAL 23 2HB ALA 23 34.259 29.947 -23.348 176 3HB DAL 23 3HB ALA 23 32.896 31.031 -23.736 177 H ILE 24 H ILE 24 32.394 29.229 -19.532 178 HA ILE 24 HA ILE 24 31.637 26.786 -20.751 179 HB ILE 24 HB ILE 24 30.703 27.439 -17.977 180 1HG1 ILE 24 2HG1 ILE 24 33.576 26.293 -18.369 181 2HG1 ILE 24 1HG1 ILE 24 33.275 28.001 -18.211 182 1HG2 ILE 24 1HG2 ILE 24 31.628 24.754 -19.248 183 2HG2 ILE 24 2HG2 ILE 24 29.940 25.219 -18.889 184 3HG2 ILE 24 3HG2 ILE 24 31.079 24.927 -17.555 185 1HD1 ILE 24 1HD1 ILE 24 32.202 27.745 -16.019 186 2HD1 ILE 24 2HD1 ILE 24 32.458 25.984 -16.107 187 3HD1 ILE 24 3HD1 ILE 24 33.892 27.079 -16.030 188 H SER 25 H SER 25 29.767 25.869 -21.055 189 HA SER 25 HA SER 25 27.054 27.259 -20.763 190 1HB SER 25 2HB SER 25 27.800 27.378 -23.161 191 2HB SER 25 1HB SER 25 28.072 25.625 -23.180 192 HG SER 25 HG SER 25 25.609 26.941 -22.613 193 H LEU 26 H LEU 26 26.697 26.103 -18.873 194 HA LEU 26 HA LEU 26 27.828 23.498 -18.308 195 1HB LEU 26 1HB LEU 26 25.748 25.126 -16.772 196 2HB LEU 26 2HB LEU 26 26.239 23.558 -16.219 197 HG LEU 26 HG LEU 26 27.320 25.111 -14.868 198 1HD1 LEU 26 1HD1 LEU 26 29.435 23.871 -16.618 199 2HD1 LEU 26 2HD1 LEU 26 28.646 23.140 -15.210 200 3HD1 LEU 26 3HD1 LEU 26 29.729 24.532 -14.980 201 1HD2 LEU 26 1HD2 LEU 26 28.728 26.457 -17.252 202 2HD2 LEU 26 2HD2 LEU 26 27.342 27.136 -16.365 203 3HD2 LEU 26 3HD2 LEU 26 28.893 26.901 -15.535 204 H ARG 27 H ARG 27 26.896 21.532 -17.945 205 HA ARG 27 HA ARG 27 24.222 20.865 -19.303 206 1HB ARG 27 1HB ARG 27 26.748 19.099 -19.131 207 2HB ARG 27 2HB ARG 27 25.151 18.435 -19.420 208 1HG ARG 27 2HG ARG 27 24.895 19.762 -21.525 209 2HG ARG 27 1HG ARG 27 26.481 20.488 -21.277 210 1HD ARG 27 1HD ARG 27 27.565 18.210 -21.454 211 2HD ARG 27 2HD ARG 27 25.976 17.465 -21.689 212 HE ARG 27 HE ARG 27 27.375 19.340 -23.647 213 1HH1 ARG 27 2HH1 ARG 27 24.609 17.083 -23.175 214 2HH1 ARG 27 1HH1 ARG 27 24.294 17.129 -24.982 215 1HH2 ARG 27 2HH2 ARG 27 26.889 19.281 -25.636 216 2HH2 ARG 27 1HH2 ARG 27 25.486 18.277 -26.262 217 H CYS 28 H CYS 28 24.396 21.963 -17.007 218 HA CYS 28 HA CYS 28 24.420 20.653 -14.675 219 1HB CYS 28 1HB CYS 28 24.092 23.111 -14.921 220 2HB CYS 28 2HB CYS 28 22.376 22.848 -15.295 221 H GLU 29 H GLU 29 21.311 20.605 -16.531 222 HA GLU 29 HA GLU 29 20.413 18.205 -14.852 223 1HB GLU 29 2HB GLU 29 19.279 20.480 -14.132 224 2HB GLU 29 1HB GLU 29 18.548 20.489 -15.720 225 1HG GLU 29 1HG GLU 29 16.864 19.667 -14.289 226 2HG GLU 29 2HG GLU 29 17.440 18.216 -15.102 227 HE2 GLU 29 HE2 GLU 29 17.449 20.092 -12.307 Start of MODEL 29 1 1H SER 1 1H SER 1 21.788 19.522 -11.789 2 2H SER 1 2H SER 1 22.338 20.341 -10.464 3 3H SER 1 3H SER 1 20.714 20.149 -10.701 4 HA SER 1 HA SER 1 21.466 18.686 -8.973 5 1HB SER 1 2HB SER 1 19.525 18.062 -10.381 6 2HB SER 1 1HB SER 1 20.601 17.230 -11.520 7 HG SER 1 HG SER 1 21.270 15.905 -9.774 8 H LYS 2 H LYS 2 23.263 17.917 -11.970 9 HA LYS 2 HA LYS 2 25.654 17.162 -10.357 10 1HB LYS 2 1HB LYS 2 24.378 14.982 -12.127 11 2HB LYS 2 2HB LYS 2 26.075 14.966 -11.672 12 1HG LYS 2 2HG LYS 2 25.433 14.878 -9.217 13 2HG LYS 2 1HG LYS 2 23.752 14.868 -9.696 14 1HD LYS 2 1HD LYS 2 24.080 12.638 -9.276 15 2HD LYS 2 2HD LYS 2 24.203 12.660 -11.021 16 1HE LYS 2 1HE LYS 2 26.760 12.582 -10.785 17 2HE LYS 2 2HE LYS 2 26.570 12.533 -9.024 18 1HZ LYS 2 1HZ LYS 2 25.466 10.513 -10.924 19 2HZ LYS 2 2HZ LYS 2 26.789 10.305 -9.956 20 3HZ LYS 2 3HZ LYS 2 25.289 10.465 -9.283 21 H TYR 3 H TYR 3 26.640 18.770 -11.327 22 HA TYR 3 HA TYR 3 26.489 19.352 -14.260 23 1HB TYR 3 1HB TYR 3 27.558 21.414 -13.819 24 2HB TYR 3 2HB TYR 3 26.385 21.174 -12.569 25 HD1 TYR 3 HD1 TYR 3 30.056 21.261 -13.311 26 HD2 TYR 3 HD2 TYR 3 27.131 20.938 -10.165 27 HE1 TYR 3 HE1 TYR 3 31.776 21.563 -11.670 28 HE2 TYR 3 HE2 TYR 3 28.893 21.199 -8.539 29 HH TYR 3 HH TYR 3 31.057 21.508 -8.173 30 H GLU 4 H GLU 4 28.188 19.322 -15.712 31 HA GLU 4 HA GLU 4 30.928 18.229 -14.910 32 1HB GLU 4 2HB GLU 4 29.675 16.327 -15.843 33 2HB GLU 4 1HB GLU 4 29.275 17.205 -17.299 34 1HG GLU 4 1HG GLU 4 32.183 16.543 -16.495 35 2HG GLU 4 2HG GLU 4 31.155 15.412 -17.373 36 HE2 GLU 4 HE2 GLU 4 30.999 15.540 -19.332 37 H TYR 5 H TYR 5 32.040 20.050 -15.203 38 HA TYR 5 HA TYR 5 31.628 21.695 -17.783 39 1HB TYR 5 1HB TYR 5 32.253 23.689 -16.886 40 2HB TYR 5 2HB TYR 5 30.818 23.056 -16.110 41 HD1 TYR 5 HD1 TYR 5 30.684 23.394 -13.703 42 HD2 TYR 5 HD2 TYR 5 34.543 23.637 -15.591 43 HE1 TYR 5 HE1 TYR 5 31.651 24.298 -11.670 44 HE2 TYR 5 HE2 TYR 5 35.458 24.563 -13.550 45 HH TYR 5 HH TYR 5 35.077 25.188 -11.473 46 H THR 6 H THR 6 33.245 21.404 -19.127 47 HA THR 6 HA THR 6 35.960 20.572 -18.137 48 HB THR 6 HB THR 6 34.950 20.657 -21.041 49 HG1 THR 6 HG1 THR 6 34.704 18.552 -19.167 50 1HG2 THR 6 1HG2 THR 6 36.461 18.701 -21.397 51 2HG2 THR 6 2HG2 THR 6 37.398 20.107 -20.798 52 3HG2 THR 6 3HG2 THR 6 36.976 18.769 -19.690 53 H VAL 7 H VAL 7 36.898 22.348 -17.450 54 HA VAL 7 HA VAL 7 37.308 24.729 -19.347 55 HB VAL 7 HB VAL 7 37.608 24.570 -16.306 56 1HG1 VAL 7 1HG1 VAL 7 38.367 26.934 -16.156 57 2HG1 VAL 7 2HG1 VAL 7 38.366 27.084 -17.942 58 3HG1 VAL 7 3HG1 VAL 7 39.500 25.986 -17.134 59 1HG2 VAL 7 1HG2 VAL 7 35.248 25.000 -17.185 60 2HG2 VAL 7 2HG2 VAL 7 35.798 26.500 -17.933 61 3HG2 VAL 7 3HG2 VAL 7 35.837 26.314 -16.154 62 HA DPR 8 HA PRO 8 41.751 23.505 -19.484 63 1HB DPR 8 1HB PRO 8 42.102 24.875 -21.309 64 2HB DPR 8 2HB PRO 8 42.266 23.337 -22.187 65 1HG DPR 8 1HG PRO 8 40.465 25.122 -23.054 66 2HG DPR 8 2HG PRO 8 39.993 23.391 -22.922 67 1HD DPR 8 1HD PRO 8 39.276 25.674 -21.018 68 2HD DPR 8 2HD PRO 8 38.264 24.300 -21.541 69 H SER 9 H SER 9 42.928 21.679 -20.112 70 HA SER 9 HA SER 9 41.454 19.037 -20.479 71 1HB SER 9 2HB SER 9 44.384 19.622 -19.746 72 2HB SER 9 1HB SER 9 43.705 18.019 -20.034 73 HG SER 9 HG SER 9 44.637 18.918 -21.898 74 H TYR 10 H TYR 10 40.228 20.511 -18.340 75 HA TYR 10 HA TYR 10 40.742 18.629 -16.032 76 1HB TYR 10 1HB TYR 10 41.791 21.284 -15.929 77 2HB TYR 10 2HB TYR 10 40.276 21.483 -15.120 78 HD1 TYR 10 HD1 TYR 10 43.611 19.828 -14.979 79 HD2 TYR 10 HD2 TYR 10 39.850 20.248 -12.910 80 HE1 TYR 10 HE1 TYR 10 44.579 18.868 -12.984 81 HE2 TYR 10 HE2 TYR 10 40.866 19.282 -10.932 82 HH TYR 10 HH TYR 10 42.680 18.436 -10.010 83 H THR 11 H THR 11 38.983 17.706 -16.429 84 HA THR 11 HA THR 11 36.329 18.935 -17.004 85 HB THR 11 HB THR 11 36.928 15.974 -16.508 86 HG1 THR 11 HG1 THR 11 37.049 17.473 -18.908 87 1HG2 THR 11 1HG2 THR 11 34.784 17.277 -18.307 88 2HG2 THR 11 2HG2 THR 11 35.095 15.530 -18.156 89 3HG2 THR 11 3HG2 THR 11 34.457 16.450 -16.761 90 H PHE 12 H PHE 12 35.254 19.938 -15.303 91 HA PHE 12 HA PHE 12 35.803 18.974 -12.464 92 1HB PHE 12 2HB PHE 12 34.456 21.488 -13.471 93 2HB PHE 12 1HB PHE 12 34.640 21.087 -11.789 94 HD1 PHE 12 HD1 PHE 12 36.916 21.146 -10.672 95 HD2 PHE 12 HD2 PHE 12 36.490 22.242 -14.820 96 HE1 PHE 12 HE1 PHE 12 39.079 22.244 -10.628 97 HE2 PHE 12 HE2 PHE 12 38.654 23.328 -14.726 98 HZ PHE 12 HZ PHE 12 39.966 23.342 -12.646 99 H ARG 13 H ARG 13 34.555 17.127 -12.452 100 HA ARG 13 HA ARG 13 31.553 17.303 -12.841 101 1HB ARG 13 2HB ARG 13 33.391 14.908 -12.154 102 2HB ARG 13 1HB ARG 13 31.634 14.775 -12.177 103 1HG ARG 13 1HG ARG 13 31.566 15.411 -14.586 104 2HG ARG 13 2HG ARG 13 33.327 15.537 -14.616 105 1HD ARG 13 2HD ARG 13 33.509 13.073 -14.038 106 2HD ARG 13 1HD ARG 13 31.737 12.955 -14.021 107 HE ARG 13 HE ARG 13 32.381 14.085 -16.570 108 1HH1 ARG 13 2HH2 ARG 13 33.169 10.939 -15.001 109 2HH1 ARG 13 1HH2 ARG 13 33.294 10.170 -16.663 110 1HH2 ARG 13 1HH1 ARG 13 32.559 13.073 -18.342 111 2HH2 ARG 13 2HH1 ARG 13 32.975 11.287 -18.402 112 H GLY 14 H GLY 14 30.238 17.454 -11.110 113 1HA GLY 14 1HA GLY 14 30.695 16.430 -8.411 114 2HA GLY 14 2HA GLY 14 31.140 18.135 -8.426 115 HA PRO 15 HA PRO 15 26.339 17.901 -8.336 116 1HB PRO 15 1HB PRO 15 25.444 17.514 -5.759 117 2HB PRO 15 2HB PRO 15 25.930 16.189 -6.836 118 1HG PRO 15 2HG PRO 15 27.571 17.485 -4.626 119 2HG PRO 15 1HG PRO 15 27.327 15.737 -4.934 120 1HD PRO 15 2HD PRO 15 29.560 17.194 -5.842 121 2HD PRO 15 1HD PRO 15 28.941 15.754 -6.692 122 H GLY 16 H GLY 16 24.985 19.594 -7.906 123 1HA GLY 16 2HA GLY 16 24.201 21.748 -7.122 124 2HA GLY 16 1HA GLY 16 25.570 21.829 -6.023 125 H CYS 17 H CYS 17 24.356 22.910 -9.036 126 HA CYS 17 HA CYS 17 26.799 23.447 -10.469 127 1HB CYS 17 1HB CYS 17 24.116 24.789 -10.944 128 2HB CYS 17 2HB CYS 17 25.450 24.595 -12.098 129 HA PRO 18 HA PRO 18 27.352 27.448 -8.058 130 1HB PRO 18 1HB PRO 18 29.930 27.334 -7.345 131 2HB PRO 18 2HB PRO 18 28.741 26.119 -6.809 132 1HG PRO 18 2HG PRO 18 30.876 25.827 -8.948 133 2HG PRO 18 1HG PRO 18 30.307 24.620 -7.764 134 1HD PRO 18 2HD PRO 18 29.393 24.990 -10.512 135 2HD PRO 18 1HD PRO 18 28.697 23.879 -9.317 136 H THR 19 H THR 19 30.124 27.275 -10.320 137 HA THR 19 HA THR 19 29.899 30.202 -10.905 138 HB THR 19 HB THR 19 32.064 29.753 -12.168 139 HG1 THR 19 HG1 THR 19 33.096 27.810 -11.745 140 1HG2 THR 19 1HG2 THR 19 32.239 28.979 -9.221 141 2HG2 THR 19 2HG2 THR 19 33.587 29.518 -10.263 142 3HG2 THR 19 3HG2 THR 19 32.252 30.639 -9.877 143 H VAL 20 H VAL 20 29.745 31.029 -12.962 144 HA VAL 20 HA VAL 20 29.223 29.319 -15.376 145 HB VAL 20 HB VAL 20 27.245 31.346 -14.621 146 1HG1 VAL 20 1HG1 VAL 20 27.438 31.142 -17.120 147 2HG1 VAL 20 2HG1 VAL 20 27.004 29.423 -17.051 148 3HG1 VAL 20 3HG1 VAL 20 25.802 30.680 -16.630 149 1HG2 VAL 20 1HG2 VAL 20 25.395 29.598 -14.307 150 2HG2 VAL 20 2HG2 VAL 20 26.765 29.297 -13.223 151 3HG2 VAL 20 3HG2 VAL 20 26.575 28.303 -14.679 152 H LYS 21 H LYS 21 31.102 30.336 -15.055 153 HA LYS 21 HA LYS 21 31.951 33.087 -15.702 154 1HB LYS 21 2HB LYS 21 33.556 30.473 -16.066 155 2HB LYS 21 1HB LYS 21 34.261 32.049 -16.369 156 1HG LYS 21 2HG LYS 21 33.952 32.796 -14.048 157 2HG LYS 21 1HG LYS 21 33.113 31.301 -13.625 158 1HD LYS 21 2HD LYS 21 35.162 29.959 -14.134 159 2HD LYS 21 1HD LYS 21 36.037 31.431 -14.593 160 1HE LYS 21 2HE LYS 21 35.783 32.316 -12.229 161 2HE LYS 21 1HE LYS 21 34.914 30.838 -11.771 162 1HZ LYS 21 1HZ LYS 21 37.270 30.681 -11.241 163 2HZ LYS 21 2HZ LYS 21 37.706 30.928 -12.815 164 3HZ LYS 21 3HZ LYS 21 36.896 29.553 -12.389 165 HA PRO 22 HA PRO 22 31.072 33.832 -19.818 166 1HB PRO 22 2HB PRO 22 33.535 35.454 -20.397 167 2HB PRO 22 1HB PRO 22 31.818 35.924 -20.373 168 1HG PRO 22 1HG PRO 22 33.397 36.636 -18.251 169 2HG PRO 22 2HG PRO 22 31.773 35.965 -17.914 170 1HD PRO 22 1HD PRO 22 34.427 34.402 -17.963 171 2HD PRO 22 2HD PRO 22 33.248 34.590 -16.639 172 H DAL 23 H ALA 23 31.090 31.841 -20.672 173 HA DAL 23 HA ALA 23 33.396 30.918 -22.474 174 1HB DAL 23 1HB ALA 23 30.390 30.889 -23.140 175 2HB DAL 23 2HB ALA 23 31.579 32.046 -23.796 176 3HB DAL 23 3HB ALA 23 31.703 30.322 -24.206 177 H ILE 24 H ILE 24 31.083 29.687 -20.082 178 HA ILE 24 HA ILE 24 31.843 26.874 -20.802 179 HB ILE 24 HB ILE 24 30.259 27.621 -18.369 180 1HG1 ILE 24 1HG1 ILE 24 33.319 27.229 -18.091 181 2HG1 ILE 24 2HG1 ILE 24 32.576 28.801 -18.261 182 1HG2 ILE 24 1HG2 ILE 24 30.976 25.393 -17.472 183 2HG2 ILE 24 2HG2 ILE 24 32.017 25.127 -18.920 184 3HG2 ILE 24 3HG2 ILE 24 30.228 25.177 -19.047 185 1HD1 ILE 24 1HD1 ILE 24 31.166 28.464 -16.243 186 2HD1 ILE 24 2HD1 ILE 24 32.935 28.305 -15.859 187 3HD1 ILE 24 3HD1 ILE 24 31.882 26.854 -16.026 188 H SER 25 H SER 25 30.314 25.493 -21.246 189 HA SER 25 HA SER 25 27.362 26.229 -21.673 190 1HB SER 25 1HB SER 25 28.567 25.922 -23.854 191 2HB SER 25 2HB SER 25 29.154 24.333 -23.325 192 HG SER 25 HG SER 25 26.428 25.133 -23.550 193 H LEU 26 H LEU 26 27.033 25.641 -19.464 194 HA LEU 26 HA LEU 26 28.148 23.179 -18.262 195 1HB LEU 26 2HB LEU 26 25.972 25.063 -17.145 196 2HB LEU 26 1HB LEU 26 26.462 23.598 -16.360 197 HG LEU 26 HG LEU 26 28.948 24.548 -16.371 198 1HD1 LEU 26 1HD1 LEU 26 28.386 26.609 -17.830 199 2HD1 LEU 26 2HD1 LEU 26 27.390 27.253 -16.512 200 3HD1 LEU 26 3HD1 LEU 26 29.156 27.041 -16.298 201 1HD2 LEU 26 1HD2 LEU 26 28.731 25.554 -14.186 202 2HD2 LEU 26 2HD2 LEU 26 27.726 24.106 -14.329 203 3HD2 LEU 26 3HD2 LEU 26 26.957 25.714 -14.382 204 H ARG 27 H ARG 27 27.017 21.391 -17.544 205 HA ARG 27 HA ARG 27 24.403 20.672 -18.928 206 1HB ARG 27 1HB ARG 27 24.961 18.499 -19.400 207 2HB ARG 27 2HB ARG 27 26.224 19.507 -20.083 208 1HG ARG 27 2HG ARG 27 27.786 18.769 -18.202 209 2HG ARG 27 1HG ARG 27 26.494 17.762 -17.571 210 1HD ARG 27 2HD ARG 27 27.835 16.235 -18.749 211 2HD ARG 27 1HD ARG 27 26.494 16.483 -19.856 212 HE ARG 27 HE ARG 27 28.855 18.266 -20.376 213 1HH1 ARG 27 1HH2 ARG 27 27.439 15.076 -21.267 214 2HH1 ARG 27 2HH2 ARG 27 28.483 15.062 -22.777 215 1HH2 ARG 27 2HH1 ARG 27 29.947 18.093 -22.101 216 2HH2 ARG 27 1HH1 ARG 27 29.789 16.638 -23.207 217 H CYS 28 H CYS 28 24.508 21.944 -16.712 218 HA CYS 28 HA CYS 28 24.323 20.809 -14.295 219 1HB CYS 28 2HB CYS 28 24.056 23.245 -14.728 220 2HB CYS 28 1HB CYS 28 22.370 22.980 -15.225 221 H GLU 29 H GLU 29 21.370 20.660 -16.384 222 HA GLU 29 HA GLU 29 20.365 18.293 -14.750 223 1HB GLU 29 2HB GLU 29 18.684 20.825 -15.311 224 2HB GLU 29 1HB GLU 29 17.949 19.273 -14.928 225 1HG GLU 29 2HG GLU 29 19.047 19.229 -12.686 226 2HG GLU 29 1HG GLU 29 19.827 20.781 -13.023 227 HE2 GLU 29 HE2 GLU 29 16.024 20.523 -11.828 Start of MODEL 30 1 1H SER 1 1H SER 1 20.937 20.670 -10.606 2 2H SER 1 2H SER 1 21.983 20.011 -11.701 3 3H SER 1 3H SER 1 22.564 20.721 -10.327 4 HA SER 1 HA SER 1 21.530 19.073 -8.936 5 1HB SER 1 1HB SER 1 19.579 18.674 -10.411 6 2HB SER 1 2HB SER 1 20.611 17.811 -11.566 7 HG SER 1 HG SER 1 21.130 16.357 -9.872 8 H LYS 2 H LYS 2 23.336 18.311 -11.928 9 HA LYS 2 HA LYS 2 25.618 17.293 -10.313 10 1HB LYS 2 1HB LYS 2 24.217 15.309 -12.210 11 2HB LYS 2 2HB LYS 2 25.902 15.141 -11.729 12 1HG LYS 2 1HG LYS 2 25.249 14.960 -9.318 13 2HG LYS 2 2HG LYS 2 23.548 15.138 -9.754 14 1HD LYS 2 1HD LYS 2 23.671 13.004 -11.130 15 2HD LYS 2 2HD LYS 2 25.374 12.823 -10.697 16 1HE LYS 2 2HE LYS 2 24.735 12.618 -8.252 17 2HE LYS 2 1HE LYS 2 23.025 12.800 -8.686 18 1HZ LYS 2 1HZ LYS 2 23.229 10.798 -10.071 19 2HZ LYS 2 2HZ LYS 2 23.650 10.471 -8.508 20 3HZ LYS 2 3HZ LYS 2 24.820 10.628 -9.663 21 H TYR 3 H TYR 3 26.767 18.827 -11.197 22 HA TYR 3 HA TYR 3 26.668 19.663 -14.044 23 1HB TYR 3 1HB TYR 3 28.203 21.412 -13.472 24 2HB TYR 3 2HB TYR 3 26.891 21.337 -12.337 25 HD1 TYR 3 HD1 TYR 3 27.415 21.186 -9.909 26 HD2 TYR 3 HD2 TYR 3 30.558 20.504 -12.766 27 HE1 TYR 3 HE1 TYR 3 29.068 21.208 -8.137 28 HE2 TYR 3 HE2 TYR 3 32.177 20.533 -10.972 29 HH TYR 3 HH TYR 3 31.196 21.030 -7.589 30 H GLU 4 H GLU 4 28.267 19.555 -15.583 31 HA GLU 4 HA GLU 4 30.915 18.157 -15.068 32 1HB GLU 4 2HB GLU 4 29.408 16.379 -15.979 33 2HB GLU 4 1HB GLU 4 29.027 17.384 -17.373 34 1HG GLU 4 1HG GLU 4 31.454 17.240 -18.099 35 2HG GLU 4 2HG GLU 4 31.817 16.207 -16.729 36 HE2 GLU 4 HE2 GLU 4 29.998 13.444 -17.928 37 H TYR 5 H TYR 5 32.020 20.043 -15.301 38 HA TYR 5 HA TYR 5 31.596 21.685 -17.865 39 1HB TYR 5 2HB TYR 5 32.080 23.726 -16.930 40 2HB TYR 5 1HB TYR 5 30.671 22.992 -16.197 41 HD1 TYR 5 HD1 TYR 5 30.621 22.536 -13.729 42 HD2 TYR 5 HD2 TYR 5 34.106 24.278 -15.557 43 HE1 TYR 5 HE1 TYR 5 31.424 23.279 -11.558 44 HE2 TYR 5 HE2 TYR 5 34.870 24.995 -13.371 45 HH TYR 5 HH TYR 5 33.003 24.314 -10.433 46 H THR 6 H THR 6 33.183 21.272 -19.143 47 HA THR 6 HA THR 6 35.904 20.549 -18.123 48 HB THR 6 HB THR 6 34.879 20.420 -21.020 49 HG1 THR 6 HG1 THR 6 34.247 18.316 -20.535 50 1HG2 THR 6 1HG2 THR 6 37.321 19.856 -20.752 51 2HG2 THR 6 2HG2 THR 6 36.362 18.418 -21.225 52 3HG2 THR 6 3HG2 THR 6 36.892 18.621 -19.534 53 H VAL 7 H VAL 7 36.951 22.303 -17.630 54 HA VAL 7 HA VAL 7 37.279 24.595 -19.650 55 HB VAL 7 HB VAL 7 37.849 24.557 -16.648 56 1HG1 VAL 7 1HG1 VAL 7 38.560 26.949 -16.703 57 2HG1 VAL 7 2HG1 VAL 7 38.348 27.004 -18.481 58 3HG1 VAL 7 3HG1 VAL 7 39.598 25.976 -17.758 59 1HG2 VAL 7 1HG2 VAL 7 35.409 24.884 -17.253 60 2HG2 VAL 7 2HG2 VAL 7 35.811 26.350 -18.156 61 3HG2 VAL 7 3HG2 VAL 7 36.062 26.284 -16.384 62 HA DPR 8 HA PRO 8 41.679 23.252 -20.017 63 1HB DPR 8 1HB PRO 8 41.923 24.487 -21.954 64 2HB DPR 8 2HB PRO 8 42.008 22.889 -22.731 65 1HG DPR 8 1HG PRO 8 40.176 24.640 -23.597 66 2HG DPR 8 2HG PRO 8 39.692 22.931 -23.312 67 1HD DPR 8 2HD PRO 8 39.131 25.353 -21.531 68 2HD DPR 8 1HD PRO 8 38.070 23.962 -21.886 69 H SER 9 H SER 9 42.779 21.377 -20.550 70 HA SER 9 HA SER 9 41.266 18.734 -20.656 71 1HB SER 9 1HB SER 9 44.226 19.330 -20.076 72 2HB SER 9 2HB SER 9 43.518 17.719 -20.214 73 HG SER 9 HG SER 9 44.389 18.457 -22.175 74 H TYR 10 H TYR 10 40.133 20.368 -18.610 75 HA TYR 10 HA TYR 10 40.680 18.654 -16.182 76 1HB TYR 10 2HB TYR 10 41.710 21.327 -16.302 77 2HB TYR 10 1HB TYR 10 40.216 21.561 -15.463 78 HD1 TYR 10 HD1 TYR 10 39.876 20.496 -13.161 79 HD2 TYR 10 HD2 TYR 10 43.572 19.943 -15.311 80 HE1 TYR 10 HE1 TYR 10 40.956 19.674 -11.154 81 HE2 TYR 10 HE2 TYR 10 44.608 19.130 -13.285 82 HH TYR 10 HH TYR 10 44.361 18.675 -11.135 83 H THR 11 H THR 11 38.912 17.703 -16.484 84 HA THR 11 HA THR 11 36.236 18.883 -17.066 85 HB THR 11 HB THR 11 36.828 15.977 -16.318 86 HG1 THR 11 HG1 THR 11 36.891 17.239 -18.852 87 1HG2 THR 11 1HG2 THR 11 34.353 16.478 -16.539 88 2HG2 THR 11 2HG2 THR 11 34.641 17.124 -18.173 89 3HG2 THR 11 3HG2 THR 11 34.931 15.399 -17.842 90 H PHE 12 H PHE 12 35.211 20.038 -15.404 91 HA PHE 12 HA PHE 12 35.787 19.248 -12.514 92 1HB PHE 12 1HB PHE 12 34.459 21.706 -13.716 93 2HB PHE 12 2HB PHE 12 34.519 21.403 -12.002 94 HD1 PHE 12 HD1 PHE 12 36.584 22.384 -14.948 95 HD2 PHE 12 HD2 PHE 12 36.703 21.525 -10.724 96 HE1 PHE 12 HE1 PHE 12 38.756 23.440 -14.766 97 HE2 PHE 12 HE2 PHE 12 38.874 22.592 -10.592 98 HZ PHE 12 HZ PHE 12 39.922 23.555 -12.602 99 H ARG 13 H ARG 13 34.545 17.492 -12.171 100 HA ARG 13 HA ARG 13 31.551 17.570 -12.716 101 1HB ARG 13 2HB ARG 13 33.413 15.182 -12.121 102 2HB ARG 13 1HB ARG 13 31.655 15.045 -12.233 103 1HG ARG 13 1HG ARG 13 31.711 15.841 -14.588 104 2HG ARG 13 2HG ARG 13 33.476 15.944 -14.522 105 1HD ARG 13 1HD ARG 13 33.575 13.430 -14.073 106 2HD ARG 13 2HD ARG 13 31.805 13.365 -14.201 107 HE ARG 13 HE ARG 13 32.915 14.636 -16.601 108 1HH1 ARG 13 2HH1 ARG 13 32.588 11.321 -15.229 109 2HH1 ARG 13 1HH1 ARG 13 32.676 10.635 -16.928 110 1HH2 ARG 13 2HH2 ARG 13 32.996 13.708 -18.426 111 2HH2 ARG 13 1HH2 ARG 13 32.888 11.884 -18.591 112 H GLY 14 H GLY 14 30.180 17.557 -11.017 113 1HA GLY 14 2HA GLY 14 30.563 16.303 -8.434 114 2HA GLY 14 1HA GLY 14 31.018 17.993 -8.236 115 HA PRO 15 HA PRO 15 26.215 17.806 -8.139 116 1HB PRO 15 1HB PRO 15 25.421 17.486 -5.524 117 2HB PRO 15 2HB PRO 15 25.852 16.137 -6.593 118 1HG PRO 15 2HG PRO 15 27.590 17.459 -4.477 119 2HG PRO 15 1HG PRO 15 27.315 15.707 -4.739 120 1HD PRO 15 2HD PRO 15 29.529 17.116 -5.760 121 2HD PRO 15 1HD PRO 15 28.859 15.670 -6.561 122 H GLY 16 H GLY 16 24.916 19.547 -7.708 123 1HA GLY 16 2HA GLY 16 24.197 21.744 -6.995 124 2HA GLY 16 1HA GLY 16 25.532 21.771 -5.852 125 H CYS 17 H CYS 17 24.462 22.885 -8.918 126 HA CYS 17 HA CYS 17 26.994 23.366 -10.215 127 1HB CYS 17 1HB CYS 17 24.344 24.695 -10.877 128 2HB CYS 17 2HB CYS 17 25.751 24.514 -11.944 129 HA PRO 18 HA PRO 18 27.548 27.379 -7.880 130 1HB PRO 18 2HB PRO 18 30.113 27.262 -7.128 131 2HB PRO 18 1HB PRO 18 28.907 26.070 -6.580 132 1HG PRO 18 2HG PRO 18 31.056 25.714 -8.697 133 2HG PRO 18 1HG PRO 18 30.492 24.544 -7.475 134 1HD PRO 18 1HD PRO 18 29.587 24.800 -10.227 135 2HD PRO 18 2HD PRO 18 28.857 23.761 -8.988 136 H THR 19 H THR 19 30.360 27.140 -10.094 137 HA THR 19 HA THR 19 30.199 30.048 -10.716 138 HB THR 19 HB THR 19 32.296 29.527 -12.065 139 HG1 THR 19 HG1 THR 19 33.267 27.545 -11.697 140 1HG2 THR 19 1HG2 THR 19 32.604 30.392 -9.779 141 2HG2 THR 19 2HG2 THR 19 32.555 28.730 -9.131 142 3HG2 THR 19 3HG2 THR 19 33.881 29.226 -10.222 143 H VAL 20 H VAL 20 30.018 30.897 -12.784 144 HA VAL 20 HA VAL 20 29.368 29.259 -15.174 145 HB VAL 20 HB VAL 20 27.349 31.226 -14.357 146 1HG1 VAL 20 1HG2 VAL 20 27.483 30.961 -16.859 147 2HG1 VAL 20 2HG2 VAL 20 27.079 29.238 -16.729 148 3HG1 VAL 20 3HG2 VAL 20 25.869 30.488 -16.311 149 1HG2 VAL 20 1HG1 VAL 20 26.935 29.231 -12.890 150 2HG2 VAL 20 2HG1 VAL 20 25.537 29.474 -13.952 151 3HG2 VAL 20 3HG1 VAL 20 26.728 28.186 -14.305 152 H LYS 21 H LYS 21 31.183 30.306 -15.053 153 HA LYS 21 HA LYS 21 31.931 33.108 -15.543 154 1HB LYS 21 2HB LYS 21 33.551 30.666 -16.466 155 2HB LYS 21 1HB LYS 21 34.180 32.288 -16.525 156 1HG LYS 21 1HG LYS 21 33.419 30.859 -13.908 157 2HG LYS 21 2HG LYS 21 35.014 30.807 -14.641 158 1HD LYS 21 1HD LYS 21 35.206 33.330 -14.401 159 2HD LYS 21 2HD LYS 21 33.621 33.340 -13.644 160 1HE LYS 21 2HE LYS 21 35.090 33.470 -11.816 161 2HE LYS 21 1HE LYS 21 34.588 31.786 -11.779 162 1HZ LYS 21 1HZ LYS 21 36.978 32.019 -11.476 163 2HZ LYS 21 2HZ LYS 21 36.715 31.231 -12.905 164 3HZ LYS 21 3HZ LYS 21 37.157 32.823 -12.909 165 HA PRO 22 HA PRO 22 30.522 34.105 -19.482 166 1HB PRO 22 1HB PRO 22 32.763 36.018 -20.129 167 2HB PRO 22 2HB PRO 22 31.025 36.316 -19.887 168 1HG PRO 22 2HG PRO 22 32.768 36.976 -17.878 169 2HG PRO 22 1HG PRO 22 31.249 36.137 -17.445 170 1HD PRO 22 1HD PRO 22 33.996 34.822 -17.918 171 2HD PRO 22 2HD PRO 22 32.963 34.790 -16.466 172 H DAL 23 H ALA 23 30.493 32.463 -20.814 173 HA DAL 23 HA ALA 23 32.921 31.461 -22.327 174 1HB DAL 23 1HB ALA 23 31.675 31.275 -24.467 175 2HB DAL 23 2HB ALA 23 30.281 32.131 -23.753 176 3HB DAL 23 3HB ALA 23 31.839 32.977 -23.958 177 H ILE 24 H ILE 24 32.846 29.811 -20.742 178 HA ILE 24 HA ILE 24 32.630 27.668 -20.441 179 HB ILE 24 HB ILE 24 31.777 29.460 -18.619 180 1HG1 ILE 24 2HG1 ILE 24 31.703 26.512 -18.161 181 2HG1 ILE 24 1HG1 ILE 24 33.104 27.580 -18.224 182 1HG2 ILE 24 1HG2 ILE 24 29.173 27.861 -18.883 183 2HG2 ILE 24 2HG2 ILE 24 29.575 28.964 -17.544 184 3HG2 ILE 24 3HG2 ILE 24 29.377 29.603 -19.201 185 1HD1 ILE 24 1HD1 ILE 24 32.553 26.879 -15.878 186 2HD1 ILE 24 2HD1 ILE 24 31.039 27.805 -15.980 187 3HD1 ILE 24 3HD1 ILE 24 32.596 28.657 -16.098 188 H SER 25 H SER 25 31.179 25.937 -19.664 189 HA SER 25 HA SER 25 29.094 25.031 -21.635 190 1HB SER 25 2HB SER 25 31.166 24.433 -22.894 191 2HB SER 25 1HB SER 25 31.748 23.475 -21.521 192 HG SER 25 HG SER 25 29.314 23.079 -22.947 193 H LEU 26 H LEU 26 27.676 24.265 -20.201 194 HA LEU 26 HA LEU 26 28.541 22.485 -17.858 195 1HB LEU 26 1HB LEU 26 26.706 24.976 -17.809 196 2HB LEU 26 2HB LEU 26 26.325 23.625 -16.791 197 HG LEU 26 HG LEU 26 28.590 23.784 -15.660 198 1HD1 LEU 26 1HD1 LEU 26 28.904 26.503 -17.121 199 2HD1 LEU 26 2HD1 LEU 26 29.912 25.068 -17.390 200 3HD1 LEU 26 3HD1 LEU 26 29.961 25.868 -15.825 201 1HD2 LEU 26 1HD2 LEU 26 26.540 24.769 -14.628 202 2HD2 LEU 26 2HD2 LEU 26 26.803 26.295 -15.498 203 3HD2 LEU 26 3HD2 LEU 26 27.945 25.768 -14.227 204 H ARG 27 H ARG 27 27.004 21.029 -17.166 205 HA ARG 27 HA ARG 27 24.535 20.445 -18.789 206 1HB ARG 27 2HB ARG 27 26.770 18.338 -18.467 207 2HB ARG 27 1HB ARG 27 25.092 17.895 -18.711 208 1HG ARG 27 2HG ARG 27 25.012 19.090 -20.878 209 2HG ARG 27 1HG ARG 27 26.680 19.609 -20.705 210 1HD ARG 27 2HD ARG 27 25.875 16.617 -20.809 211 2HD ARG 27 1HD ARG 27 26.179 17.577 -22.244 212 HE ARG 27 HE ARG 27 28.273 16.716 -20.241 213 1HH1 ARG 27 1HH1 ARG 27 27.723 18.523 -23.305 214 2HH1 ARG 27 2HH1 ARG 27 29.526 18.466 -23.636 215 1HH2 ARG 27 2HH2 ARG 27 30.255 16.740 -20.757 216 2HH2 ARG 27 1HH2 ARG 27 30.844 17.535 -22.303 217 H CYS 28 H CYS 28 24.514 21.702 -16.639 218 HA CYS 28 HA CYS 28 24.507 20.622 -14.180 219 1HB CYS 28 2HB CYS 28 24.229 23.040 -14.664 220 2HB CYS 28 1HB CYS 28 22.518 22.772 -15.067 221 H GLU 29 H GLU 29 21.436 20.452 -16.100 222 HA GLU 29 HA GLU 29 20.199 18.640 -13.953 223 1HB GLU 29 1HB GLU 29 18.946 20.037 -16.405 224 2HB GLU 29 2HB GLU 29 18.090 18.817 -15.474 225 1HG GLU 29 1HG GLU 29 18.186 20.221 -13.412 226 2HG GLU 29 2HG GLU 29 19.062 21.479 -14.295 227 HE2 GLU 29 HE2 GLU 29 16.200 20.019 -13.623 Start of MODEL 31 1 1H SER 1 1H SER 1 21.348 21.028 -10.195 2 2H SER 1 2H SER 1 22.068 20.171 -11.410 3 3H SER 1 3H SER 1 22.992 21.040 -10.352 4 HA SER 1 HA SER 1 22.340 19.661 -8.516 5 1HB SER 1 2HB SER 1 20.943 17.665 -8.840 6 2HB SER 1 1HB SER 1 20.078 19.134 -9.324 7 HG SER 1 HG SER 1 20.711 18.684 -11.483 8 H LYS 2 H LYS 2 23.296 18.320 -11.723 9 HA LYS 2 HA LYS 2 25.790 17.189 -10.438 10 1HB LYS 2 1HB LYS 2 24.014 15.356 -10.604 11 2HB LYS 2 2HB LYS 2 23.942 15.614 -12.347 12 1HG LYS 2 1HG LYS 2 26.367 14.955 -12.517 13 2HG LYS 2 2HG LYS 2 26.425 14.721 -10.764 14 1HD LYS 2 2HD LYS 2 24.702 12.890 -10.951 15 2HD LYS 2 1HD LYS 2 24.608 13.109 -12.692 16 1HE LYS 2 2HE LYS 2 27.230 12.289 -11.247 17 2HE LYS 2 1HE LYS 2 26.009 11.142 -11.773 18 1HZ LYS 2 1HZ LYS 2 27.451 12.985 -13.607 19 2HZ LYS 2 2HZ LYS 2 26.302 11.890 -14.064 20 3HZ LYS 2 3HZ LYS 2 27.735 11.368 -13.429 21 H TYR 3 H TYR 3 26.781 18.946 -11.317 22 HA TYR 3 HA TYR 3 26.579 19.707 -14.207 23 1HB TYR 3 2HB TYR 3 27.713 21.705 -13.670 24 2HB TYR 3 1HB TYR 3 26.569 21.420 -12.406 25 HD1 TYR 3 HD1 TYR 3 30.227 21.362 -13.252 26 HD2 TYR 3 HD2 TYR 3 27.365 21.070 -10.049 27 HE1 TYR 3 HE1 TYR 3 31.988 21.594 -11.647 28 HE2 TYR 3 HE2 TYR 3 29.155 21.238 -8.462 29 HH TYR 3 HH TYR 3 32.549 21.641 -9.483 30 H GLU 4 H GLU 4 28.239 19.733 -15.702 31 HA GLU 4 HA GLU 4 30.930 18.395 -15.100 32 1HB GLU 4 1HB GLU 4 29.466 16.717 -16.232 33 2HB GLU 4 2HB GLU 4 29.140 17.841 -17.544 34 1HG GLU 4 2HG GLU 4 31.601 17.728 -18.180 35 2HG GLU 4 1HG GLU 4 31.871 16.534 -16.927 36 HE2 GLU 4 HE2 GLU 4 30.234 14.812 -16.975 37 H TYR 5 H TYR 5 32.324 20.050 -15.393 38 HA TYR 5 HA TYR 5 32.004 21.837 -17.869 39 1HB TYR 5 2HB TYR 5 32.607 23.820 -16.961 40 2HB TYR 5 1HB TYR 5 31.207 23.158 -16.168 41 HD1 TYR 5 HD1 TYR 5 31.069 23.348 -13.753 42 HD2 TYR 5 HD2 TYR 5 34.887 23.872 -15.670 43 HE1 TYR 5 HE1 TYR 5 32.002 24.217 -11.696 44 HE2 TYR 5 HE2 TYR 5 35.767 24.775 -13.602 45 HH TYR 5 HH TYR 5 35.380 25.290 -11.498 46 H THR 6 H THR 6 33.559 21.344 -19.164 47 HA THR 6 HA THR 6 36.216 20.382 -18.189 48 HB THR 6 HB THR 6 35.236 20.535 -21.101 49 HG1 THR 6 HG1 THR 6 34.440 18.456 -20.778 50 1HG2 THR 6 1HG2 THR 6 36.570 18.444 -21.424 51 2HG2 THR 6 2HG2 THR 6 37.077 18.487 -19.714 52 3HG2 THR 6 3HG2 THR 6 37.624 19.767 -20.834 53 H VAL 7 H VAL 7 37.465 21.967 -17.619 54 HA VAL 7 HA VAL 7 38.076 24.259 -19.572 55 HB VAL 7 HB VAL 7 37.982 24.418 -16.519 56 1HG1 VAL 7 1HG2 VAL 7 39.902 25.817 -17.335 57 2HG1 VAL 7 2HG2 VAL 7 38.816 26.760 -18.370 58 3HG1 VAL 7 3HG2 VAL 7 38.652 26.824 -16.587 59 1HG2 VAL 7 1HG1 VAL 7 36.274 26.047 -18.535 60 2HG2 VAL 7 2HG1 VAL 7 36.158 26.117 -16.749 61 3HG2 VAL 7 3HG1 VAL 7 35.715 24.640 -17.618 62 HA DPR 8 HA PRO 8 42.451 22.940 -18.790 63 1HB DPR 8 1HB PRO 8 43.212 24.337 -20.478 64 2HB DPR 8 2HB PRO 8 43.490 22.805 -21.339 65 1HG DPR 8 1HG PRO 8 41.970 24.679 -22.510 66 2HG DPR 8 2HG PRO 8 41.418 22.968 -22.518 67 1HD DPR 8 1HD PRO 8 40.407 25.248 -20.754 68 2HD DPR 8 2HD PRO 8 39.481 23.912 -21.488 69 H SER 9 H SER 9 43.668 21.067 -19.258 70 HA SER 9 HA SER 9 42.110 18.522 -19.915 71 1HB SER 9 2HB SER 9 44.527 18.669 -20.484 72 2HB SER 9 1HB SER 9 44.934 18.884 -18.766 73 HG SER 9 HG SER 9 45.075 16.728 -19.454 74 H TYR 10 H TYR 10 40.621 19.957 -18.069 75 HA TYR 10 HA TYR 10 40.600 18.089 -15.709 76 1HB TYR 10 2HB TYR 10 41.449 20.960 -15.463 77 2HB TYR 10 