NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
580726 | 2mr5 | 25061 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 -3.631 -14.806 -0.619 2 H2 MET 1 2H MET 1 -4.212 -16.256 0.015 3 H3 MET 1 3H MET 1 -2.741 -16.223 -0.810 4 HA MET 1 HA MET 1 -3.345 -14.914 1.761 5 HB2 MET 1 2HB MET 1 -1.450 -17.217 1.110 6 HB3 MET 1 3HB MET 1 -1.653 -16.481 2.687 7 HG2 MET 1 2HG MET 1 -4.075 -17.245 2.586 8 HG3 MET 1 3HG MET 1 -3.613 -18.207 1.186 9 HE1 MET 1 3HE MET 1 -1.654 -20.161 1.364 10 HE2 MET 1 1HE MET 1 -0.922 -20.633 2.897 11 HE3 MET 1 2HE MET 1 -0.544 -19.065 2.185 12 H GLY 2 H GLY 2 -2.013 -13.255 2.347 13 HA2 GLY 2 2HA GLY 2 -0.121 -11.953 2.532 14 HA3 GLY 2 3HA GLY 2 0.740 -13.096 1.518 15 H THR 3 H THR 3 -2.210 -11.251 0.663 16 HA THR 3 HA THR 3 -0.965 -10.093 -1.677 17 HB THR 3 HB THR 3 -3.175 -8.753 -1.808 18 HG1 THR 3 HG1 THR 3 -4.575 -8.969 -0.224 19 HG21 THR 3 3HG2 THR 3 -3.388 -11.789 -1.716 20 HG22 THR 3 1HG2 THR 3 -2.823 -10.846 -3.096 21 HG23 THR 3 2HG2 THR 3 -4.496 -10.701 -2.553 22 H VAL 4 H VAL 4 -0.445 -7.877 -1.982 23 HA VAL 4 HA VAL 4 0.208 -6.472 0.557 24 HB VAL 4 HB VAL 4 1.844 -6.331 -2.043 25 HG11 VAL 4 1HG1 VAL 4 2.516 -5.409 0.789 26 HG12 VAL 4 2HG1 VAL 4 2.072 -4.358 -0.558 27 HG13 VAL 4 3HG1 VAL 4 3.574 -5.280 -0.619 28 HG21 VAL 4 3HG2 VAL 4 3.505 -7.816 -0.977 29 HG22 VAL 4 1HG2 VAL 4 1.946 -8.631 -1.139 30 HG23 VAL 4 2HG2 VAL 4 2.453 -8.002 0.429 31 H VAL 5 H VAL 5 -1.060 -4.733 0.712 32 HA VAL 5 HA VAL 5 -1.754 -3.207 -1.723 33 HB VAL 5 HB VAL 5 -3.886 -2.520 -0.554 34 HG11 VAL 5 1HG1 VAL 5 -5.116 -4.602 -1.070 35 HG12 VAL 5 2HG1 VAL 5 -3.594 -5.498 -