1HB TYR 10 39.980 20.724 -14.593 78 HD1 TYR 10 HD1 TYR 10 43.569 19.738 -14.727 79 HD2 TYR 10 HD2 TYR 10 39.861 19.184 -12.596 80 HE1 TYR 10 HE1 TYR 10 44.753 18.730 -12.871 81 HE2 TYR 10 HE2 TYR 10 41.085 18.185 -10.767 82 HH TYR 10 HH TYR 10 43.058 17.582 -9.971 83 H THR 11 H THR 11 38.870 17.255 -16.369 84 HA THR 11 HA THR 11 36.338 18.672 -17.169 85 HB THR 11 HB THR 11 36.714 15.690 -16.601 86 HG1 THR 11 HG1 THR 11 37.049 15.542 -18.827 87 1HG2 THR 11 1HG2 THR 11 34.700 17.100 -18.468 88 2HG2 THR 11 2HG2 THR 11 34.289 16.342 -16.907 89 3HG2 THR 11 3HG2 THR 11 34.879 15.340 -18.266 90 H PHE 12 H PHE 12 35.461 19.878 -15.457 91 HA PHE 12 HA PHE 12 35.938 18.949 -12.615 92 1HB PHE 12 2HB PHE 12 34.710 21.500 -13.700 93 2HB PHE 12 1HB PHE 12 34.825 21.145 -12.003 94 HD1 PHE 12 HD1 PHE 12 36.736 22.373 -14.896 95 HD2 PHE 12 HD2 PHE 12 37.121 20.938 -10.848 96 HE1 PHE 12 HE1 PHE 12 38.898 23.450 -14.689 97 HE2 PHE 12 HE2 PHE 12 39.288 22.015 -10.698 98 HZ PHE 12 HZ PHE 12 40.192 23.280 -12.606 99 H ARG 13 H ARG 13 34.614 17.121 -12.650 100 HA ARG 13 HA ARG 13 31.610 17.444 -12.952 101 1HB ARG 13 2HB ARG 13 33.321 14.907 -12.533 102 2HB ARG 13 1HB ARG 13 31.556 14.893 -12.548 103 1HG ARG 13 2HG ARG 13 31.532 15.761 -14.886 104 2HG ARG 13 1HG ARG 13 33.299 15.763 -14.911 105 1HD ARG 13 1HD ARG 13 33.242 13.215 -14.523 106 2HD ARG 13 2HD ARG 13 31.470 13.292 -14.624 107 HE ARG 13 HE ARG 13 32.727 14.546 -16.987 108 1HH1 ARG 13 2HH2 ARG 13 31.856 11.276 -15.749 109 2HH1 ARG 13 1HH2 ARG 13 31.829 10.656 -17.476 110 1HH2 ARG 13 1HH1 ARG 13 32.653 13.694 -18.848 111 2HH2 ARG 13 2HH1 ARG 13 32.245 11.921 -19.088 112 H GLY 14 H GLY 14 30.386 17.556 -11.181 113 1HA GLY 14 2HA GLY 14 30.861 16.313 -8.563 114 2HA GLY 14 1HA GLY 14 31.372 18.001 -8.495 115 HA PRO 15 HA PRO 15 26.560 17.878 -8.423 116 1HB PRO 15 1HB PRO 15 25.608 17.299 -5.895 117 2HB PRO 15 2HB PRO 15 26.069 16.062 -7.081 118 1HG PRO 15 2HG PRO 15 27.723 17.116 -4.754 119 2HG PRO 15 1HG PRO 15 27.428 15.408 -5.206 120 1HD PRO 15 2HD PRO 15 29.721 16.838 -5.970 121 2HD PRO 15 1HD PRO 15 29.044 15.521 -6.965 122 H GLY 16 H GLY 16 25.235 19.553 -7.889 123 1HA GLY 16 2HA GLY 16 24.469 21.645 -6.933 124 2HA GLY 16 1HA GLY 16 25.832 21.627 -5.825 125 H CYS 17 H CYS 17 24.658 22.915 -8.776 126 HA CYS 17 HA CYS 17 27.098 23.557 -10.148 127 1HB CYS 17 1HB CYS 17 24.446 24.994 -10.520 128 2HB CYS 17 2HB CYS 17 25.760 24.813 -11.696 129 HA PRO 18 HA PRO 18 27.735 27.182 -7.236 130 1HB PRO 18 2HB PRO 18 30.387 27.238 -6.859 131 2HB PRO 18 1HB PRO 18 29.384 25.850 -6.366 132 1HG PRO 18 2HG PRO 18 31.136 26.095 -8.850 133 2HG PRO 18 1HG PRO 18 31.009 24.714 -7.726 134 1HD PRO 18 2HD PRO 18 29.565 24.995 -10.172 135 2HD PRO 18 1HD PRO 18 29.085 23.918 -8.843 136 H THR 19 H THR 19 30.218 27.634 -9.763 137 HA THR 19 HA THR 19 29.172 30.464 -10.208 138 HB THR 19 HB THR 19 31.364 30.618 -9.512 139 HG1 THR 19 HG1 THR 19 30.557 31.949 -11.100 140 1HG2 THR 19 1HG2 THR 19 32.567 28.504 -10.247 141 2HG2 THR 19 2HG2 THR 19 33.421 29.974 -10.792 142 3HG2 THR 19 3HG2 THR 19 32.434 29.036 -11.946 143 H VAL 20 H VAL 20 29.023 31.245 -12.261 144 HA VAL 20 HA VAL 20 28.713 29.374 -14.640 145 HB VAL 20 HB VAL 20 26.437 31.034 -13.796 146 1HG1 VAL 20 1HG1 VAL 20 26.378 28.881 -16.044 147 2HG1 VAL 20 2HG1 VAL 20 24.989 29.923 -15.609 148 3HG1 VAL 20 3HG1 VAL 20 26.460 30.635 -16.289 149 1HG2 VAL 20 1HG2 VAL 20 26.366 27.932 -13.553 150 2HG2 VAL 20 2HG2 VAL 20 24.980 29.008 -13.189 151 3HG2 VAL 20 3HG2 VAL 20 26.457 29.082 -12.212 152 H LYS 21 H LYS 21 30.402 30.894 -14.380 153 HA LYS 21 HA LYS 21 30.473 33.626 -15.419 154 1HB LYS 21 2HB LYS 21 32.783 33.614 -15.657 155 2HB LYS 21 1HB LYS 21 32.288 32.835 -14.172 156 1HG LYS 21 1HG LYS 21 32.837 30.555 -15.298 157 2HG LYS 21 2HG LYS 21 33.452 31.450 -16.690 158 1HD LYS 21 1HD LYS 21 35.105 32.637 -15.122 159 2HD LYS 21 2HD LYS 21 34.469 31.652 -13.804 160 1HE LYS 21 1HE LYS 21 36.460 30.549 -14.387 161 2HE LYS 21 2HE LYS 21 35.239 29.531 -15.134 162 1HZ LYS 21 1HZ LYS 21 37.096 29.961 -16.628 163 2HZ LYS 21 2HZ LYS 21 36.890 31.598 -16.533 164 3HZ LYS 21 3HZ LYS 21 35.745 30.662 -17.270 165 HA PRO 22 HA PRO 22 29.379 33.541 -19.559 166 1HB PRO 22 1HB PRO 22 31.201 35.775 -20.416 167 2HB PRO 22 2HB PRO 22 29.424 35.683 -20.367 168 1HG PRO 22 1HG PRO 22 30.723 37.100 -18.415 169 2HG PRO 22 2HG PRO 22 29.389 36.010 -17.932 170 1HD PRO 22 1HD PRO 22 32.396 35.340 -17.921 171 2HD PRO 22 2HD PRO 22 31.229 35.319 -16.575 172 H DAL 23 H ALA 23 29.903 31.665 -20.459 173 HA DAL 23 HA ALA 23 32.497 31.304 -22.050 174 1HB DAL 23 1HB ALA 23 29.660 30.620 -23.027 175 2HB DAL 23 2HB ALA 23 30.613 32.036 -23.546 176 3HB DAL 23 3HB ALA 23 31.173 30.397 -23.947 177 H ILE 24 H ILE 24 30.221 29.504 -19.982 178 HA ILE 24 HA ILE 24 31.791 26.994 -20.504 179 HB ILE 24 HB ILE 24 29.679 27.323 -18.377 180 1HG1 ILE 24 2HG1 ILE 24 32.729 27.482 -17.758 181 2HG1 ILE 24 1HG1 ILE 24 31.755 28.911 -17.999 182 1HG2 ILE 24 1HG2 ILE 24 31.786 25.134 -18.835 183 2HG2 ILE 24 2HG2 ILE 24 30.854 25.252 -17.328 184 3HG2 ILE 24 3HG2 ILE 24 30.000 25.000 -18.866 185 1HD1 ILE 24 1HD1 ILE 24 30.257 28.323 -16.109 186 2HD1 ILE 24 2HD1 ILE 24 31.987 28.484 -15.591 187 3HD1 ILE 24 3HD1 ILE 24 31.234 26.867 -15.807 188 H SER 25 H SER 25 30.813 25.316 -21.189 189 HA SER 25 HA SER 25 28.002 25.254 -22.455 190 1HB SER 25 1HB SER 25 29.891 24.847 -24.056 191 2HB SER 25 2HB SER 25 30.516 23.551 -23.017 192 HG SER 25 HG SER 25 29.175 22.780 -24.689 193 H LEU 26 H LEU 26 27.320 25.191 -20.248 194 HA LEU 26 HA LEU 26 28.400 23.244 -18.306 195 1HB LEU 26 2HB LEU 26 27.614 25.750 -17.929 196 2HB LEU 26 1HB LEU 26 26.012 25.086 -17.898 197 HG LEU 26 HG LEU 26 26.864 23.637 -15.784 198 1HD1 LEU 26 1HD2 LEU 26 28.873 24.366 -14.573 199 2HD1 LEU 26 2HD2 LEU 26 29.261 25.578 -15.830 200 3HD1 LEU 26 3HD2 LEU 26 29.289 23.851 -16.220 201 1HD2 LEU 26 1HD1 LEU 26 26.590 25.600 -14.222 202 2HD2 LEU 26 2HD1 LEU 26 26.908 26.731 -15.566 203 3HD2 LEU 26 3HD1 LEU 26 25.440 25.734 -15.565 204 H ARG 27 H ARG 27 27.255 21.647 -17.199 205 HA ARG 27 HA ARG 27 24.672 20.577 -18.462 206 1HB ARG 27 2HB ARG 27 27.224 18.909 -18.013 207 2HB ARG 27 1HB ARG 27 25.635 18.179 -18.138 208 1HG ARG 27 1HG ARG 27 25.310 19.094 -20.439 209 2HG ARG 27 2HG ARG 27 26.888 19.876 -20.367 210 1HD ARG 27 1HD ARG 27 28.012 17.614 -20.151 211 2HD ARG 27 2HD ARG 27 26.425 16.823 -20.221 212 HE ARG 27 HE ARG 27 26.517 18.473 -22.552 213 1HH1 ARG 27 1HH1 ARG 27 28.539 15.712 -21.425 214 2HH1 ARG 27 2HH1 ARG 27 28.927 15.314 -23.174 215 1HH2 ARG 27 1HH2 ARG 27 27.049 17.893 -24.443 216 2HH2 ARG 27 2HH2 ARG 27 28.148 16.455 -24.744 217 H CYS 28 H CYS 28 24.749 22.091 -16.409 218 HA CYS 28 HA CYS 28 24.629 21.120 -13.883 219 1HB CYS 28 2HB CYS 28 24.380 23.510 -14.460 220 2HB CYS 28 1HB CYS 28 22.699 23.230 -14.975 221 H GLU 29 H GLU 29 21.637 20.928 -15.937 222 HA GLU 29 HA GLU 29 20.695 18.580 -14.261 223 1HB GLU 29 2HB GLU 29 18.429 19.308 -14.003 224 2HB GLU 29 1HB GLU 29 19.537 20.361 -13.154 225 1HG GLU 29 2HG GLU 29 19.184 22.162 -14.897 226 2HG GLU 29 1HG GLU 29 18.064 21.099 -15.759 227 HE2 GLU 29 HE2 GLU 29 16.346 20.309 -14.621 Start of MODEL 32 1 1H SER 1 1H SER 1 21.116 18.002 -8.705 2 2H SER 1 2H SER 1 20.566 17.576 -10.204 3 3H SER 1 3H SER 1 20.057 18.984 -9.507 4 HA SER 1 HA SER 1 21.657 19.482 -11.223 5 1HB SER 1 2HB SER 1 21.504 20.946 -9.217 6 2HB SER 1 1HB SER 1 22.689 19.937 -8.366 7 HG SER 1 HG SER 1 23.614 21.751 -9.373 8 H LYS 2 H LYS 2 23.304 18.634 -12.340 9 HA LYS 2 HA LYS 2 25.592 17.166 -11.120 10 1HB LYS 2 2HB LYS 2 23.766 15.631 -13.071 11 2HB LYS 2 1HB LYS 2 25.452 15.205 -12.805 12 1HG LYS 2 2HG LYS 2 25.009 14.766 -10.374 13 2HG LYS 2 1HG LYS 2 23.316 15.201 -10.592 14 1HD LYS 2 1HD LYS 2 23.015 13.297 -12.204 15 2HD LYS 2 2HD LYS 2 24.704 12.842 -12.039 16 1HE LYS 2 2HE LYS 2 22.732 12.857 -9.643 17 2HE LYS 2 1HE LYS 2 22.934 11.492 -10.730 18 1HZ LYS 2 1HZ LYS 2 25.129 12.642 -9.087 19 2HZ LYS 2 2HZ LYS 2 24.313 11.239 -8.780 20 3HZ LYS 2 3HZ LYS 2 25.278 11.357 -10.115 21 H TYR 3 H TYR 3 26.807 18.711 -11.917 22 HA TYR 3 HA TYR 3 26.607 19.668 -14.797 23 1HB TYR 3 2HB TYR 3 27.639 21.690 -14.124 24 2HB TYR 3 1HB TYR 3 26.410 21.342 -12.951 25 HD1 TYR 3 HD1 TYR 3 27.059 20.775 -10.560 26 HD2 TYR 3 HD2 TYR 3 30.100 21.507 -13.517 27 HE1 TYR 3 HE1 TYR 3 28.752 20.798 -8.848 28 HE2 TYR 3 HE2 TYR 3 31.755 21.606 -11.776 29 HH TYR 3 HH TYR 3 32.177 21.417 -9.598 30 H GLU 4 H GLU 4 28.389 19.775 -16.157 31 HA GLU 4 HA GLU 4 31.056 18.517 -15.327 32 1HB GLU 4 1HB GLU 4 29.767 16.820 -16.603 33 2HB GLU 4 2HB GLU 4 29.564 17.932 -17.952 34 1HG GLU 4 1HG GLU 4 32.009 17.887 -18.411 35 2HG GLU 4 2HG GLU 4 32.306 16.881 -17.003 36 HE2 GLU 4 HE2 GLU 4 30.878 13.984 -18.399 37 H TYR 5 H TYR 5 32.482 20.107 -15.551 38 HA TYR 5 HA TYR 5 32.307 21.977 -17.980 39 1HB TYR 5 2HB TYR 5 32.969 23.905 -16.996 40 2HB TYR 5 1HB TYR 5 31.505 23.300 -16.307 41 HD1 TYR 5 HD1 TYR 5 35.172 23.850 -15.582 42 HD2 TYR 5 HD2 TYR 5 31.253 23.345 -13.872 43 HE1 TYR 5 HE1 TYR 5 35.972 24.643 -13.439 44 HE2 TYR 5 HE2 TYR 5 32.105 24.109 -11.742 45 HH TYR 5 HH TYR 5 35.495 25.081 -11.336 46 H THR 6 H THR 6 33.853 21.332 -19.226 47 HA THR 6 HA THR 6 36.512 20.411 -18.174 48 HB THR 6 HB THR 6 35.513 20.412 -21.082 49 HG1 THR 6 HG1 THR 6 34.020 19.387 -19.725 50 1HG2 THR 6 1HG2 THR 6 37.428 18.481 -19.635 51 2HG2 THR 6 2HG2 THR 6 37.918 19.722 -20.824 52 3HG2 THR 6 3HG2 THR 6 36.894 18.342 -21.332 53 H VAL 7 H VAL 7 37.456 22.203 -17.523 54 HA VAL 7 HA VAL 7 38.041 24.471 -19.511 55 HB VAL 7 HB VAL 7 38.158 24.468 -16.452 56 1HG1 VAL 7 1HG1 VAL 7 38.892 26.849 -16.400 57 2HG1 VAL 7 2HG1 VAL 7 40.079 25.858 -17.264 58 3HG1 VAL 7 3HG1 VAL 7 38.979 26.896 -18.188 59 1HG2 VAL 7 1HG2 VAL 7 35.844 24.824 -17.465 60 2HG2 VAL 7 2HG2 VAL 7 36.370 26.206 -16.488 61 3HG2 VAL 7 3HG2 VAL 7 36.417 26.285 -18.275 62 HA DPR 8 HA PRO 8 42.449 23.062 -19.240 63 1HB DPR 8 2HB PRO 8 43.028 24.442 -21.014 64 2HB DPR 8 1HB PRO 8 43.187 22.901 -21.889 65 1HG DPR 8 1HG PRO 8 41.567 24.789 -22.894 66 2HG DPR 8 2HG PRO 8 40.998 23.085 -22.827 67 1HD DPR 8 1HD PRO 8 40.213 25.388 -20.982 68 2HD DPR 8 2HD PRO 8 39.200 24.050 -21.589 69 H SER 9 H SER 9 43.562 21.167 -19.817 70 HA SER 9 HA SER 9 41.914 18.643 -20.306 71 1HB SER 9 1HB SER 9 44.842 18.989 -19.438 72 2HB SER 9 2HB SER 9 44.052 17.446 -19.772 73 HG SER 9 HG SER 9 45.135 18.281 -21.582 74 H TYR 10 H TYR 10 40.639 20.125 -18.308 75 HA TYR 10 HA TYR 10 40.899 18.274 -15.932 76 1HB TYR 10 1HB TYR 10 41.942 20.958 -15.815 77 2HB TYR 10 2HB TYR 10 40.385 21.130 -15.087 78 HD1 TYR 10 HD1 TYR 10 43.735 19.535 -14.756 79 HD2 TYR 10 HD2 TYR 10 39.859 19.900 -12.902 80 HE1 TYR 10 HE1 TYR 10 44.607 18.606 -12.702 81 HE2 TYR 10 HE2 TYR 10 40.780 18.965 -10.863 82 HH TYR 10 HH TYR 10 44.186 18.004 -10.618 83 H THR 11 H THR 11 39.164 17.371 -16.462 84 HA THR 11 HA THR 11 36.557 18.613 -17.226 85 HB THR 11 HB THR 11 37.084 15.672 -16.574 86 HG1 THR 11 HG1 THR 11 38.519 16.498 -18.120 87 1HG2 THR 11 1HG2 THR 11 35.302 15.161 -18.238 88 2HG2 THR 11 2HG2 THR 11 34.630 16.206 -16.953 89 3HG2 THR 11 3HG2 THR 11 35.043 16.895 -18.542 90 H PHE 12 H PHE 12 35.572 19.803 -15.557 91 HA PHE 12 HA PHE 12 35.753 18.787 -12.697 92 1HB PHE 12 2HB PHE 12 34.665 21.372 -13.847 93 2HB PHE 12 1HB PHE 12 34.559 20.965 -12.160 94 HD1 PHE 12 HD1 PHE 12 36.622 20.885 -10.689 95 HD2 PHE 12 HD2 PHE 12 36.925 22.034 -14.834 96 HE1 PHE 12 HE1 PHE 12 38.810 21.849 -10.287 97 HE2 PHE 12 HE2 PHE 12 39.105 22.986 -14.382 98 HZ PHE 12 HZ PHE 12 40.068 22.906 -12.120 99 H ARG 13 H ARG 13 34.478 16.948 -12.945 100 HA ARG 13 HA ARG 13 31.507 17.275 -13.445 101 1HB ARG 13 1HB ARG 13 33.214 14.749 -12.894 102 2HB ARG 13 2HB ARG 13 31.458 14.697 -12.985 103 1HG ARG 13 2HG ARG 13 31.532 15.555 -15.353 104 2HG ARG 13 1HG ARG 13 33.286 15.551 -15.264 105 1HD ARG 13 2HD ARG 13 32.789 13.575 -16.433 106 2HD ARG 13 1HD ARG 13 33.183 12.987 -14.821 107 HE ARG 13 HE ARG 13 30.246 13.441 -15.352 108 1HH1 ARG 13 2HH2 ARG 13 32.816 10.917 -15.348 109 2HH1 ARG 13 1HH2 ARG 13 31.514 9.624 -15.314 110 1HH2 ARG 13 2HH1 ARG 13 28.922 11.876 -15.311 111 2HH2 ARG 13 1HH1 ARG 13 29.485 10.129 -15.295 112 H GLY 14 H GLY 14 30.123 17.336 -11.748 113 1HA GLY 14 2HA GLY 14 30.445 16.064 -9.141 114 2HA GLY 14 1HA GLY 14 30.954 17.743 -8.982 115 HA PRO 15 HA PRO 15 26.141 17.697 -9.003 116 1HB PRO 15 2HB PRO 15 25.207 17.198 -6.463 117 2HB PRO 15 1HB PRO 15 25.636 15.923 -7.620 118 1HG PRO 15 2HG PRO 15 27.322 16.996 -5.328 119 2HG PRO 15 1HG PRO 15 26.992 15.284 -5.743 120 1HD PRO 15 1HD PRO 15 29.306 16.668 -6.547 121 2HD PRO 15 2HD PRO 15 28.613 15.327 -7.497 122 H GLY 16 H GLY 16 24.898 19.438 -8.512 123 1HA GLY 16 2HA GLY 16 24.186 21.565 -7.587 124 2HA GLY 16 1HA GLY 16 25.501 21.475 -6.429 125 H CYS 17 H CYS 17 24.473 22.933 -9.328 126 HA CYS 17 HA CYS 17 26.988 23.461 -10.649 127 1HB CYS 17 2HB CYS 17 24.491 25.151 -11.056 128 2HB CYS 17 1HB CYS 17 25.805 24.836 -12.197 129 HA PRO 18 HA PRO 18 27.788 26.926 -7.591 130 1HB PRO 18 1HB PRO 18 30.434 26.837 -7.193 131 2HB PRO 18 2HB PRO 18 29.361 25.480 -6.760 132 1HG PRO 18 2HG PRO 18 31.133 25.742 -9.231 133 2HG PRO 18 1HG PRO 18 30.953 24.329 -8.155 134 1HD PRO 18 2HD PRO 18 29.530 24.727 -10.584 135 2HD PRO 18 1HD PRO 18 28.984 23.656 -9.274 136 H THR 19 H THR 19 30.468 27.486 -9.909 137 HA THR 19 HA THR 19 29.520 30.309 -10.351 138 HB THR 19 HB THR 19 31.707 30.457 -11.666 139 HG1 THR 19 HG1 THR 19 33.225 28.863 -11.254 140 1HG2 THR 19 1HG2 THR 19 31.660 31.367 -9.386 141 2HG2 THR 19 2HG2 THR 19 32.100 29.769 -8.722 142 3HG2 THR 19 3HG2 THR 19 33.248 30.650 -9.776 143 H VAL 20 H VAL 20 28.932 31.047 -12.300 144 HA VAL 20 HA VAL 20 28.696 29.222 -14.738 145 HB VAL 20 HB VAL 20 26.376 30.713 -13.696 146 1HG1 VAL 20 1HG2 VAL 20 26.260 30.364 -16.200 147 2HG1 VAL 20 2HG2 VAL 20 24.889 29.540 -15.442 148 3HG1 VAL 20 3HG2 VAL 20 26.314 28.605 -15.992 149 1HG2 VAL 20 1HG1 VAL 20 26.531 27.607 -13.534 150 2HG2 VAL 20 2HG1 VAL 20 25.105 28.574 -13.051 151 3HG2 VAL 20 3HG1 VAL 20 26.635 28.729 -12.171 152 H LYS 21 H LYS 21 30.294 30.895 -14.438 153 HA LYS 21 HA LYS 21 30.081 33.650 -15.440 154 1HB LYS 21 2HB LYS 21 32.546 31.792 -15.509 155 2HB LYS 21 1HB LYS 21 32.631 33.468 -16.020 156 1HG LYS 21 1HG LYS 21 31.996 34.322 -13.801 157 2HG LYS 21 2HG LYS 21 31.766 32.684 -13.183 158 1HD LYS 21 1HD LYS 21 34.184 32.158 -13.567 159 2HD LYS 21 2HD LYS 21 34.454 33.785 -14.217 160 1HE LYS 21 1HE LYS 21 33.822 34.784 -11.973 161 2HE LYS 21 2HE LYS 21 33.559 33.154 -11.323 162 1HZ LYS 21 1HZ LYS 21 35.894 32.644 -11.820 163 2HZ LYS 21 2HZ LYS 21 35.786 33.957 -10.824 164 3HZ LYS 21 3HZ LYS 21 36.140 34.161 -12.425 165 HA PRO 22 HA PRO 22 29.102 33.393 -19.614 166 1HB PRO 22 2HB PRO 22 30.631 35.852 -20.434 167 2HB PRO 22 1HB PRO 22 28.882 35.525 -20.425 168 1HG PRO 22 1HG PRO 22 29.941 37.107 -18.454 169 2HG PRO 22 2HG PRO 22 28.745 35.856 -17.997 170 1HD PRO 22 1HD PRO 22 31.813 35.575 -17.908 171 2HD PRO 22 2HD PRO 22 30.625 35.413 -16.590 172 H DAL 23 H ALA 23 29.880 31.632 -20.544 173 HA DAL 23 HA ALA 23 32.608 31.576 -21.938 174 1HB DAL 23 1HB ALA 23 31.547 30.554 -23.940 175 2HB DAL 23 2HB ALA 23 29.949 30.609 -23.148 176 3HB DAL 23 3HB ALA 23 30.787 32.122 -23.584 177 H ILE 24 H ILE 24 30.374 29.545 -20.057 178 HA ILE 24 HA ILE 24 32.193 27.180 -20.476 179 HB ILE 24 HB ILE 24 29.929 27.350 -18.487 180 1HG1 ILE 24 1HG1 ILE 24 32.929 27.705 -17.714 181 2HG1 ILE 24 2HG1 ILE 24 31.855 29.058 -17.969 182 1HG2 ILE 24 1HG2 ILE 24 32.247 25.338 -18.671 183 2HG2 ILE 24 2HG2 ILE 24 30.526 25.029 -19.048 184 3HG2 ILE 24 3HG2 ILE 24 31.011 25.354 -17.379 185 1HD1 ILE 24 1HD1 ILE 24 31.437 26.939 -15.829 186 2HD1 ILE 24 2HD1 ILE 24 32.030 28.614 -15.563 187 3HD1 ILE 24 3HD1 ILE 24 30.338 28.303 -16.142 188 H SER 25 H SER 25 31.393 25.438 -21.226 189 HA SER 25 HA SER 25 28.687 25.169 -22.681 190 1HB SER 25 1HB SER 25 30.711 24.889 -24.138 191 2HB SER 25 2HB SER 25 31.347 23.644 -23.045 192 HG SER 25 HG SER 25 30.189 22.775 -24.803 193 H LEU 26 H LEU 26 27.936 25.125 -20.463 194 HA LEU 26 HA LEU 26 28.922 23.102 -18.521 195 1HB LEU 26 2HB LEU 26 28.393 25.568 -18.055 196 2HB LEU 26 1HB LEU 26 26.706 25.164 -18.275 197 HG LEU 26 HG LEU 26 26.925 23.652 -16.127 198 1HD1 LEU 26 1HD2 LEU 26 29.673 24.984 -15.721 199 2HD1 LEU 26 2HD2 LEU 26 29.364 23.278 -16.141 200 3HD1 LEU 26 3HD2 LEU 26 28.815 23.920 -14.583 201 1HD2 LEU 26 1HD1 LEU 26 26.848 25.627 -14.555 202 2HD2 LEU 26 2HD1 LEU 26 27.620 26.656 -15.793 203 3HD2 LEU 26 3HD1 LEU 26 25.986 26.019 -16.053 204 H ARG 27 H ARG 27 27.693 21.535 -17.541 205 HA ARG 27 HA ARG 27 25.171 20.564 -19.028 206 1HB ARG 27 2HB ARG 27 27.488 18.829 -17.939 207 2HB ARG 27 1HB ARG 27 25.898 18.162 -18.249 208 1HG ARG 27 2HG ARG 27 26.037 18.853 -20.673 209 2HG ARG 27 1HG ARG 27 27.645 19.487 -20.372 210 1HD ARG 27 1HD ARG 27 28.066 17.392 -21.360 211 2HD ARG 27 2HD ARG 27 28.366 17.071 -19.657 212 HE ARG 27 HE ARG 27 25.617 16.358 -20.088 213 1HH1 ARG 27 1HH2 ARG 27 28.719 15.174 -21.484 214 2HH1 ARG 27 2HH2 ARG 27 27.931 13.546 -21.793 215 1HH2 ARG 27 1HH1 ARG 27 24.892 14.487 -20.500 216 2HH2 ARG 27 2HH1 ARG 27 25.935 13.193 -21.278 217 H CYS 28 H CYS 28 25.193 22.295 -17.039 218 HA CYS 28 HA CYS 28 23.921 21.216 -14.718 219 1HB CYS 28 1HB CYS 28 25.030 23.492 -14.826 220 2HB CYS 28 2HB CYS 28 23.627 24.082 -15.751 221 H GLU 29 H GLU 29 20.286 21.151 -15.933 222 HA GLU 29 HA GLU 29 22.111 20.481 -13.585 223 1HB GLU 29 1HB GLU 29 19.045 20.282 -13.950 224 2HB GLU 29 2HB GLU 29 19.867 19.526 -12.596 225 1HG GLU 29 2HG GLU 29 20.694 21.733 -11.772 226 2HG GLU 29 1HG GLU 29 19.902 22.549 -13.127 227 HE2 GLU 29 HE2 GLU 29 19.543 20.786 -10.300 Start of MODEL 33 1 1H SER 1 1H SER 1 22.272 20.318 -11.466 2 2H SER 1 2H SER 1 23.006 20.919 -10.112 3 3H SER 1 3H SER 1 21.362 20.985 -10.259 4 HA SER 1 HA SER 1 21.975 19.269 -8.718 5 1HB SER 1 1HB SER 1 19.893 19.070 -10.054 6 2HB SER 1 2HB SER 1 20.777 18.202 -11.323 7 HG SER 1 HG SER 1 21.322 16.636 -9.740 8 H LYS 2 H LYS 2 23.505 18.574 -11.872 9 HA LYS 2 HA LYS 2 25.782 17.218 -10.467 10 1HB LYS 2 1HB LYS 2 24.121 15.626 -12.478 11 2HB LYS 2 2HB LYS 2 25.785 15.226 -12.150 12 1HG LYS 2 1HG LYS 2 23.614 15.256 -9.952 13 2HG LYS 2 2HG LYS 2 23.910 13.867 -10.982 14 1HD LYS 2 1HD LYS 2 26.289 13.704 -10.134 15 2HD LYS 2 2HD LYS 2 25.994 15.095 -9.105 16 1HE LYS 2 2HE LYS 2 25.782 13.288 -7.628 17 2HE LYS 2 1HE LYS 2 24.105 13.719 -7.928 18 1HZ LYS 2 1HZ LYS 2 24.460 11.325 -8.044 19 2HZ LYS 2 2HZ LYS 2 24.017 11.855 -9.545 20 3HZ LYS 2 3HZ LYS 2 25.595 11.477 -9.234 21 H TYR 3 H TYR 3 26.973 18.846 -11.199 22 HA TYR 3 HA TYR 3 26.942 19.862 -14.003 23 1HB TYR 3 1HB TYR 3 28.510 21.528 -13.333 24 2HB TYR 3 2HB TYR 3 27.187 21.439 -12.212 25 HD1 TYR 3 HD1 TYR 3 30.836 20.546 -12.649 26 HD2 TYR 3 HD2 TYR 3 27.679 21.147 -9.785 27 HE1 TYR 3 HE1 TYR 3 32.439 20.456 -10.836 28 HE2 TYR 3 HE2 TYR 3 29.327 21.035 -7.997 29 HH TYR 3 HH TYR 3 32.769 20.546 -8.657 30 H GLU 4 H GLU 4 28.440 19.573 -15.566 31 HA GLU 4 HA GLU 4 31.087 18.160 -15.058 32 1HB GLU 4 1HB GLU 4 29.605 16.373 -15.839 33 2HB GLU 4 2HB GLU 4 29.102 17.303 -17.245 34 1HG GLU 4 2HG GLU 4 31.413 17.161 -18.191 35 2HG GLU 4 1HG GLU 4 31.975 16.263 -16.799 36 HE2 GLU 4 HE2 GLU 4 30.385 14.398 -19.843 37 H TYR 5 H TYR 5 32.311 19.885 -15.462 38 HA TYR 5 HA TYR 5 31.865 21.513 -18.035 39 1HB TYR 5 1HB TYR 5 32.467 23.568 -17.132 40 2HB TYR 5 2HB TYR 5 31.009 22.895 -16.453 41 HD1 TYR 5 HD1 TYR 5 34.396 24.168 -15.665 42 HD2 TYR 5 HD2 TYR 5 30.864 22.366 -13.981 43 HE1 TYR 5 HE1 TYR 5 35.012 24.964 -13.463 44 HE2 TYR 5 HE2 TYR 5 31.517 23.202 -11.798 45 HH TYR 5 HH TYR 5 33.002 24.312 -10.615 46 H THR 6 H THR 6 33.444 21.066 -19.316 47 HA THR 6 HA THR 6 36.137 20.250 -18.312 48 HB THR 6 HB THR 6 35.134 20.207 -21.218 49 HG1 THR 6 HG1 THR 6 33.644 19.185 -19.855 50 1HG2 THR 6 1HG2 THR 6 36.539 18.158 -21.448 51 2HG2 THR 6 2HG2 THR 6 37.046 18.290 -19.743 52 3HG2 THR 6 3HG2 THR 6 37.551 19.537 -20.918 53 H VAL 7 H VAL 7 37.286 21.932 -17.805 54 HA VAL 7 HA VAL 7 37.695 24.254 -19.775 55 HB VAL 7 HB VAL 7 38.304 24.145 -16.782 56 1HG1 VAL 7 1HG2 VAL 7 39.073 26.522 -16.832 57 2HG1 VAL 7 2HG2 VAL 7 40.060 25.532 -17.920 58 3HG1 VAL 7 3HG2 VAL 7 38.819 26.598 -18.603 59 1HG2 VAL 7 1HG1 VAL 7 35.863 24.537 -17.310 60 2HG2 VAL 7 2HG1 VAL 7 36.271 26.000 -18.220 61 3HG2 VAL 7 3HG1 VAL 7 36.570 25.919 -16.456 62 HA DPR 8 HA PRO 8 42.027 22.735 -20.192 63 1HB DPR 8 1HB PRO 8 42.289 23.937 -22.144 64 2HB DPR 8 2HB PRO 8 42.311 22.330 -22.907 65 1HG DPR 8 1HG PRO 8 40.528 24.132 -23.766 66 2HG DPR 8 2HG PRO 8 39.990 22.443 -23.458 67 1HD DPR 8 2HD PRO 8 39.535 24.900 -21.693 68 2HD DPR 8 1HD PRO 8 38.421 23.545 -22.024 69 H SER 9 H SER 9 43.058 20.825 -20.702 70 HA SER 9 HA SER 9 41.499 18.219 -20.812 71 1HB SER 9 1HB SER 9 44.453 18.770 -20.148 72 2HB SER 9 2HB SER 9 43.725 17.170 -20.303 73 HG SER 9 HG SER 9 43.737 19.191 -22.303 74 H TYR 10 H TYR 10 40.399 19.928 -18.739 75 HA TYR 10 HA TYR 10 40.868 18.175 -16.319 76 1HB TYR 10 2HB TYR 10 42.051 20.767 -16.428 77 2HB TYR 10 1HB TYR 10 40.558 21.115 -15.625 78 HD1 TYR 10 HD1 TYR 10 40.105 20.108 -13.314 79 HD2 TYR 10 HD2 TYR 10 43.794 19.276 -15.387 80 HE1 TYR 10 HE1 TYR 10 41.090 19.240 -11.278 81 HE2 TYR 10 HE2 TYR 10 44.734 18.420 -13.333 82 HH TYR 10 HH TYR 10 42.862 18.354 -10.310 83 H THR 11 H THR 11 39.056 17.310 -16.629 84 HA THR 11 HA THR 11 36.451 18.618 -17.218 85 HB THR 11 HB THR 11 36.869 15.685 -16.467 86 HG1 THR 11 HG1 THR 11 38.242 16.358 -18.139 87 1HG2 THR 11 1HG2 THR 11 34.777 16.947 -18.358 88 2HG2 THR 11 2HG2 THR 11 34.425 16.348 -16.721 89 3HG2 THR 11 3HG2 THR 11 34.951 15.213 -17.997 90 H PHE 12 H PHE 12 35.415 19.783 -15.598 91 HA PHE 12 HA PHE 12 35.924 19.047 -12.688 92 1HB PHE 12 2HB PHE 12 34.661 21.495 -13.995 93 2HB PHE 12 1HB PHE 12 34.646 21.234 -12.274 94 HD1 PHE 12 HD1 PHE 12 36.769 21.373 -10.908 95 HD2 PHE 12 HD2 PHE 12 36.857 22.077 -15.161 96 HE1 PHE 12 HE1 PHE 12 38.958 22.396 -10.717 97 HE2 PHE 12 HE2 PHE 12 39.046 23.090 -14.919 98 HZ PHE 12 HZ PHE 12 40.116 23.260 -12.711 99 H ARG 13 H ARG 13 34.724 17.167 -12.591 100 HA ARG 13 HA ARG 13 31.725 17.294 -12.983 101 1HB ARG 13 1HB ARG 13 33.589 14.906 -12.384 102 2HB ARG 13 2HB ARG 13 31.829 14.762 -12.387 103 1HG ARG 13 1HG ARG 13 31.735 15.478 -14.767 104 2HG ARG 13 2HG ARG 13 33.500 15.600 -14.808 105 1HD ARG 13 1HD ARG 13 33.641 13.099 -14.296 106 2HD ARG 13 2HD ARG 13 31.865 13.027 -14.319 107 HE ARG 13 HE ARG 13 32.785 14.244 -16.810 108 1HH1 ARG 13 1HH1 ARG 13 32.717 10.954 -15.343 109 2HH1 ARG 13 2HH1 ARG 13 32.739 10.229 -17.029 110 1HH2 ARG 13 2HH2 ARG 13 32.806 13.274 -18.614 111 2HH2 ARG 13 1HH2 ARG 13 32.786 11.443 -18.731 112 H GLY 14 H GLY 14 30.384 17.342 -11.248 113 1HA GLY 14 2HA GLY 14 30.886 16.219 -8.604 114 2HA GLY 14 1HA GLY 14 31.269 17.936 -8.530 115 HA PRO 15 HA PRO 15 26.468 17.577 -8.335 116 1HB PRO 15 1HB PRO 15 25.690 17.053 -5.749 117 2HB PRO 15 2HB PRO 15 26.113 15.793 -6.924 118 1HG PRO 15 2HG PRO 15 27.867 16.940 -4.720 119 2HG PRO 15 1HG PRO 15 27.590 15.215 -5.121 120 1HD PRO 15 1HD PRO 15 29.797 16.701 -6.041 121 2HD PRO 15 2HD PRO 15 29.118 15.326 -6.952 122 H GLY 16 H GLY 16 25.149 19.275 -7.726 123 1HA GLY 16 1HA GLY 16 24.449 21.399 -6.830 124 2HA GLY 16 2HA GLY 16 25.820 21.354 -5.734 125 H CYS 17 H CYS 17 24.642 22.660 -8.688 126 HA CYS 17 HA CYS 17 27.155 23.313 -9.984 127 1HB CYS 17 1HB CYS 17 24.424 24.556 -10.511 128 2HB CYS 17 2HB CYS 17 25.826 24.583 -11.597 129 HA PRO 18 HA PRO 18 27.644 27.019 -7.184 130 1HB PRO 18 1HB PRO 18 30.312 27.468 -7.163 131 2HB PRO 18 2HB PRO 18 29.557 26.033 -6.414 132 1HG PRO 18 1HG PRO 18 30.918 26.226 -9.142 133 2HG PRO 18 2HG PRO 18 31.165 24.980 -7.886 134 1HD PRO 18 2HD PRO 18 29.418 24.671 -10.065 135 2HD PRO 18 1HD PRO 18 29.158 23.853 -8.505 136 H THR 19 H THR 19 29.639 27.531 -10.094 137 HA THR 19 HA THR 19 28.216 30.196 -10.566 138 HB THR 19 HB THR 19 30.215 30.748 -9.448 139 HG1 THR 19 HG1 THR 19 30.951 32.183 -11.000 140 1HG2 THR 19 1HG2 THR 19 31.943 29.612 -11.748 141 2HG2 THR 19 2HG2 THR 19 31.941 28.993 -10.074 142 3HG2 THR 19 3HG2 THR 19 32.523 30.645 -10.414 143 H VAL 20 H VAL 20 28.607 31.100 -12.703 144 HA VAL 20 HA VAL 20 29.156 29.393 -14.978 145 HB VAL 20 HB VAL 20 27.199 28.435 -14.553 146 1HG1 VAL 20 1HG2 VAL 20 24.826 29.233 -14.880 147 2HG1 VAL 20 2HG2 VAL 20 25.654 30.237 -13.671 148 3HG1 VAL 20 3HG2 VAL 20 25.431 30.858 -15.324 149 1HG2 VAL 20 1HG1 VAL 20 26.188 28.158 -16.813 150 2HG2 VAL 20 2HG1 VAL 20 27.944 28.351 -16.870 151 3HG2 VAL 20 3HG1 VAL 20 26.896 29.727 -17.301 152 H LYS 21 H LYS 21 30.307 30.902 -14.760 153 HA LYS 21 HA LYS 21 29.982 33.818 -15.566 154 1HB LYS 21 1HB LYS 21 32.554 32.140 -15.218 155 2HB LYS 21 2HB LYS 21 32.599 33.834 -15.666 156 1HG LYS 21 2HG LYS 21 31.544 34.585 -13.594 157 2HG LYS 21 1HG LYS 21 31.278 32.926 -13.054 158 1HD LYS 21 2HD LYS 21 33.734 32.500 -12.980 159 2HD LYS 21 1HD LYS 21 34.061 34.146 -13.552 160 1HE LYS 21 2HE LYS 21 32.984 35.085 -11.456 161 2HE LYS 21 1HE LYS 21 32.665 33.437 -10.883 162 1HZ LYS 21 1HZ LYS 21 34.728 34.308 -9.967 163 2HZ LYS 21 2HZ LYS 21 35.070 33.017 -10.940 164 3HZ LYS 21 3HZ LYS 21 35.367 34.553 -11.471 165 HA PRO 22 HA PRO 22 29.821 33.617 -19.859 166 1HB PRO 22 2HB PRO 22 31.405 36.161 -20.323 167 2HB PRO 22 1HB PRO 22 29.710 35.773 -20.700 168 1HG PRO 22 2HG PRO 22 30.248 37.344 -18.520 169 2HG PRO 22 1HG PRO 22 29.041 36.035 -18.342 170 1HD PRO 22 1HD PRO 22 32.028 35.888 -17.610 171 2HD PRO 22 2HD PRO 22 30.595 35.642 -16.579 172 H DAL 23 H ALA 23 30.730 32.405 -21.393 173 HA DAL 23 HA ALA 23 33.745 31.860 -21.330 174 1HB DAL 23 1HB ALA 23 33.337 33.261 -23.327 175 2HB DAL 23 2HB ALA 23 32.101 32.114 -23.911 176 3HB DAL 23 3HB ALA 23 33.807 31.605 -23.793 177 H ILE 24 H ILE 24 32.940 30.245 -19.739 178 HA ILE 24 HA ILE 24 33.148 27.833 -20.226 179 HB ILE 24 HB ILE 24 32.579 29.379 -18.074 180 1HG1 ILE 24 1HG1 ILE 24 32.284 26.421 -17.957 181 2HG1 ILE 24 2HG1 ILE 24 33.780 27.361 -18.064 182 1HG2 ILE 24 1HG2 ILE 24 30.077 29.638 -18.464 183 2HG2 ILE 24 2HG2 ILE 24 29.887 27.906 -18.168 184 3HG2 ILE 24 3HG2 ILE 24 30.468 28.960 -16.852 185 1HD1 ILE 24 1HD1 ILE 24 33.444 26.460 -15.770 186 2HD1 ILE 24 2HD1 ILE 24 31.981 27.455 -15.600 187 3HD1 ILE 24 3HD1 ILE 24 33.561 28.250 -15.796 188 H SER 25 H SER 25 31.817 26.038 -19.592 189 HA SER 25 HA SER 25 29.376 25.525 -21.363 190 1HB SER 25 1HB SER 25 31.292 24.892 -22.804 191 2HB SER 25 2HB SER 25 31.908 23.794 -21.556 192 HG SER 25 HG SER 25 30.616 22.739 -23.106 193 H LEU 26 H LEU 26 28.024 24.953 -19.798 194 HA LEU 26 HA LEU 26 28.762 22.772 -17.779 195 1HB LEU 26 1HB LEU 26 27.252 25.423 -17.252 196 2HB LEU 26 2HB LEU 26 26.763 23.987 -16.410 197 HG LEU 26 HG LEU 26 29.156 23.708 -15.537 198 1HD1 LEU 26 1HD1 LEU 26 30.716 25.617 -15.474 199 2HD1 LEU 26 2HD1 LEU 26 30.351 25.284 -17.170 200 3HD1 LEU 26 3HD1 LEU 26 29.575 26.662 -16.361 201 1HD2 LEU 26 1HD2 LEU 26 28.863 25.321 -13.659 202 2HD2 LEU 26 2HD2 LEU 26 27.662 26.233 -14.617 203 3HD2 LEU 26 3HD2 LEU 26 27.322 24.566 -14.100 204 H ARG 27 H ARG 27 27.165 21.341 -17.291 205 HA ARG 27 HA ARG 27 24.639 21.235 -18.921 206 1HB ARG 27 1HB ARG 27 24.863 19.038 -19.647 207 2HB ARG 27 2HB ARG 27 26.300 19.906 -20.166 208 1HG ARG 27 2HG ARG 27 27.639 18.737 -18.390 209 2HG ARG 27 1HG ARG 27 26.217 17.859 -17.852 210 1HD ARG 27 2HD ARG 27 27.341 17.616 -20.733 211 2HD ARG 27 1HD ARG 27 27.895 16.626 -19.389 212 HE ARG 27 HE ARG 27 24.970 16.424 -19.607 213 1HH1 ARG 27 1HH1 ARG 27 27.937 15.087 -21.152 214 2HH1 ARG 27 2HH1 ARG 27 26.973 13.617 -21.677 215 1HH2 ARG 27 2HH2 ARG 27 24.042 14.721 -20.268 216 2HH2 ARG 27 1HH2 ARG 27 24.942 13.431 -21.213 217 H CYS 28 H CYS 28 24.759 22.185 -16.552 218 HA CYS 28 HA CYS 28 24.421 20.730 -14.323 219 1HB CYS 28 2HB CYS 28 24.511 23.230 -14.399 220 2HB CYS 28 1HB CYS 28 22.785 23.267 -14.825 221 H GLU 29 H GLU 29 21.493 21.337 -16.360 222 HA GLU 29 HA GLU 29 19.824 19.588 -14.525 223 1HB GLU 29 2HB GLU 29 17.863 20.248 -15.685 224 2HB GLU 29 1HB GLU 29 18.758 21.638 -15.119 225 1HG GLU 29 2HG GLU 29 19.477 22.154 -17.493 226 2HG GLU 29 1HG GLU 29 18.570 20.747 -18.065 227 HE2 GLU 29 HE2 GLU 29 15.482 22.192 -17.910 Start of MODEL 34 1 1H SER 1 1H SER 1 21.008 20.203 -10.948 2 2H SER 1 2H SER 1 22.093 19.496 -11.973 3 3H SER 1 3H SER 1 22.629 20.334 -10.654 4 HA SER 1 HA SER 1 21.630 18.765 -9.146 5 1HB SER 1 1HB SER 1 20.781 17.299 -11.694 6 2HB SER 1 2HB SER 1 20.639 16.640 -10.055 7 HG SER 1 HG SER 1 19.498 19.068 -10.986 8 H LYS 2 H LYS 2 23.567 17.916 -12.023 9 HA LYS 2 HA LYS 2 25.789 16.995 -10.271 10 1HB LYS 2 2HB LYS 2 24.522 14.935 -12.185 11 2HB LYS 2 1HB LYS 2 26.186 14.817 -11.625 12 1HG LYS 2 1HG LYS 2 25.423 14.660 -9.238 13 2HG LYS 2 2HG LYS 2 23.744 14.789 -9.755 14 1HD LYS 2 1HD LYS 2 24.009 12.626 -11.098 15 2HD LYS 2 2HD LYS 2 25.672 12.522 -10.541 16 1HE LYS 2 2HE LYS 2 24.551 11.033 -9.139 17 2HE LYS 2 1HE LYS 2 24.759 12.428 -8.093 18 1HZ LYS 2 1HZ LYS 2 22.520 11.517 -7.951 19 2HZ LYS 2 2HZ LYS 2 22.418 13.032 -8.600 20 3HZ LYS 2 3HZ LYS 2 22.259 11.706 -9.572 21 H TYR 3 H TYR 3 26.953 18.523 -11.144 22 HA TYR 3 HA TYR 3 26.904 19.354 -13.980 23 1HB TYR 3 2HB TYR 3 28.401 21.121 -13.388 24 2HB TYR 3 1HB TYR 3 27.095 21.010 -12.246 25 HD1 TYR 3 HD1 TYR 3 27.606 20.831 -9.843 26 HD2 TYR 3 HD2 TYR 3 30.778 20.260 -12.688 27 HE1 TYR 3 HE1 TYR 3 29.255 20.936 -8.060 28 HE2 TYR 3 HE2 TYR 3 32.394 20.355 -10.884 29 HH TYR 3 HH TYR 3 32.727 20.594 -8.713 30 H GLU 4 H GLU 4 28.471 19.218 -15.531 31 HA GLU 4 HA GLU 4 31.142 17.862 -15.028 32 1HB GLU 4 1HB GLU 4 29.638 16.051 -15.875 33 2HB GLU 4 2HB GLU 4 29.235 17.019 -17.288 34 1HG GLU 4 2HG GLU 4 31.659 16.867 -18.033 35 2HG GLU 4 1HG GLU 4 32.033 15.864 -16.645 36 HE2 GLU 4 HE2 GLU 4 30.625 14.071 -16.354 37 H TYR 5 H TYR 5 32.287 19.681 -15.390 38 HA TYR 5 HA TYR 5 31.834 21.246 -18.001 39 1HB TYR 5 1HB TYR 5 32.306 23.338 -17.121 40 2HB TYR 5 2HB TYR 5 30.885 22.599 -16.432 41 HD1 TYR 5 HD1 TYR 5 34.224 24.019 -15.671 42 HD2 TYR 5 HD2 TYR 5 30.761 22.127 -13.947 43 HE1 TYR 5 HE1 TYR 5 34.853 24.822 -13.473 44 HE2 TYR 5 HE2 TYR 5 31.421 22.974 -11.769 45 HH TYR 5 HH TYR 5 34.356 24.912 -11.329 46 H THR 6 H THR 6 33.470 20.847 -19.240 47 HA THR 6 HA THR 6 36.159 20.159 -18.135 48 HB THR 6 HB THR 6 35.247 19.998 -21.069 49 HG1 THR 6 HG1 THR 6 34.891 18.072 -19.027 50 1HG2 THR 6 1HG2 THR 6 37.677 19.430 -20.681 51 2HG2 THR 6 2HG2 THR 6 37.184 18.199 -19.482 52 3HG2 THR 6 3HG2 THR 6 36.733 17.997 -21.197 53 H VAL 7 H VAL 7 37.289 21.860 -17.681 54 HA VAL 7 HA VAL 7 37.626 24.164 -19.686 55 HB VAL 7 HB VAL 7 38.292 24.116 -16.705 56 1HG1 VAL 7 1HG1 VAL 7 38.987 26.515 -16.815 57 2HG1 VAL 7 2HG1 VAL 7 39.976 25.535 -17.910 58 3HG1 VAL 7 3HG1 VAL 7 38.688 26.551 -18.581 59 1HG2 VAL 7 1HG2 VAL 7 35.832 24.423 -17.174 60 2HG2 VAL 7 2HG2 VAL 7 36.168 25.878 -18.126 61 3HG2 VAL 7 3HG2 VAL 7 36.514 25.845 -16.369 62 HA DPR 8 HA PRO 8 41.985 22.741 -20.144 63 1HB DPR 8 1HB PRO 8 42.178 23.888 -22.134 64 2HB DPR 8 2HB PRO 8 42.234 22.261 -22.850 65 1HG DPR 8 1HG PRO 8 40.385 23.983 -23.729 66 2HG DPR 8 2HG PRO 8 39.901 22.290 -23.360 67 1HD DPR 8 2HD PRO 8 39.407 24.786 -21.662 68 2HD DPR 8 1HD PRO 8 38.326 23.392 -21.932 69 H SER 9 H SER 9 43.062 20.852 -20.602 70 HA SER 9 HA SER 9 41.604 18.191 -20.634 71 1HB SER 9 1HB SER 9 44.529 18.876 -19.962 72 2HB SER 9 2HB SER 9 43.867 17.246 -20.080 73 HG SER 9 HG SER 9 44.794 17.951 -22.028 74 H TYR 10 H TYR 10 40.458 19.941 -18.581 75 HA TYR 10 HA TYR 10 40.985 18.254 -16.126 76 1HB TYR 10 1HB TYR 10 42.127 20.850 -16.305 77 2HB TYR 10 2HB TYR 10 40.627 21.211 -15.520 78 HD1 TYR 10 HD1 TYR 10 43.879 19.411 -15.209 79 HD2 TYR 10 HD2 TYR 10 40.176 20.278 -13.177 80 HE1 TYR 10 HE1 TYR 10 44.820 18.634 -13.126 81 HE2 TYR 10 HE2 TYR 10 41.162 19.489 -11.109 82 HH TYR 10 HH TYR 10 42.940 18.653 -10.107 83 H THR 11 H THR 11 39.190 17.344 -16.401 84 HA THR 11 HA THR 11 36.557 18.573 -17.009 85 HB THR 11 HB THR 11 37.034 15.674 -16.163 86 HG1 THR 11 HG1 THR 11 38.401 16.316 -17.852 87 1HG2 THR 11 1HG2 THR 11 34.923 16.837 -18.097 88 2HG2 THR 11 2HG2 THR 11 35.135 15.116 -17.692 89 3HG2 THR 11 3HG2 THR 11 34.579 16.271 -16.446 90 H PHE 12 H PHE 12 35.447 19.737 -15.426 91 HA PHE 12 HA PHE 12 36.000 19.105 -12.494 92 1HB PHE 12 1HB PHE 12 34.690 21.486 -13.870 93 2HB PHE 12 2HB PHE 12 34.661 21.274 -12.143 94 HD1 PHE 12 HD1 PHE 12 36.885 22.092 -15.029 95 HD2 PHE 12 HD2 PHE 12 36.762 21.495 -10.760 96 HE1 PHE 12 HE1 PHE 12 39.039 23.173 -14.786 97 HE2 PHE 12 HE2 PHE 12 38.915 22.584 -10.566 98 HZ PHE 12 HZ PHE 12 40.077 23.430 -12.570 99 H ARG 13 H ARG 13 34.817 17.280 -12.211 100 HA ARG 13 HA ARG 13 31.811 17.330 -12.675 101 1HB ARG 13 2HB ARG 13 33.691 14.965 -12.043 102 2HB ARG 13 1HB ARG 13 31.931 14.820 -12.109 103 1HG ARG 13 1HG ARG 13 31.928 15.536 -14.491 104 2HG ARG 13 2HG ARG 13 33.693 15.655 -14.465 105 1HD ARG 13 1HD ARG 13 33.819 13.155 -13.940 106 2HD ARG 13 2HD ARG 13 32.048 13.074 -14.038 107 HE ARG 13 HE ARG 13 32.812 14.252 -16.504 108 1HH1 ARG 13 2HH1 ARG 13 33.690 11.107 -14.981 109 2HH1 ARG 13 1HH1 ARG 13 33.950 10.397 -16.653 110 1HH2 ARG 13 2HH2 ARG 13 33.145 13.306 -18.290 111 2HH2 ARG 13 1HH2 ARG 13 33.664 11.548 -18.375 112 H GLY 14 H GLY 14 30.487 17.384 -10.929 113 1HA GLY 14 1HA GLY 14 31.055 16.292 -8.270 114 2HA GLY 14 2HA GLY 14 31.362 18.024 -8.231 115 HA PRO 15 HA PRO 15 26.610 17.412 -7.874 116 1HB PRO 15 1HB PRO 15 25.973 17.235 -5.205 117 2HB PRO 15 2HB PRO 15 26.492 15.849 -6.184 118 1HG PRO 15 1HG PRO 15 28.176 17.509 -4.271 119 2HG PRO 15 2HG PRO 15 28.074 15.724 -4.381 120 1HD PRO 15 2HD PRO 15 30.079 17.260 -5.626 121 2HD PRO 15 1HD PRO 15 29.531 15.689 -6.269 122 H GLY 16 H GLY 16 25.144 19.041 -7.483 123 1HA GLY 16 1HA GLY 16 24.231 21.169 -6.790 124 2HA GLY 16 2HA GLY 16 25.685 21.478 -5.850 125 H CYS 17 H CYS 17 24.013 22.540 -8.506 126 HA CYS 17 HA CYS 17 26.095 22.910 -10.479 127 1HB CYS 17 1HB CYS 17 23.611 22.805 -10.947 128 2HB CYS 17 2HB CYS 17 23.530 24.532 -10.484 129 HA PRO 18 HA PRO 18 27.647 26.723 -8.300 130 1HB PRO 18 2HB PRO 18 30.224 26.756 -9.057 131 2HB PRO 18 1HB PRO 18 29.530 25.353 -8.217 132 1HG PRO 18 2HG PRO 18 30.050 25.675 -11.219 133 2HG PRO 18 1HG PRO 18 30.499 24.295 -10.172 134 1HD PRO 18 2HD PRO 18 28.091 24.437 -11.701 135 2HD PRO 18 1HD PRO 18 28.280 23.432 -10.249 136 H THR 19 H THR 19 29.556 28.600 -9.705 137 HA THR 19 HA THR 19 27.686 30.489 -10.989 138 HB THR 19 HB THR 19 29.849 31.761 -11.427 139 HG1 THR 19 HG1 THR 19 31.195 29.957 -11.438 140 1HG2 THR 19 1HG2 THR 19 30.367 32.484 -9.137 141 2HG2 THR 19 2HG2 THR 19 28.604 32.353 -9.378 142 3HG2 THR 19 3HG2 THR 19 29.476 31.090 -8.469 143 H VAL 20 H VAL 20 28.330 31.517 -13.240 144 HA VAL 20 HA VAL 20 29.272 29.661 -15.231 145 HB VAL 20 HB VAL 20 27.593 30.076 -16.736 146 1HG1 VAL 20 1HG1 VAL 20 26.496 28.189 -14.590 147 2HG1 VAL 20 2HG1 VAL 20 27.777 27.813 -15.767 148 3HG1 VAL 20 3HG1 VAL 20 26.124 28.085 -16.335 149 1HG2 VAL 20 1HG2 VAL 20 25.134 30.478 -16.382 150 2HG2 VAL 20 2HG2 VAL 20 26.082 31.847 -15.771 151 3HG2 VAL 20 3HG2 VAL 20 25.419 30.661 -14.627 152 H LYS 21 H LYS 21 30.647 31.104 -14.815 153 HA LYS 21 HA LYS 21 30.756 33.954 -15.741 154 1HB LYS 21 2HB LYS 21 33.113 31.989 -15.529 155 2HB LYS 21 1HB LYS 21 33.315 33.695 -15.827 156 1HG LYS 21 2HG LYS 21 32.177 32.518 -13.226 157 2HG LYS 21 1HG LYS 21 33.873 32.888 -13.511 158 1HD LYS 21 1HD LYS 21 33.290 35.333 -13.833 159 2HD LYS 21 2HD LYS 21 31.594 34.954 -13.517 160 1HE LYS 21 2HE LYS 21 32.189 34.175 -11.181 161 2HE LYS 21 1HE LYS 21 33.896 34.546 -11.492 162 1HZ LYS 21 1HZ LYS 21 33.258 36.873 -11.871 163 2HZ LYS 21 2HZ LYS 21 31.669 36.528 -11.582 164 3HZ LYS 21 3HZ LYS 21 32.780 36.379 -10.369 165 HA PRO 22 HA PRO 22 30.486 33.690 -20.020 166 1HB PRO 22 2HB PRO 22 32.435 35.949 -20.574 167 2HB PRO 22 1HB PRO 22 30.696 35.814 -20.926 168 1HG PRO 22 1HG PRO 22 31.487 37.336 -18.790 169 2HG PRO 22 2HG PRO 22 30.102 36.224 -18.566 170 1HD PRO 22 1HD PRO 22 33.045 35.658 -17.862 171 2HD PRO 22 2HD PRO 22 31.604 35.648 -16.812 172 H DAL 23 H ALA 23 31.158 32.325 -21.544 173 HA DAL 23 HA ALA 23 34.050 31.309 -21.510 174 1HB DAL 23 1HB ALA 23 33.816 32.704 -23.543 175 2HB DAL 23 2HB ALA 23 32.403 31.747 -24.066 176 3HB DAL 23 3HB ALA 23 34.013 30.983 -23.968 177 H ILE 24 H ILE 24 32.887 29.974 -19.813 178 HA ILE 24 HA ILE 24 33.040 27.563 -20.251 179 HB ILE 24 HB ILE 24 32.454 29.154 -18.133 180 1HG1 ILE 24 1HG1 ILE 24 32.134 26.196 -17.978 181 2HG1 ILE 24 2HG1 ILE 24 33.643 27.119 -18.083 182 1HG2 ILE 24 1HG2 ILE 24 30.340 28.676 -16.909 183 2HG2 ILE 24 2HG2 ILE 24 29.989 29.482 -18.466 184 3HG2 ILE 24 3HG2 ILE 24 29.735 27.724 -18.278 185 1HD1 ILE 24 1HD1 ILE 24 33.386 28.077 -15.839 186 2HD1 ILE 24 2HD1 ILE 24 33.286 26.285 -15.772 187 3HD1 ILE 24 3HD1 ILE 24 31.812 27.272 -15.647 188 H SER 25 H SER 25 31.648 25.804 -19.616 189 HA SER 25 HA SER 25 29.248 25.324 -21.448 190 1HB SER 25 2HB SER 25 31.171 24.687 -22.868 191 2HB SER 25 1HB SER 25 31.759 23.566 -21.626 192 HG SER 25 HG SER 25 29.217 23.485 -22.905 193 H LEU 26 H LEU 26 27.908 24.882 -19.823 194 HA LEU 26 HA LEU 26 28.508 22.569 -17.904 195 1HB LEU 26 1HB LEU 26 27.105 25.255 -17.258 196 2HB LEU 26 2HB LEU 26 26.629 23.798 -16.440 197 HG LEU 26 HG LEU 26 29.051 23.456 -15.673 198 1HD1 LEU 26 1HD2 LEU 26 29.433 26.434 -16.447 199 2HD1 LEU 26 2HD2 LEU 26 30.615 25.392 -15.599 200 3HD1 LEU 26 3HD2 LEU 26 30.203 25.076 -17.286 201 1HD2 LEU 26 1HD1 LEU 26 27.602 25.914 -14.575 202 2HD2 LEU 26 2HD1 LEU 26 27.312 24.222 -14.130 203 3HD2 LEU 26 3HD1 LEU 26 28.866 24.980 -13.733 204 H ARG 27 H ARG 27 26.949 21.208 -17.601 205 HA ARG 27 HA ARG 27 24.177 21.468 -18.739 206 1HB ARG 27 2HB ARG 27 26.053 19.222 -19.739 207 2HB ARG 27 1HB ARG 27 24.309 19.025 -19.729 208 1HG ARG 27 2HG ARG 27 24.004 20.975 -21.218 209 2HG ARG 27 1HG ARG 27 25.733 21.276 -21.256 210 1HD ARG 27 2HD ARG 27 24.483 18.624 -22.280 211 2HD ARG 27 1HD ARG 27 24.667 20.055 -23.284 212 HE ARG 27 HE ARG 27 27.256 19.325 -22.072 213 1HH1 ARG 27 1HH1 ARG 27 25.153 18.465 -24.868 214 2HH1 ARG 27 2HH1 ARG 27 26.631 17.838 -25.756 215 1HH2 ARG 27 1HH2 ARG 27 28.798 18.585 -23.199 216 2HH2 ARG 27 2HH2 ARG 27 28.530 17.903 -24.882 217 H CYS 28 H CYS 28 24.792 21.736 -16.299 218 HA CYS 28 HA CYS 28 24.763 19.460 -14.677 219 1HB CYS 28 1HB CYS 28 24.711 20.933 -12.765 220 2HB CYS 28 2HB CYS 28 25.807 21.538 -14.015 221 H GLU 29 H GLU 29 21.910 21.658 -15.147 222 HA GLU 29 HA GLU 29 20.139 19.621 -13.714 223 1HB GLU 29 1HB GLU 29 20.135 22.184 -13.122 224 2HB GLU 29 2HB GLU 29 19.421 22.437 -14.699 225 1HG GLU 29 2HG GLU 29 17.609 22.512 -13.192 226 2HG GLU 29 1HG GLU 29 17.453 20.921 -13.931 227 HE2 GLU 29 HE2 GLU 29 17.422 19.311 -12.764 Start of MODEL 35 1 1H SER 1 1H SER 1 20.001 18.087 -9.442 2 2H SER 1 2H SER 1 21.191 17.469 -8.477 3 3H SER 1 3H SER 1 20.732 16.661 -9.843 4 HA SER 1 HA SER 1 21.522 18.458 -11.260 5 1HB SER 1 2HB SER 1 22.425 19.654 -8.574 6 2HB SER 1 1HB SER 1 22.907 20.273 -10.163 7 HG SER 1 HG SER 1 20.245 19.983 -9.216 8 H LYS 2 H LYS 2 23.341 17.759 -12.201 9 HA LYS 2 HA LYS 2 25.734 16.775 -10.672 10 1HB LYS 2 1HB LYS 2 26.077 14.693 -11.739 11 2HB LYS 2 2HB LYS 2 24.620 14.706 -10.767 12 1HG LYS 2 1HG LYS 2 23.214 14.800 -12.874 13 2HG LYS 2 2HG LYS 2 24.683 14.777 -13.850 14 1HD LYS 2 2HD LYS 2 25.291 12.505 -12.885 15 2HD LYS 2 1HD LYS 2 23.820 12.527 -11.908 16 1HE LYS 2 2HE LYS 2 22.414 12.578 -14.018 17 2HE LYS 2 1HE LYS 2 23.891 12.557 -15.000 18 1HZ LYS 2 1HZ LYS 2 23.095 10.440 -13.055 19 2HZ LYS 2 2HZ LYS 2 24.472 10.420 -13.969 20 3HZ LYS 2 3HZ LYS 2 22.993 10.331 -14.700 21 H TYR 3 H TYR 3 26.686 18.588 -11.415 22 HA TYR 3 HA TYR 3 26.750 19.359 -14.286 23 1HB TYR 3 2HB TYR 3 27.826 21.362 -13.631 24 2HB TYR 3 1HB TYR 3 26.575 21.049 -12.494 25 HD1 TYR 3 HD1 TYR 3 30.322 20.882 -12.985 26 HD2 TYR 3 HD2 TYR 3 27.123 21.070 -10.122 27 HE1 TYR 3 HE1 TYR 3 31.883 21.479 -11.269 28 HE2 TYR 3 HE2 TYR 3 28.708 21.646 -8.408 29 HH TYR 3 HH TYR 3 32.194 21.951 -9.107 30 H GLU 4 H GLU 4 28.446 19.311 -15.688 31 HA GLU 4 HA GLU 4 31.178 18.205 -14.885 32 1HB GLU 4 1HB GLU 4 29.932 16.303 -15.869 33 2HB GLU 4 2HB GLU 4 29.531 17.241 -17.301 34 1HG GLU 4 2HG GLU 4 32.000 17.304 -17.892 35 2HG GLU 4 1HG GLU 4 32.368 16.306 -16.498 36 HE2 GLU 4 HE2 GLU 4 30.913 14.423 -16.361 37 H TYR 5 H TYR 5 32.403 19.952 -15.261 38 HA TYR 5 HA TYR 5 32.017 21.545 -17.864 39 1HB TYR 5 2HB TYR 5 32.499 23.585 -17.034 40 2HB TYR 5 1HB TYR 5 31.115 22.908 -16.206 41 HD1 TYR 5 HD1 TYR 5 31.096 22.843 -13.718 42 HD2 TYR 5 HD2 TYR 5 34.681 24.014 -15.794 43 HE1 TYR 5 HE1 TYR 5 32.025 23.754 -11.663 44 HE2 TYR 5 HE2 TYR 5 35.558 24.916 -13.726 45 HH TYR 5 HH TYR 5 35.224 25.272 -11.579 46 H THR 6 H THR 6 33.609 20.924 -19.090 47 HA THR 6 HA THR 6 36.330 20.286 -17.994 48 HB THR 6 HB THR 6 35.301 19.931 -20.871 49 HG1 THR 6 HG1 THR 6 35.088 18.130 -18.698 50 1HG2 THR 6 1HG2 THR 6 37.364 18.285 -19.280 51 2HG2 THR 6 2HG2 THR 6 36.820 17.947 -20.946 52 3HG2 THR 6 3HG2 THR 6 37.752 19.434 -20.592 53 H VAL 7 H VAL 7 37.213 22.162 -17.564 54 HA VAL 7 HA VAL 7 37.628 24.248 -19.784 55 HB VAL 7 HB VAL 7 37.838 24.554 -16.746 56 1HG1 VAL 7 1HG1 VAL 7 39.690 25.915 -17.742 57 2HG1 VAL 7 2HG1 VAL 7 38.533 26.825 -18.730 58 3HG1 VAL 7 3HG1 VAL 7 38.494 26.948 -16.943 59 1HG2 VAL 7 1HG2 VAL 7 35.992 26.219 -16.896 60 2HG2 VAL 7 2HG2 VAL 7 35.488 24.737 -17.727 61 3HG2 VAL 7 3HG2 VAL 7 35.992 26.132 -18.684 62 HA DPR 8 HA PRO 8 42.105 23.112 -19.557 63 1HB DPR 8 1HB PRO 8 42.536 24.289 -21.503 64 2HB DPR 8 2HB PRO 8 42.754 22.666 -22.199 65 1HG DPR 8 1HG PRO 8 40.987 24.326 -23.342 66 2HG DPR 8 2HG PRO 8 40.521 22.615 -23.048 67 1HD DPR 8 2HD PRO 8 39.686 25.079 -21.444 68 2HD DPR 8 1HD PRO 8 38.718 23.637 -21.857 69 H SER 9 H SER 9 43.318 21.240 -19.931 70 HA SER 9 HA SER 9 41.840 18.570 -20.049 71 1HB SER 9 1HB SER 9 44.757 19.216 -19.326 72 2HB SER 9 2HB SER 9 44.068 17.594 -19.442 73 HG SER 9 HG SER 9 44.094 19.542 -21.511 74 H TYR 10 H TYR 10 40.522 20.217 -18.202 75 HA TYR 10 HA TYR 10 40.949 18.675 -15.637 76 1HB TYR 10 1HB TYR 10 41.826 21.413 -15.858 77 2HB TYR 10 2HB TYR 10 40.279 21.574 -15.106 78 HD1 TYR 10 HD1 TYR 10 39.884 20.574 -12.781 79 HD2 TYR 10 HD2 TYR 10 43.730 20.231 -14.701 80 HE1 TYR 10 HE1 TYR 10 40.910 19.939 -10.678 81 HE2 TYR 10 HE2 TYR 10 44.708 19.599 -12.581 82 HH TYR 10 HH TYR 10 42.756 19.364 -9.622 83 H THR 11 H THR 11 39.259 17.617 -16.016 84 HA THR 11 HA THR 11 36.569 18.626 -16.844 85 HB THR 11 HB THR 11 37.288 15.799 -15.924 86 HG1 THR 11 HG1 THR 11 37.397 16.951 -18.509 87 1HG2 THR 11 1HG2 THR 11 35.134 16.702 -17.943 88 2HG2 THR 11 2HG2 THR 11 34.798 16.143 -16.286 89 3HG2 THR 11 3HG2 THR 11 35.507 15.023 -17.485 90 H PHE 12 H PHE 12 35.520 19.897 -15.279 91 HA PHE 12 HA PHE 12 35.867 19.209 -12.336 92 1HB PHE 12 2HB PHE 12 34.573 21.579 -13.717 93 2HB PHE 12 1HB PHE 12 34.535 21.353 -11.994 94 HD1 PHE 12 HD1 PHE 12 36.765 22.243 -14.852 95 HD2 PHE 12 HD2 PHE 12 36.623 21.593 -10.591 96 HE1 PHE 12 HE1 PHE 12 38.878 23.394 -14.577 97 HE2 PHE 12 HE2 PHE 12 38.738 22.749 -10.366 98 HZ PHE 12 HZ PHE 12 39.887 23.658 -12.348 99 H ARG 13 H ARG 13 34.695 17.324 -12.226 100 HA ARG 13 HA ARG 13 31.728 17.353 -12.832 101 1HB ARG 13 1HB ARG 13 33.557 15.034 -11.943 102 2HB ARG 13 2HB ARG 13 31.807 14.877 -12.095 103 1HG ARG 13 2HG ARG 13 31.935 15.454 -14.523 104 2HG ARG 13 1HG ARG 13 33.696 15.583 -14.400 105 1HD ARG 13 1HD ARG 13 33.737 13.094 -13.685 106 2HD ARG 13 2HD ARG 13 31.984 13.050 -13.978 107 HE ARG 13 HE ARG 13 33.207 14.088 -16.379 108 1HH1 ARG 13 2HH2 ARG 13 33.245 10.916 -14.670 109 2HH1 ARG 13 1HH2 ARG 13 33.582 10.085 -16.270 110 1HH2 ARG 13 1HH1 ARG 13 33.584 13.005 -18.077 111 2HH2 ARG 13 2HH1 ARG 13 33.758 11.179 -18.044 112 H GLY 14 H GLY 14 30.304 17.564 -11.229 113 1HA GLY 14 1HA GLY 14 30.562 16.641 -8.464 114 2HA GLY 14 2HA GLY 14 30.941 18.363 -8.507 115 HA PRO 15 HA PRO 15 26.173 17.924 -8.795 116 1HB PRO 15 1HB PRO 15 25.089 17.784 -6.271 117 2HB PRO 15 2HB PRO 15 25.756 16.381 -7.129 118 1HG PRO 15 1HG PRO 15 27.105 18.059 -4.986 119 2HG PRO 15 2HG PRO 15 27.006 16.271 -5.086 120 1HD PRO 15 1HD PRO 15 29.208 17.789 -5.994 121 2HD PRO 15 2HD PRO 15 28.778 16.201 -6.685 122 H GLY 16 H GLY 16 24.759 19.566 -8.768 123 1HA GLY 16 1HA GLY 16 23.828 21.775 -8.635 124 2HA GLY 16 2HA GLY 16 24.553 21.818 -7.038 125 H CYS 17 H CYS 17 24.683 23.209 -10.151 126 HA CYS 17 HA CYS 17 27.420 23.796 -10.530 127 1HB CYS 17 1HB CYS 17 24.978 25.276 -11.568 128 2HB CYS 17 2HB CYS 17 26.630 25.782 -11.984 129 HA PRO 18 HA PRO 18 27.606 27.318 -7.320 130 1HB PRO 18 1HB PRO 18 30.179 27.274 -6.502 131 2HB PRO 18 2HB PRO 18 29.023 25.978 -6.097 132 1HG PRO 18 1HG PRO 18 31.137 25.969 -8.304 133 2HG PRO 18 2HG PRO 18 30.795 24.682 -7.113 134 1HD PRO 18 2HD PRO 18 29.711 24.740 -9.735 135 2HD PRO 18 1HD PRO 18 28.915 23.932 -8.356 136 H THR 19 H THR 19 30.466 27.443 -9.457 137 HA THR 19 HA THR 19 29.871 30.321 -10.180 138 HB THR 19 HB THR 19 32.130 29.954 -9.617 139 HG1 THR 19 HG1 THR 19 31.493 31.417 -11.174 140 1HG2 THR 19 1HG2 THR 19 32.570 28.146 -12.086 141 2HG2 THR 19 2HG2 THR 19 33.849 28.840 -11.054 142 3HG2 THR 19 3HG2 THR 19 32.735 27.614 -10.391 143 H VAL 20 H VAL 20 30.077 30.895 -12.466 144 HA VAL 20 HA VAL 20 29.486 29.096 -14.601 145 HB VAL 20 HB VAL 20 27.220 30.971 -14.290 146 1HG1 VAL 20 1HG2 VAL 20 26.080 29.854 -16.245 147 2HG1 VAL 20 2HG2 VAL 20 27.714 30.384 -16.669 148 3HG1 VAL 20 3HG2 VAL 20 27.414 28.667 -16.338 149 1HG2 VAL 20 1HG1 VAL 20 26.806 29.166 -12.578 150 2HG2 VAL 20 2HG1 VAL 20 25.533 29.142 -13.811 151 3HG2 VAL 20 3HG1 VAL 20 26.845 27.924 -13.845 152 H LYS 21 H LYS 21 31.083 30.132 -14.856 153 HA LYS 21 HA LYS 21 31.827 32.978 -15.301 154 1HB LYS 21 1HB LYS 21 33.310 30.454 -16.275 155 2HB LYS 21 2HB LYS 21 33.950 32.067 -16.527 156 1HG LYS 21 1HG LYS 21 34.130 32.538 -14.127 157 2HG LYS 21 2HG LYS 21 33.371 30.999 -13.710 158 1HD LYS 21 1HD LYS 21 35.248 29.734 -14.766 159 2HD LYS 21 2HD LYS 21 36.037 31.252 -15.233 160 1HE LYS 21 1HE LYS 21 36.287 31.872 -12.786 161 2HE LYS 21 2HE LYS 21 35.503 30.350 -12.322 162 1HZ LYS 21 1HZ LYS 21 37.294 29.148 -13.467 163 2HZ LYS 21 2HZ LYS 21 38.025 30.566 -13.899 164 3HZ LYS 21 3HZ LYS 21 37.914 30.145 -12.305 165 HA PRO 22 HA PRO 22 30.090 34.023 -19.099 166 1HB PRO 22 1HB PRO 22 32.254 35.932 -19.910 167 2HB PRO 22 2HB PRO 22 30.554 36.229 -19.475 168 1HG PRO 22 2HG PRO 22 32.512 36.847 -17.660 169 2HG PRO 22 1HG PRO 22 31.036 36.016 -17.084 170 1HD PRO 22 2HD PRO 22 33.704 34.677 -17.862 171 2HD PRO 22 1HD PRO 22 32.831 34.633 -16.309 172 H DAL 23 H ALA 23 30.215 32.022 -20.079 173 HA DAL 23 HA ALA 23 32.078 31.697 -22.487 174 1HB DAL 23 1HB ALA 23 30.115 31.140 -23.909 175 2HB DAL 23 2HB ALA 23 29.905 32.752 -23.189 176 3HB DAL 23 3HB ALA 23 29.019 31.357 -22.518 177 H ILE 24 H ILE 24 30.427 29.824 -19.946 178 HA ILE 24 HA ILE 24 31.451 27.321 -21.195 179 HB ILE 24 HB ILE 24 30.030 27.243 -18.545 180 1HG1 ILE 24 2HG1 ILE 24 33.118 27.613 -18.518 181 2HG1 ILE 24 1HG1 ILE 24 32.048 28.985 -18.414 182 1HG2 ILE 24 1HG2 ILE 24 32.213 25.468 -19.821 183 2HG2 ILE 24 2HG2 ILE 24 30.469 25.081 -19.643 184 3HG2 ILE 24 3HG2 ILE 24 31.502 25.182 -18.203 185 1HD1 ILE 24 1HD1 ILE 24 32.697 28.280 -16.152 186 2HD1 ILE 24 2HD1 ILE 24 30.911 28.117 -16.420 187 3HD1 ILE 24 3HD1 ILE 24 31.943 26.667 -16.459 188 H SER 25 H SER 25 30.127 25.763 -21.773 189 HA SER 25 HA SER 25 27.091 26.154 -22.080 190 1HB SER 25 2HB SER 25 28.376 25.856 -24.197 191 2HB SER 25 1HB SER 25 29.094 24.354 -23.581 192 HG SER 25 HG SER 25 26.314 24.882 -23.913 193 H LEU 26 H LEU 26 26.806 25.691 -19.856 194 HA LEU 26 HA LEU 26 28.131 23.467 -18.490 195 1HB LEU 26 2HB LEU 26 26.508 25.772 -17.588 196 2HB LEU 26 1HB LEU 26 25.839 24.385 -16.880 197 HG LEU 26 HG LEU 26 27.217 25.231 -15.214 198 1HD1 LEU 26 1HD2 LEU 26 28.896 22.934 -16.214 199 2HD1 LEU 26 2HD2 LEU 26 28.841 23.591 -14.547 200 3HD1 LEU 26 3HD2 LEU 26 27.398 22.823 -15.266 201 1HD2 LEU 26 1HD1 LEU 26 28.615 26.781 -16.652 202 2HD2 LEU 26 2HD1 LEU 26 29.666 25.396 -17.001 203 3HD2 LEU 26 3HD1 LEU 26 29.507 25.992 -15.338 204 H ARG 27 H ARG 27 27.127 21.697 -17.375 205 HA ARG 27 HA ARG 27 24.523 20.609 -18.543 206 1HB ARG 27 2HB ARG 27 27.113 18.964 -18.191 207 2HB ARG 27 1HB ARG 27 25.527 18.222 -18.234 208 1HG ARG 27 1HG ARG 27 25.101 19.122 -20.539 209 2HG ARG 27 2HG ARG 27 26.679 19.890 -20.516 210 1HD ARG 27 1HD ARG 27 27.054 17.954 -21.790 211 2HD ARG 27 2HD ARG 27 27.733 17.512 -20.235 212 HE ARG 27 HE ARG 27 25.864 15.944 -19.871 213 1HH1 ARG 27 2HH1 ARG 27 25.442 17.540 -23.070 214 2HH1 ARG 27 1HH1 ARG 27 24.231 16.241 -23.532 215 1HH2 ARG 27 2HH2 ARG 27 24.494 14.576 -20.540 216 2HH2 ARG 27 1HH2 ARG 27 23.739 14.696 -22.208 217 H CYS 28 H CYS 28 24.659 22.149 -16.524 218 HA CYS 28 HA CYS 28 24.833 21.288 -13.977 219 1HB CYS 28 2HB CYS 28 22.814 23.316 -15.049 220 2HB CYS 28 1HB CYS 28 23.142 23.106 -13.308 221 H GLU 29 H GLU 29 21.727 20.717 -15.734 222 HA GLU 29 HA GLU 29 20.633 19.175 -13.318 223 1HB GLU 29 2HB GLU 29 19.261 20.136 -15.912 224 2HB GLU 29 1HB GLU 29 18.488 19.028 -14.789 225 1HG GLU 29 1HG GLU 29 18.549 20.720 -12.958 226 2HG GLU 29 2HG GLU 29 19.348 21.875 -14.034 227 HE2 GLU 29 HE2 GLU 29 16.570 20.255 -13.211 Start of MODEL 36 1 1H SER 1 1H SER 1 23.024 20.863 -10.041 2 2H SER 1 2H SER 1 22.205 20.177 -11.302 3 3H SER 1 3H SER 1 21.372 20.845 -10.041 4 HA SER 1 HA SER 1 22.206 19.221 -8.506 5 1HB SER 1 2HB SER 1 20.027 18.872 -9.630 6 2HB SER 1 1HB SER 1 20.832 18.004 -10.952 7 HG SER 1 HG SER 1 20.884 17.311 -8.195 8 H LYS 2 H LYS 2 23.427 18.405 -11.772 9 HA LYS 2 HA LYS 2 25.911 17.283 -10.528 10 1HB LYS 2 2HB LYS 2 26.044 15.160 -11.610 11 2HB LYS 2 1HB LYS 2 24.710 15.242 -10.483 12 1HG LYS 2 2HG LYS 2 23.086 15.408 -12.460 13 2HG LYS 2 1HG LYS 2 24.459 15.279 -13.532 14 1HD LYS 2 1HD LYS 2 23.687 13.120 -13.580 15 2HD LYS 2 2HD LYS 2 25.015 12.967 -12.451 16 1HE LYS 2 2HE LYS 2 23.312 13.020 -10.529 17 2HE LYS 2 1HE LYS 2 22.008 13.145 -11.722 18 1HZ LYS 2 1HZ LYS 2 22.746 11.011 -12.661 19 2HZ LYS 2 2HZ LYS 2 23.962 10.895 -11.549 20 3HZ LYS 2 3HZ LYS 2 22.385 10.843 -11.058 21 H TYR 3 H TYR 3 26.883 19.000 -11.405 22 HA TYR 3 HA TYR 3 26.667 19.736 -14.294 23 1HB TYR 3 2HB TYR 3 27.810 21.740 -13.772 24 2HB TYR 3 1HB TYR 3 26.663 21.466 -12.504 25 HD1 TYR 3 HD1 TYR 3 27.463 21.037 -10.147 26 HD2 TYR 3 HD2 TYR 3 30.315 21.439 -13.347 27 HE1 TYR 3 HE1 TYR 3 29.262 21.135 -8.561 28 HE2 TYR 3 HE2 TYR 3 32.083 21.611 -11.739 29 HH TYR 3 HH TYR 3 32.650 21.573 -9.579 30 H GLU 4 H GLU 4 28.344 19.790 -15.791 31 HA GLU 4 HA GLU 4 31.030 18.457 -15.176 32 1HB GLU 4 2HB GLU 4 29.598 16.763 -16.297 33 2HB GLU 4 1HB GLU 4 29.261 17.862 -17.626 34 1HG GLU 4 2HG GLU 4 31.689 17.784 -18.292 35 2HG GLU 4 1HG GLU 4 32.035 16.673 -16.982 36 HE2 GLU 4 HE2 GLU 4 30.911 15.293 -20.434 37 H TYR 5 H TYR 5 32.426 20.091 -15.481 38 HA TYR 5 HA TYR 5 32.105 21.896 -17.944 39 1HB TYR 5 1HB TYR 5 32.723 23.869 -17.025 40 2HB TYR 5 2HB TYR 5 31.324 23.217 -16.232 41 HD1 TYR 5 HD1 TYR 5 35.019 23.874 -15.746 42 HD2 TYR 5 HD2 TYR 5 31.204 23.405 -13.810 43 HE1 TYR 5 HE1 TYR 5 35.934 24.724 -13.670 44 HE2 TYR 5 HE2 TYR 5 32.171 24.224 -11.746 45 HH TYR 5 HH TYR 5 33.968 25.002 -10.734 46 H THR 6 H THR 6 33.664 21.416 -19.254 47 HA THR 6 HA THR 6 36.315 20.429 -18.285 48 HB THR 6 HB THR 6 35.366 20.648 -21.205 49 HG1 THR 6 HG1 THR 6 34.547 18.572 -20.935 50 1HG2 THR 6 1HG2 THR 6 36.686 18.550 -21.549 51 2HG2 THR 6 2HG2 THR 6 37.171 18.560 -19.833 52 3HG2 THR 6 3HG2 THR 6 37.743 19.854 -20.922 53 H VAL 7 H VAL 7 37.584 21.979 -17.689 54 HA VAL 7 HA VAL 7 38.253 24.281 -19.602 55 HB VAL 7 HB VAL 7 38.019 24.511 -16.560 56 1HG1 VAL 7 1HG2 VAL 7 39.937 25.923 -17.361 57 2HG1 VAL 7 2HG2 VAL 7 38.866 26.810 -18.459 58 3HG1 VAL 7 3HG2 VAL 7 38.645 26.928 -16.685 59 1HG2 VAL 7 1HG1 VAL 7 36.344 26.034 -18.684 60 2HG2 VAL 7 2HG1 VAL 7 35.787 24.651 -17.727 61 3HG2 VAL 7 3HG1 VAL 7 36.173 26.171 -16.906 62 HA DPR 8 HA PRO 8 42.572 22.955 -18.514 63 1HB DPR 8 1HB PRO 8 43.462 24.428 -20.080 64 2HB DPR 8 2HB PRO 8 43.802 22.930 -20.979 65 1HG DPR 8 2HG PRO 8 42.379 24.861 -22.186 66 2HG DPR 8 1HG PRO 8 41.829 23.155 -22.309 67 1HD DPR 8 1HD PRO 8 40.680 25.363 -20.544 68 2HD DPR 8 2HD PRO 8 39.819 24.050 -21.391 69 H SER 9 H SER 9 43.823 21.094 -18.997 70 HA SER 9 HA SER 9 42.260 18.605 -19.842 71 1HB SER 9 2HB SER 9 44.267 17.341 -19.297 72 2HB SER 9 1HB SER 9 44.690 18.717 -20.325 73 HG SER 9 HG SER 9 46.076 18.478 -18.541 74 H TYR 10 H TYR 10 40.687 19.931 -18.069 75 HA TYR 10 HA TYR 10 40.501 17.960 -15.805 76 1HB TYR 10 1HB TYR 10 41.114 20.912 -15.366 77 2HB TYR 10 2HB TYR 10 39.718 20.375 -14.501 78 HD1 TYR 10 HD1 TYR 10 43.407 19.940 -14.746 79 HD2 TYR 10 HD2 TYR 10 39.845 18.660 -12.679 80 HE1 TYR 10 HE1 TYR 10 44.744 18.968 -12.974 81 HE2 TYR 10 HE2 TYR 10 41.217 17.706 -10.937 82 HH TYR 10 HH TYR 10 43.269 17.338 -10.190 83 H THR 11 H THR 11 38.824 17.153 -16.592 84 HA THR 11 HA THR 11 36.316 18.596 -17.460 85 HB THR 11 HB THR 11 36.693 15.601 -16.950 86 HG1 THR 11 HG1 THR 11 37.068 15.507 -19.173 87 1HG2 THR 11 1HG2 THR 11 34.709 17.044 -18.823 88 2HG2 THR 11 2HG2 THR 11 34.271 16.263 -17.281 89 3HG2 THR 11 3HG2 THR 11 34.885 15.281 -18.646 90 H PHE 12 H PHE 12 35.504 19.806 -15.700 91 HA PHE 12 HA PHE 12 35.999 18.821 -12.892 92 1HB PHE 12 2HB PHE 12 34.798 21.410 -13.931 93 2HB PHE 12 1HB PHE 12 34.912 21.035 -12.239 94 HD1 PHE 12 HD1 PHE 12 36.812 22.340 -15.078 95 HD2 PHE 12 HD2 PHE 12 37.221 20.716 -11.105 96 HE1 PHE 12 HE1 PHE 12 38.976 23.402 -14.837 97 HE2 PHE 12 HE2 PHE 12 39.390 21.778 -10.921 98 HZ PHE 12 HZ PHE 12 40.285 23.131 -12.773 99 H ARG 13 H ARG 13 34.641 17.019 -12.896 100 HA ARG 13 HA ARG 13 31.645 17.380 -13.162 101 1HB ARG 13 2HB ARG 13 33.323 14.826 -12.709 102 2HB ARG 13 1HB ARG 13 31.560 14.833 -12.697 103 1HG ARG 13 1HG ARG 13 31.516 15.659 -15.062 104 2HG ARG 13 2HG ARG 13 33.281 15.623 -15.108 105 1HD ARG 13 1HD ARG 13 33.199 13.099 -14.680 106 2HD ARG 13 2HD ARG 13 31.425 13.189 -14.712 107 HE ARG 13 HE ARG 13 32.682 14.357 -17.146 108 1HH1 ARG 13 1HH2 ARG 13 31.496 11.223 -15.822 109 2HH1 ARG 13 2HH2 ARG 13 31.338 10.587 -17.535 110 1HH2 ARG 13 2HH1 ARG 13 32.447 13.493 -18.989 111 2HH2 ARG 13 1HH1 ARG 13 31.835 11.774 -19.183 112 H GLY 14 H GLY 14 30.411 17.513 -11.382 113 1HA GLY 14 2HA GLY 14 30.888 16.278 -8.769 114 2HA GLY 14 1HA GLY 14 31.424 17.957 -8.695 115 HA PRO 15 HA PRO 15 26.612 17.934 -8.486 116 1HB PRO 15 2HB PRO 15 25.766 17.464 -5.906 117 2HB PRO 15 1HB PRO 15 26.152 16.177 -7.065 118 1HG PRO 15 2HG PRO 15 27.922 17.275 -4.849 119 2HG PRO 15 1HG PRO 15 27.575 15.559 -5.229 120 1HD PRO 15 2HD PRO 15 29.861 16.923 -6.135 121 2HD PRO 15 1HD PRO 15 29.125 15.579 -7.049 122 H GLY 16 H GLY 16 25.383 19.671 -7.981 123 1HA GLY 16 1HA GLY 16 24.690 21.806 -7.063 124 2HA GLY 16 2HA GLY 16 26.053 21.752 -5.957 125 H CYS 17 H CYS 17 24.909 23.080 -8.897 126 HA CYS 17 HA CYS 17 27.351 23.626 -10.294 127 1HB CYS 17 2HB CYS 17 24.771 25.193 -10.629 128 2HB CYS 17 1HB CYS 17 26.054 24.939 -11.825 129 HA PRO 18 HA PRO 18 28.218 27.241 -7.433 130 1HB PRO 18 1HB PRO 18 30.877 27.186 -7.121 131 2HB PRO 18 2HB PRO 18 29.827 25.850 -6.581 132 1HG PRO 18 2HG PRO 18 31.523 25.982 -9.113 133 2HG PRO 18 1HG PRO 18 31.368 24.625 -7.962 134 1HD PRO 18 2HD PRO 18 29.875 24.922 -10.374 135 2HD PRO 18 1HD PRO 18 29.380 23.895 -9.010 136 H THR 19 H THR 19 30.769 27.641 -9.931 137 HA THR 19 HA THR 19 29.889 30.477 -10.412 138 HB THR 19 HB THR 19 31.965 30.491 -11.901 139 HG1 THR 19 HG1 THR 19 32.096 28.256 -12.160 140 1HG2 THR 19 1HG2 THR 19 32.141 31.477 -9.659 141 2HG2 THR 19 2HG2 THR 19 32.573 29.886 -8.976 142 3HG2 THR 19 3HG2 THR 19 33.663 30.684 -10.151 143 H VAL 20 H VAL 20 29.182 31.172 -12.337 144 HA VAL 20 HA VAL 20 28.701 29.290 -14.692 145 HB VAL 20 HB VAL 20 26.526 30.903 -13.534 146 1HG1 VAL 20 1HG2 VAL 20 26.206 28.779 -15.790 147 2HG1 VAL 20 2HG2 VAL 20 24.870 29.786 -15.152 148 3HG1 VAL 20 3HG2 VAL 20 26.220 30.538 -16.014 149 1HG2 VAL 20 1HG1 VAL 20 26.549 27.792 -13.344 150 2HG2 VAL 20 2HG1 VAL 20 26.808 28.919 -12.005 151 3HG2 VAL 20 3HG1 VAL 20 25.211 28.834 -12.768 152 H LYS 21 H LYS 21 30.385 30.878 -14.556 153 HA LYS 21 HA LYS 21 30.244 33.631 -15.569 154 1HB LYS 21 1HB LYS 21 32.602 31.650 -15.787 155 2HB LYS 21 2HB LYS 21 32.736 33.317 -16.318 156 1HG LYS 21 1HG LYS 21 32.296 34.214 -14.068 157 2HG LYS 21 2HG LYS 21 32.028 32.593 -13.422 158 1HD LYS 21 2HD LYS 21 34.385 31.944 -13.965 159 2HD LYS 21 1HD LYS 21 34.690 33.552 -14.644 160 1HE LYS 21 2HE LYS 21 34.263 34.592 -12.371 161 2HE LYS 21 1HE LYS 21 33.963 32.980 -11.692 162 1HZ LYS 21 1HZ LYS 21 36.232 32.352 -12.341 163 2HZ LYS 21 2HZ LYS 21 36.511 33.853 -12.973 164 3HZ LYS 21 3HZ LYS 21 36.256 33.674 -11.350 165 HA PRO 22 HA PRO 22 28.977 33.395 -19.669 166 1HB PRO 22 1HB PRO 22 30.559 35.774 -20.609 167 2HB PRO 22 2HB PRO 22 28.801 35.531 -20.477 168 1HG PRO 22 1HG PRO 22 30.068 37.072 -18.598 169 2HG PRO 22 2HG PRO 22 28.847 35.884 -18.050 170 1HD PRO 22 1HD PRO 22 31.897 35.454 -18.167 171 2HD PRO 22 2HD PRO 22 30.796 35.357 -16.770 172 H DAL 23 H ALA 23 29.649 31.561 -20.559 173 HA DAL 23 HA ALA 23 32.254 31.379 -22.159 174 1HB DAL 23 1HB ALA 23 30.334 31.939 -23.685 175 2HB DAL 23 2HB ALA 23 31.019 30.339 -24.049 176 3HB DAL 23 3HB ALA 23 29.485 30.466 -23.146 177 H ILE 24 H ILE 24 30.096 29.471 -20.067 178 HA ILE 24 HA ILE 24 31.794 27.033 -20.567 179 HB ILE 24 HB ILE 24 29.691 27.311 -18.421 180 1HG1 ILE 24 1HG1 ILE 24 32.747 27.563 -17.853 181 2HG1 ILE 24 2HG1 ILE 24 31.724 28.958 -18.083 182 1HG2 ILE 24 1HG2 ILE 24 30.874 25.281 -17.366 183 2HG2 ILE 24 2HG2 ILE 24 30.113 24.986 -18.945 184 3HG2 ILE 24 3HG2 ILE 24 31.885 25.201 -18.831 185 1HD1 ILE 24 1HD1 ILE 24 32.019 28.562 -15.680 186 2HD1 ILE 24 2HD1 ILE 24 31.321 26.915 -15.868 187 3HD1 ILE 24 3HD1 ILE 24 30.284 28.334 -16.156 188 H SER 25 H SER 25 30.876 25.311 -21.227 189 HA SER 25 HA SER 25 28.067 25.132 -22.487 190 1HB SER 25 1HB SER 25 29.973 24.748 -24.072 191 2HB SER 25 2HB SER 25 30.632 23.494 -23.003 192 HG SER 25 HG SER 25 28.644 22.368 -23.242 193 H LEU 26 H LEU 26 27.423 25.128 -20.253 194 HA LEU 26 HA LEU 26 28.512 23.183 -18.302 195 1HB LEU 26 2HB LEU 26 27.870 25.682 -17.917 196 2HB LEU 26 1HB LEU 26 26.217 25.136 -17.926 197 HG LEU 26 HG LEU 26 26.879 23.669 -15.781 198 1HD1 LEU 26 1HD1 LEU 26 28.898 24.200 -14.512 199 2HD1 LEU 26 2HD1 LEU 26 29.454 25.358 -15.747 200 3HD1 LEU 26 3HD1 LEU 26 29.315 23.621 -16.134 201 1HD2 LEU 26 1HD2 LEU 26 25.659 25.900 -15.622 202 2HD2 LEU 26 2HD2 LEU 26 26.751 25.672 -14.244 203 3HD2 LEU 26 3HD2 LEU 26 27.218 26.747 -15.589 204 H ARG 27 H ARG 27 27.372 21.612 -17.208 205 HA ARG 27 HA ARG 27 24.762 20.567 -18.463 206 1HB ARG 27 1HB ARG 27 27.269 18.877 -17.850 207 2HB ARG 27 2HB ARG 27 25.676 18.167 -18.000 208 1HG ARG 27 1HG ARG 27 25.461 19.000 -20.360 209 2HG ARG 27 2HG ARG 27 27.052 19.729 -20.232 210 1HD ARG 27 1HD ARG 27 27.467 17.735 -21.409 211 2HD ARG 27 2HD ARG 27 28.019 17.337 -19.788 212 HE ARG 27 HE ARG 27 25.301 16.437 -19.876 213 1HH1 ARG 27 2HH2 ARG 27 28.202 15.614 -21.846 214 2HH1 ARG 27 1HH2 ARG 27 27.479 13.961 -22.177 215 1HH2 ARG 27 1HH1 ARG 27 24.639 14.556 -20.341 216 2HH2 ARG 27 2HH1 ARG 27 25.620 13.413 -21.390 217 H CYS 28 H CYS 28 24.866 22.170 -16.461 218 HA CYS 28 HA CYS 28 24.660 21.298 -13.906 219 1HB CYS 28 2HB CYS 28 24.537 23.681 -14.578 220 2HB CYS 28 1HB CYS 28 22.832 23.470 -15.048 221 H GLU 29 H GLU 29 21.702 21.149 -16.002 222 HA GLU 29 HA GLU 29 20.238 19.563 -13.820 223 1HB GLU 29 1HB GLU 29 19.215 20.858 -16.430 224 2HB GLU 29 2HB GLU 29 18.232 19.760 -15.471 225 1HG GLU 29 2HG GLU 29 18.299 21.296 -13.507 226 2HG GLU 29 1HG GLU 29 19.308 22.432 -14.413 227 HE2 GLU 29 HE2 GLU 29 15.375 21.925 -15.298 Start of MODEL 37 1 1H SER 1 1H SER 1 20.181 18.778 -9.291 2 2H SER 1 2H SER 1 20.865 17.340 -9.731 3 3H SER 1 3H SER 1 21.345 18.092 -8.340 4 HA SER 1 HA SER 1 21.721 19.147 -11.091 5 1HB SER 1 2HB SER 1 22.654 20.234 -8.369 6 2HB SER 1 1HB SER 1 23.164 20.883 -9.938 7 HG SER 1 HG SER 1 20.958 21.235 -10.423 8 H LYS 2 H LYS 2 23.551 18.453 -12.041 9 HA LYS 2 HA LYS 2 25.933 17.410 -10.561 10 1HB LYS 2 1HB LYS 2 24.401 15.527 -12.457 11 2HB LYS 2 2HB LYS 2 26.107 15.319 -12.079 12 1HG LYS 2 1HG LYS 2 25.584 15.025 -9.644 13 2HG LYS 2 2HG LYS 2 23.867 15.245 -9.972 14 1HD LYS 2 2HD LYS 2 23.865 13.199 -11.430 15 2HD LYS 2 1HD LYS 2 25.583 12.954 -11.152 16 1HE LYS 2 1HE LYS 2 23.496 12.932 -8.856 17 2HE LYS 2 2HE LYS 2 23.905 11.518 -9.813 18 1HZ LYS 2 1HZ LYS 2 25.869 13.037 -8.178 19 2HZ LYS 2 2HZ LYS 2 25.197 11.579 -7.790 20 3HZ LYS 2 3HZ LYS 2 26.213 11.701 -9.086 21 H TYR 3 H TYR 3 26.997 19.031 -11.424 22 HA TYR 3 HA TYR 3 26.881 19.854 -14.295 23 1HB TYR 3 1HB TYR 3 28.278 21.708 -13.707 24 2HB TYR 3 2HB TYR 3 27.025 21.544 -12.524 25 HD1 TYR 3 HD1 TYR 3 27.644 21.368 -10.137 26 HD2 TYR 3 HD2 TYR 3 30.715 20.890 -13.116 27 HE1 TYR 3 HE1 TYR 3 29.345 21.463 -8.436 28 HE2 TYR 3 HE2 TYR 3 32.384 21.020 -11.400 29 HH TYR 3 HH TYR 3 32.806 21.221 -9.221 30 H GLU 4 H GLU 4 28.504 19.670 -15.826 31 HA GLU 4 HA GLU 4 31.075 18.120 -15.235 32 1HB GLU 4 2HB GLU 4 29.416 16.485 -16.113 33 2HB GLU 4 1HB GLU 4 29.121 17.484 -17.530 34 1HG GLU 4 1HG GLU 4 31.494 17.083 -18.293 35 2HG GLU 4 2HG GLU 4 31.800 16.082 -16.890 36 HE2 GLU 4 HE2 GLU 4 30.942 16.152 -19.919 37 H TYR 5 H TYR 5 32.523 19.707 -15.648 38 HA TYR 5 HA TYR 5 32.342 21.247 -18.289 39 1HB TYR 5 1HB TYR 5 32.831 23.388 -17.443 40 2HB TYR 5 2HB TYR 5 31.341 22.717 -16.844 41 HD1 TYR 5 HD1 TYR 5 30.907 22.696 -14.407 42 HD2 TYR 5 HD2 TYR 5 34.837 23.668 -15.846 43 HE1 TYR 5 HE1 TYR 5 31.462 23.707 -12.271 44 HE2 TYR 5 HE2 TYR 5 35.361 24.653 -13.692 45 HH TYR 5 HH TYR 5 32.994 24.727 -11.055 46 H THR 6 H THR 6 34.138 20.963 -19.443 47 HA THR 6 HA THR 6 36.768 20.363 -18.207 48 HB THR 6 HB THR 6 37.504 20.435 -20.734 49 HG1 THR 6 HG1 THR 6 34.709 20.336 -21.039 50 1HG2 THR 6 1HG2 THR 6 35.529 18.253 -19.937 51 2HG2 THR 6 2HG2 THR 6 37.284 18.286 -19.603 52 3HG2 THR 6 3HG2 THR 6 36.706 18.195 -21.286 53 H VAL 7 H VAL 7 37.862 21.899 -17.400 54 HA VAL 7 HA VAL 7 38.473 24.426 -19.055 55 HB VAL 7 HB VAL 7 38.625 24.066 -16.014 56 1HG1 VAL 7 1HG2 VAL 7 39.718 26.565 -17.478 57 2HG1 VAL 7 2HG2 VAL 7 39.634 26.324 -15.705 58 3HG1 VAL 7 3HG2 VAL 7 40.693 25.307 -16.696 59 1HG2 VAL 7 1HG1 VAL 7 37.053 25.991 -15.823 60 2HG2 VAL 7 2HG1 VAL 7 37.101 26.264 -17.592 61 3HG2 VAL 7 3HG1 VAL 7 36.368 24.798 -16.938 62 HA DPR 8 HA PRO 8 42.674 22.456 -19.061 63 1HB DPR 8 2HB PRO 8 43.392 23.988 -20.662 64 2HB DPR 8 1HB PRO 8 43.378 22.554 -21.717 65 1HG DPR 8 1HG PRO 8 41.976 24.721 -22.464 66 2HG DPR 8 2HG PRO 8 41.225 23.093 -22.597 67 1HD DPR 8 1HD PRO 8 40.676 25.232 -20.495 68 2HD DPR 8 2HD PRO 8 39.541 24.063 -21.223 69 H SER 9 H SER 9 43.537 20.533 -19.888 70 HA SER 9 HA SER 9 41.649 18.306 -20.726 71 1HB SER 9 2HB SER 9 44.106 18.287 -21.326 72 2HB SER 9 1HB SER 9 44.503 18.165 -19.595 73 HG SER 9 HG SER 9 42.886 16.367 -21.086 74 H TYR 10 H TYR 10 40.470 19.666 -18.512 75 HA TYR 10 HA TYR 10 40.587 17.587 -16.313 76 1HB TYR 10 2HB TYR 10 41.912 20.188 -16.061 77 2HB TYR 10 1HB TYR 10 40.483 20.318 -15.102 78 HD1 TYR 10 HD1 TYR 10 40.162 18.826 -13.063 79 HD2 TYR 10 HD2 TYR 10 43.724 18.512 -15.474 80 HE1 TYR 10 HE1 TYR 10 41.235 17.510 -11.349 81 HE2 TYR 10 HE2 TYR 10 44.759 17.200 -13.737 82 HH TYR 10 HH TYR 10 44.554 16.289 -11.727 83 H THR 11 H THR 11 38.731 16.961 -16.869 84 HA THR 11 HA THR 11 36.240 18.533 -17.222 85 HB THR 11 HB THR 11 36.401 15.527 -16.638 86 HG1 THR 11 HG1 THR 11 36.616 16.873 -19.117 87 1HG2 THR 11 1HG2 THR 11 34.378 17.061 -18.397 88 2HG2 THR 11 2HG2 THR 11 34.402 15.303 -18.097 89 3HG2 THR 11 3HG2 THR 11 34.035 16.434 -16.766 90 H PHE 12 H PHE 12 35.646 19.751 -15.468 91 HA PHE 12 HA PHE 12 36.096 18.790 -12.636 92 1HB PHE 12 1HB PHE 12 35.065 21.436 -13.781 93 2HB PHE 12 2HB PHE 12 35.008 21.093 -12.079 94 HD1 PHE 12 HD1 PHE 12 37.104 20.942 -10.694 95 HD2 PHE 12 HD2 PHE 12 37.329 21.818 -14.911 96 HE1 PHE 12 HE1 PHE 12 39.370 21.739 -10.427 97 HE2 PHE 12 HE2 PHE 12 39.599 22.601 -14.596 98 HZ PHE 12 HZ PHE 12 40.645 22.572 -12.368 99 H ARG 13 H ARG 13 34.718 17.022 -12.636 100 HA ARG 13 HA ARG 13 31.736 17.416 -12.923 101 1HB ARG 13 2HB ARG 13 33.395 14.863 -12.399 102 2HB ARG 13 1HB ARG 13 31.629 14.876 -12.367 103 1HG ARG 13 1HG ARG 13 31.557 15.640 -14.738 104 2HG ARG 13 2HG ARG 13 33.323 15.593 -14.810 105 1HD ARG 13 2HD ARG 13 33.253 13.092 -14.345 106 2HD ARG 13 1HD ARG 13 31.479 13.170 -14.306 107 HE ARG 13 HE ARG 13 32.331 14.349 -16.811 108 1HH1 ARG 13 1HH1 ARG 13 32.346 11.038 -15.391 109 2HH1 ARG 13 2HH1 ARG 13 32.296 10.337 -17.086 110 1HH2 ARG 13 1HH2 ARG 13 32.277 13.405 -18.629 111 2HH2 ARG 13 2HH2 ARG 13 32.261 11.576 -18.771 112 H GLY 14 H GLY 14 30.473 17.596 -11.165 113 1HA GLY 14 2HA GLY 14 30.946 16.458 -8.496 114 2HA GLY 14 1HA GLY 14 31.415 18.160 -8.489 115 HA PRO 15 HA PRO 15 26.596 17.945 -8.463 116 1HB PRO 15 2HB PRO 15 25.621 17.344 -5.948 117 2HB PRO 15 1HB PRO 15 26.089 16.119 -7.144 118 1HG PRO 15 2HG PRO 15 27.728 17.146 -4.794 119 2HG PRO 15 1HG PRO 15 27.431 15.443 -5.264 120 1HD PRO 15 2HD PRO 15 29.736 16.866 -5.996 121 2HD PRO 15 1HD PRO 15 29.056 15.570 -7.016 122 H GLY 16 H GLY 16 25.261 19.620 -7.915 123 1HA GLY 16 1HA GLY 16 24.512 21.721 -6.961 124 2HA GLY 16 2HA GLY 16 25.882 21.702 -5.861 125 H CYS 17 H CYS 17 24.708 22.933 -8.843 126 HA CYS 17 HA CYS 17 27.176 23.557 -10.212 127 1HB CYS 17 2HB CYS 17 24.488 24.910 -10.646 128 2HB CYS 17 1HB CYS 17 25.835 24.795 -11.794 129 HA PRO 18 HA PRO 18 27.714 27.233 -7.351 130 1HB PRO 18 2HB PRO 18 30.367 27.416 -7.024 131 2HB PRO 18 1HB PRO 18 29.433 25.996 -6.482 132 1HG PRO 18 1HG PRO 18 31.112 26.267 -9.017 133 2HG PRO 18 2HG PRO 18 31.093 24.913 -7.853 134 1HD PRO 18 1HD PRO 18 29.578 25.018 -10.255 135 2HD PRO 18 2HD PRO 18 29.156 23.994 -8.864 136 H THR 19 H THR 19 30.227 27.851 -9.833 137 HA THR 19 HA THR 19 29.073 30.610 -10.300 138 HB THR 19 HB THR 19 31.346 30.969 -11.399 139 HG1 THR 19 HG1 THR 19 31.810 28.792 -11.730 140 1HG2 THR 19 1HG2 THR 19 31.565 30.254 -8.440 141 2HG2 THR 19 2HG2 THR 19 32.711 31.251 -9.381 142 3HG2 THR 19 3HG2 THR 19 31.043 31.824 -9.107 143 H VAL 20 H VAL 20 28.791 31.386 -12.374 144 HA VAL 20 HA VAL 20 29.195 29.785 -14.764 145 HB VAL 20 HB VAL 20 27.340 28.735 -14.190 146 1HG1 VAL 20 1HG1 VAL 20 25.859 30.405 -13.018 147 2HG1 VAL 20 2HG1 VAL 20 25.419 31.126 -14.586 148 3HG1 VAL 20 3HG1 VAL 20 24.927 29.449 -14.189 149 1HG2 VAL 20 1HG2 VAL 20 26.651 30.185 -16.794 150 2HG2 VAL 20 2HG2 VAL 20 27.827 28.863 -16.599 151 3HG2 VAL 20 3HG2 VAL 20 26.104 28.544 -16.336 152 H LYS 21 H LYS 21 30.325 31.318 -14.549 153 HA LYS 21 HA LYS 21 29.834 34.142 -15.684 154 1HB LYS 21 1HB LYS 21 32.556 32.723 -15.473 155 2HB LYS 21 2HB LYS 21 32.334 34.403 -15.887 156 1HG LYS 21 1HG LYS 21 31.785 33.189 -13.121 157 2HG LYS 21 2HG LYS 21 33.276 33.978 -13.621 158 1HD LYS 21 1HD LYS 21 31.990 36.141 -13.991 159 2HD LYS 21 2HD LYS 21 30.521 35.329 -13.439 160 1HE LYS 21 2HE LYS 21 31.567 34.943 -11.167 161 2HE LYS 21 1HE LYS 21 33.052 35.747 -11.712 162 1HZ LYS 21 1HZ LYS 21 30.355 37.017 -11.608 163 2HZ LYS 21 2HZ LYS 21 31.737 37.766 -12.114 164 3HZ LYS 21 3HZ LYS 21 31.589 37.282 -10.542 165 HA PRO 22 HA PRO 22 29.423 33.051 -19.833 166 1HB PRO 22 1HB PRO 22 30.831 35.515 -20.906 167 2HB PRO 22 2HB PRO 22 29.146 34.977 -21.096 168 1HG PRO 22 1HG PRO 22 29.687 36.986 -19.312 169 2HG PRO 22 2HG PRO 22 28.575 35.680 -18.799 170 1HD PRO 22 1HD PRO 22 31.596 35.847 -18.238 171 2HD PRO 22 2HD PRO 22 30.233 35.740 -17.094 172 H DAL 23 H ALA 23 30.316 31.565 -21.102 173 HA DAL 23 HA ALA 23 33.184 30.910 -20.907 174 1HB DAL 23 1HB ALA 23 33.376 32.408 -22.895 175 2HB DAL 23 2HB ALA 23 33.752 30.717 -23.322 176 3HB DAL 23 3HB ALA 23 32.177 31.422 -23.774 177 H ILE 24 H ILE 24 31.664 29.447 -19.647 178 HA ILE 24 HA ILE 24 31.915 26.872 -20.776 179 HB ILE 24 HB ILE 24 30.221 27.344 -18.335 180 1HG1 ILE 24 1HG1 ILE 24 33.293 26.893 -18.090 181 2HG1 ILE 24 2HG1 ILE 24 32.586 28.488 -18.103 182 1HG2 ILE 24 1HG2 ILE 24 30.054 25.036 -19.037 183 2HG2 ILE 24 2HG2 ILE 24 31.826 24.873 -19.264 184 3HG2 ILE 24 3HG2 ILE 24 31.133 24.990 -17.633 185 1HD1 ILE 24 1HD1 ILE 24 32.960 27.809 -15.781 186 2HD1 ILE 24 2HD1 ILE 24 31.186 27.992 -16.115 187 3HD1 ILE 24 3HD1 ILE 24 31.909 26.369 -16.034 188 H SER 25 H SER 25 30.535 25.469 -21.413 189 HA SER 25 HA SER 25 27.596 26.033 -22.136 190 1HB SER 25 2HB SER 25 29.069 25.612 -24.126 191 2HB SER 25 1HB SER 25 29.638 24.094 -23.404 192 HG SER 25 HG SER 25 27.451 23.390 -23.373 193 H LEU 26 H LEU 26 27.182 25.671 -19.926 194 HA LEU 26 HA LEU 26 28.374 23.478 -18.385 195 1HB LEU 26 2HB LEU 26 27.647 25.954 -17.670 196 2HB LEU 26 1HB LEU 26 26.088 25.234 -17.423 197 HG LEU 26 HG LEU 26 27.264 23.673 -15.600 198 1HD1 LEU 26 1HD2 LEU 26 29.667 25.575 -16.025 199 2HD1 LEU 26 2HD2 LEU 26 29.601 23.860 -16.412 200 3HD1 LEU 26 3HD2 LEU 26 29.506 24.375 -14.712 201 1HD2 LEU 26 1HD1 LEU 26 25.976 25.782 -14.991 202 2HD2 LEU 26 2HD1 LEU 26 27.464 26.729 -15.174 203 3HD2 LEU 26 3HD1 LEU 26 27.338 25.509 -13.883 204 H ARG 27 H ARG 27 27.267 21.811 -17.233 205 HA ARG 27 HA ARG 27 24.719 20.739 -18.565 206 1HB ARG 27 2HB ARG 27 27.336 19.166 -18.119 207 2HB ARG 27 1HB ARG 27 25.783 18.375 -18.316 208 1HG ARG 27 1HG ARG 27 25.477 19.367 -20.589 209 2HG ARG 27 2HG ARG 27 27.017 20.213 -20.444 210 1HD ARG 27 1HD ARG 27 28.232 17.994 -20.283 211 2HD ARG 27 2HD ARG 27 26.684 17.139 -20.427 212 HE ARG 27 HE ARG 27 27.045 19.037 -22.663 213 1HH1 ARG 27 1HH1 ARG 27 28.068 15.723 -21.688 214 2HH1 ARG 27 2HH1 ARG 27 28.342 15.313 -23.455 215 1HH2 ARG 27 1HH2 ARG 27 27.401 18.417 -24.583 216 2HH2 ARG 27 2HH2 ARG 27 27.992 16.722 -24.961 217 H CYS 28 H CYS 28 24.711 22.165 -16.459 218 HA CYS 28 HA CYS 28 24.652 21.136 -13.965 219 1HB CYS 28 1HB CYS 28 24.204 23.534 -14.535 220 2HB CYS 28 2HB CYS 28 22.514 23.114 -14.909 221 H GLU 29 H GLU 29 21.716 20.702 -16.042 222 HA GLU 29 HA GLU 29 20.460 18.898 -13.899 223 1HB GLU 29 2HB GLU 29 19.276 20.130 -16.470 224 2HB GLU 29 1HB GLU 29 18.438 18.897 -15.541 225 1HG GLU 29 1HG GLU 29 18.329 20.375 -13.535 226 2HG GLU 29 2HG GLU 29 19.188 21.649 -14.411 227 HE2 GLU 29 HE2 GLU 29 18.264 22.715 -15.885 Start of MODEL 38 1 1H SER 1 1H SER 1 22.695 20.481 -10.044 2 2H SER 1 2H SER 1 22.022 19.826 -11.404 3 3H SER 1 3H SER 1 21.052 20.371 -10.183 4 HA SER 1 HA SER 1 21.859 18.708 -8.673 5 1HB SER 1 1HB SER 1 20.735 17.597 -11.291 6 2HB SER 1 2HB SER 1 20.776 16.715 -9.754 7 HG SER 1 HG SER 1 19.542 19.233 -10.207 8 H LYS 2 H LYS 2 23.421 18.201 -11.855 9 HA LYS 2 HA LYS 2 25.876 17.202 -10.500 10 1HB LYS 2 2HB LYS 2 24.397 15.247 -12.367 11 2HB LYS 2 1HB LYS 2 26.121 15.127 -12.032 12 1HG LYS 2 2HG LYS 2 25.675 14.814 -9.587 13 2HG LYS 2 1HG LYS 2 23.939 14.942 -9.876 14 1HD LYS 2 1HD LYS 2 24.028 12.877 -11.356 15 2HD LYS 2 2HD LYS 2 25.767 12.747 -11.070 16 1HE LYS 2 1HE LYS 2 25.338 12.409 -8.594 17 2HE LYS 2 2HE LYS 2 23.592 12.539 -8.881 18 1HZ LYS 2 1HZ LYS 2 23.754 10.610 -10.369 19 2HZ LYS 2 2HZ LYS 2 25.380 10.488 -10.101 20 3HZ LYS 2 3HZ LYS 2 24.318 10.232 -8.862 21 H TYR 3 H TYR 3 26.869 18.846 -11.393 22 HA TYR 3 HA TYR 3 26.606 19.643 -14.278 23 1HB TYR 3 1HB TYR 3 27.736 21.648 -13.745 24 2HB TYR 3 2HB TYR 3 26.585 21.361 -12.484 25 HD1 TYR 3 HD1 TYR 3 27.377 20.957 -10.122 26 HD2 TYR 3 HD2 TYR 3 30.244 21.342 -13.311 27 HE1 TYR 3 HE1 TYR 3 29.170 21.076 -8.527 28 HE2 TYR 3 HE2 TYR 3 32.004 21.539 -11.694 29 HH TYR 3 HH TYR 3 31.354 21.324 -8.189 30 H GLU 4 H GLU 4 28.296 19.713 -15.771 31 HA GLU 4 HA GLU 4 30.984 18.403 -15.129 32 1HB GLU 4 2HB GLU 4 29.583 16.686 -16.225 33 2HB GLU 4 1HB GLU 4 29.239 17.731 -17.584 34 1HG GLU 4 2HG GLU 4 32.093 16.775 -16.879 35 2HG GLU 4 1HG GLU 4 30.979 15.817 -17.857 36 HE2 GLU 4 HE2 GLU 4 31.480 17.506 -20.750 37 H TYR 5 H TYR 5 32.382 20.021 -15.468 38 HA TYR 5 HA TYR 5 32.060 21.801 -17.949 39 1HB TYR 5 2HB TYR 5 32.657 23.791 -17.038 40 2HB TYR 5 1HB TYR 5 31.255 23.126 -16.255 41 HD1 TYR 5 HD1 TYR 5 34.931 23.841 -15.731 42 HD2 TYR 5 HD2 TYR 5 31.106 23.296 -13.833 43 HE1 TYR 5 HE1 TYR 5 35.807 24.708 -13.646 44 HE2 TYR 5 HE2 TYR 5 32.034 24.135 -11.761 45 HH TYR 5 HH TYR 5 33.807 24.947 -10.729 46 H THR 6 H THR 6 33.636 21.328 -19.244 47 HA THR 6 HA THR 6 36.291 20.383 -18.250 48 HB THR 6 HB THR 6 35.372 20.583 -21.180 49 HG1 THR 6 HG1 THR 6 34.575 18.498 -20.915 50 1HG2 THR 6 1HG2 THR 6 36.720 18.499 -21.504 51 2HG2 THR 6 2HG2 THR 6 37.184 18.518 -19.781 52 3HG2 THR 6 3HG2 THR 6 37.755 19.817 -20.867 53 H VAL 7 H VAL 7 37.544 21.946 -17.652 54 HA VAL 7 HA VAL 7 38.202 24.248 -19.569 55 HB VAL 7 HB VAL 7 37.939 24.494 -16.530 56 1HG1 VAL 7 1HG1 VAL 7 39.847 25.923 -17.327 57 2HG1 VAL 7 2HG1 VAL 7 38.774 26.790 -18.440 58 3HG1 VAL 7 3HG1 VAL 7 38.538 26.918 -16.669 59 1HG2 VAL 7 1HG2 VAL 7 36.077 26.130 -16.902 60 2HG2 VAL 7 2HG2 VAL 7 35.715 24.600 -17.714 61 3HG2 VAL 7 3HG2 VAL 7 36.263 25.982 -18.677 62 HA DPR 8 HA PRO 8 42.524 22.974 -18.431 63 1HB DPR 8 1HB PRO 8 43.413 24.446 -20.000 64 2HB DPR 8 2HB PRO 8 43.778 22.945 -20.885 65 1HG DPR 8 1HG PRO 8 42.346 24.852 -22.119 66 2HG DPR 8 2HG PRO 8 41.815 23.139 -22.235 67 1HD DPR 8 1HD PRO 8 40.625 25.348 -20.496 68 2HD DPR 8 2HD PRO 8 39.787 24.019 -21.342 69 H SER 9 H SER 9 43.799 21.123 -18.889 70 HA SER 9 HA SER 9 42.270 18.612 -19.732 71 1HB SER 9 2HB SER 9 44.286 17.373 -19.158 72 2HB SER 9 1HB SER 9 44.704 18.747 -20.191 73 HG SER 9 HG SER 9 45.246 19.896 -18.272 74 H TYR 10 H TYR 10 40.666 19.934 -17.984 75 HA TYR 10 HA TYR 10 40.477 17.975 -15.710 76 1HB TYR 10 1HB TYR 10 41.051 20.936 -15.283 77 2HB TYR 10 2HB TYR 10 39.652 20.388 -14.429 78 HD1 TYR 10 HD1 TYR 10 39.782 18.685 -12.595 79 HD2 TYR 10 HD2 TYR 10 43.349 19.996 -14.634 80 HE1 TYR 10 HE1 TYR 10 41.146 17.760 -10.833 81 HE2 TYR 10 HE2 TYR 10 44.679 19.052 -12.842 82 HH TYR 10 HH TYR 10 44.697 17.974 -10.920 83 H THR 11 H THR 11 38.817 17.143 -16.513 84 HA THR 11 HA THR 11 36.304 18.555 -17.416 85 HB THR 11 HB THR 11 36.707 15.566 -16.891 86 HG1 THR 11 HG1 THR 11 38.184 16.407 -18.390 87 1HG2 THR 11 1HG2 THR 11 34.282 16.202 -17.251 88 2HG2 THR 11 2HG2 THR 11 34.729 16.982 -18.790 89 3HG2 THR 11 3HG2 THR 11 34.922 15.222 -18.605 90 H PHE 12 H PHE 12 35.464 19.765 -15.670 91 HA PHE 12 HA PHE 12 35.936 18.796 -12.854 92 1HB PHE 12 2HB PHE 12 34.721 21.369 -13.913 93 2HB PHE 12 1HB PHE 12 34.826 21.001 -12.219 94 HD1 PHE 12 HD1 PHE 12 36.729 22.331 -15.040 95 HD2 PHE 12 HD2 PHE 12 37.134 20.694 -11.072 96 HE1 PHE 12 HE1 PHE 12 38.883 23.413 -14.783 97 HE2 PHE 12 HE2 PHE 12 39.293 21.777 -10.873 98 HZ PHE 12 HZ PHE 12 40.183 23.146 -12.714 99 H ARG 13 H ARG 13 34.595 16.973 -12.888 100 HA ARG 13 HA ARG 13 31.597 17.312 -13.147 101 1HB ARG 13 2HB ARG 13 33.314 14.779 -12.702 102 2HB ARG 13 1HB ARG 13 31.552 14.754 -12.672 103 1HG ARG 13 1HG ARG 13 31.467 15.587 -15.037 104 2HG ARG 13 2HG ARG 13 33.230 15.579 -15.104 105 1HD ARG 13 2HD ARG 13 33.228 13.071 -14.709 106 2HD ARG 13 1HD ARG 13 31.453 13.093 -14.657 107 HE ARG 13 HE ARG 13 32.404 14.355 -17.140 108 1HH1 ARG 13 2HH1 ARG 13 31.935 11.047 -15.792 109 2HH1 ARG 13 1HH1 ARG 13 31.800 10.395 -17.502 110 1HH2 ARG 13 1HH2 ARG 13 32.231 13.466 -18.977 111 2HH2 ARG 13 2HH2 ARG 13 31.955 11.661 -19.159 112 H GLY 14 H GLY 14 30.360 17.435 -11.368 113 1HA GLY 14 1HA GLY 14 30.851 16.220 -8.748 114 2HA GLY 14 2HA GLY 14 31.375 17.902 -8.687 115 HA PRO 15 HA PRO 15 26.561 17.835 -8.450 116 1HB PRO 15 1HB PRO 15 25.739 17.378 -5.860 117 2HB PRO 15 2HB PRO 15 26.129 16.086 -7.013 118 1HG PRO 15 2HG PRO 15 27.905 17.218 -4.818 119 2HG PRO 15 1HG PRO 15 27.571 15.496 -5.182 120 1HD PRO 15 2HD PRO 15 29.838 16.869 -6.117 121 2HD PRO 15 1HD PRO 15 29.103 15.515 -7.017 122 H GLY 16 H GLY 16 25.309 19.562 -7.940 123 1HA GLY 16 2HA GLY 16 24.599 21.691 -7.032 124 2HA GLY 16 1HA GLY 16 25.969 21.658 -5.934 125 H CYS 17 H CYS 17 24.794 22.948 -8.885 126 HA CYS 17 HA CYS 17 27.225 23.530 -10.282 127 1HB CYS 17 2HB CYS 17 24.616 25.048 -10.627 128 2HB CYS 17 1HB CYS 17 25.905 24.814 -11.821 129 HA PRO 18 HA PRO 18 28.017 27.214 -7.485 130 1HB PRO 18 2HB PRO 18 30.663 27.146 -7.094 131 2HB PRO 18 1HB PRO 18 29.589 25.827 -6.561 132 1HG PRO 18 2HG PRO 18 31.380 25.894 -9.025 133 2HG PRO 18 1HG PRO 18 31.147 24.556 -7.867 134 1HD PRO 18 1HD PRO 18 29.761 24.889 -10.354 135 2HD PRO 18 2HD PRO 18 29.224 23.832 -9.032 136 H THR 19 H THR 19 30.619 27.522 -9.943 137 HA THR 19 HA THR 19 29.827 30.375 -10.467 138 HB THR 19 HB THR 19 31.926 30.315 -11.922 139 HG1 THR 19 HG1 THR 19 31.993 28.076 -12.163 140 1HG2 THR 19 1HG2 THR 19 32.473 29.713 -8.984 141 2HG2 THR 19 2HG2 THR 19 32.101 31.312 -9.683 142 3HG2 THR 19 3HG2 THR 19 33.604 30.468 -10.147 143 H VAL 20 H VAL 20 29.191 31.078 -12.419 144 HA VAL 20 HA VAL 20 28.664 29.174 -14.752 145 HB VAL 20 HB VAL 20 26.568 30.934 -13.663 146 1HG1 VAL 20 1HG1 VAL 20 24.877 29.895 -15.293 147 2HG1 VAL 20 2HG1 VAL 20 26.160 28.805 -15.899 148 3HG1 VAL 20 3HG1 VAL 20 26.281 30.554 -16.143 149 1HG2 VAL 20 1HG2 VAL 20 26.406 27.826 -13.441 150 2HG2 VAL 20 2HG2 VAL 20 25.124 28.952 -12.895 151 3HG2 VAL 20 3HG2 VAL 20 26.711 28.950 -12.107 152 H LYS 21 H LYS 21 30.436 30.668 -14.594 153 HA LYS 21 HA LYS 21 30.504 33.402 -15.591 154 1HB LYS 21 1HB LYS 21 32.724 31.244 -15.638 155 2HB LYS 21 2HB LYS 21 32.997 32.802 -16.384 156 1HG LYS 21 1HG LYS 21 32.438 33.994 -14.207 157 2HG LYS 21 2HG LYS 21 32.230 32.426 -13.461 158 1HD LYS 21 2HD LYS 21 34.305 32.963 -12.780 159 2HD LYS 21 1HD LYS 21 34.673 31.869 -14.116 160 1HE LYS 21 1HE LYS 21 35.217 33.918 -15.557 161 2HE LYS 21 2HE LYS 21 34.864 34.963 -14.169 162 1HZ LYS 21 1HZ LYS 21 36.641 33.822 -12.936 163 2HZ LYS 21 2HZ LYS 21 37.234 34.475 -14.333 164 3HZ LYS 21 3HZ LYS 21 36.969 32.848 -14.230 165 HA PRO 22 HA PRO 22 29.356 33.585 -19.692 166 1HB PRO 22 1HB PRO 22 31.310 35.724 -20.493 167 2HB PRO 22 2HB PRO 22 29.536 35.770 -20.363 168 1HG PRO 22 2HG PRO 22 31.041 36.981 -18.419 169 2HG PRO 22 1HG PRO 22 29.631 35.993 -17.930 170 1HD PRO 22 2HD PRO 22 32.566 35.036 -18.059 171 2HD PRO 22 1HD PRO 22 31.457 35.063 -16.675 172 H DAL 23 H ALA 23 29.841 31.616 -20.499 173 HA DAL 23 HA ALA 23 32.298 31.231 -22.288 174 1HB DAL 23 1HB ALA 23 29.399 30.527 -23.035 175 2HB DAL 23 2HB ALA 23 30.838 30.295 -24.063 176 3HB DAL 23 3HB ALA 23 30.304 31.938 -23.643 177 H ILE 24 H ILE 24 30.161 29.439 -20.059 178 HA ILE 24 HA ILE 24 31.744 26.946 -20.611 179 HB ILE 24 HB ILE 24 29.676 27.263 -18.440 180 1HG1 ILE 24 2HG1 ILE 24 32.740 27.455 -17.901 181 2HG1 ILE 24 1HG1 ILE 24 31.745 28.873 -18.126 182 1HG2 ILE 24 1HG2 ILE 24 31.794 25.091 -18.925 183 2HG2 ILE 24 2HG2 ILE 24 30.888 25.212 -17.400 184 3HG2 ILE 24 3HG2 ILE 24 30.009 24.938 -18.921 185 1HD1 ILE 24 1HD1 ILE 24 31.320 26.843 -15.902 186 2HD1 ILE 24 2HD1 ILE 24 30.301 28.273 -16.192 187 3HD1 ILE 24 3HD1 ILE 24 32.041 28.481 -15.726 188 H SER 25 H SER 25 30.784 25.248 -21.266 189 HA SER 25 HA SER 25 27.957 25.130 -22.493 190 1HB SER 25 1HB SER 25 29.835 24.719 -24.104 191 2HB SER 25 2HB SER 25 30.484 23.447 -23.051 192 HG SER 25 HG SER 25 27.886 23.506 -24.219 193 H LEU 26 H LEU 26 27.308 25.104 -20.275 194 HA LEU 26 HA LEU 26 28.415 23.185 -18.320 195 1HB LEU 26 1HB LEU 26 27.646 25.693 -17.968 196 2HB LEU 26 2HB LEU 26 26.039 25.043 -17.909 197 HG LEU 26 HG LEU 26 26.891 23.627 -15.786 198 1HD1 LEU 26 1HD1 LEU 26 29.319 23.789 -16.249 199 2HD1 LEU 26 2HD1 LEU 26 29.324 25.524 -15.884 200 3HD1 LEU 26 3HD1 LEU 26 28.930 24.338 -14.606 201 1HD2 LEU 26 1HD2 LEU 26 25.511 25.755 -15.581 202 2HD2 LEU 26 2HD2 LEU 26 26.998 26.722 -15.615 203 3HD2 LEU 26 3HD2 LEU 26 26.675 25.621 -14.249 204 H ARG 27 H ARG 27 27.314 21.575 -17.220 205 HA ARG 27 HA ARG 27 24.742 20.463 -18.492 206 1HB ARG 27 2HB ARG 27 27.301 18.853 -17.872 207 2HB ARG 27 1HB ARG 27 25.730 18.092 -18.032 208 1HG ARG 27 2HG ARG 27 25.486 18.904 -20.381 209 2HG ARG 27 1HG ARG 27 27.046 19.717 -20.277 210 1HD ARG 27 2HD ARG 27 28.197 17.493 -19.923 211 2HD ARG 27 1HD ARG 27 26.636 16.663 -20.009 212 HE ARG 27 HE ARG 27 28.022 18.099 -22.317 213 1HH1 ARG 27 2HH1 ARG 27 25.318 15.909 -21.393 214 2HH1 ARG 27 1HH1 ARG 27 25.043 15.538 -23.169 215 1HH2 ARG 27 2HH2 ARG 27 27.584 17.579 -24.249 216 2HH2 ARG 27 1HH2 ARG 27 26.228 16.412 -24.655 217 H CYS 28 H CYS 28 24.797 22.056 -16.476 218 HA CYS 28 HA CYS 28 24.606 21.148 -13.930 219 1HB CYS 28 2HB CYS 28 24.451 23.535 -14.566 220 2HB CYS 28 1HB CYS 28 22.755 23.306 -15.059 221 H GLU 29 H GLU 29 21.647 20.996 -16.028 222 HA GLU 29 HA GLU 29 20.578 18.762 -14.278 223 1HB GLU 29 1HB GLU 29 18.338 19.589 -14.097 224 2HB GLU 29 2HB GLU 29 19.471 20.631 -13.268 225 1HG GLU 29 2HG GLU 29 19.225 22.371 -15.089 226 2HG GLU 29 1HG GLU 29 18.080 21.319 -15.932 227 HE2 GLU 29 HE2 GLU 29 15.494 21.700 -13.618
Contact the webmaster for help, if required. Sunday, July 7, 2024 6:48:04 PM GMT (wattos1)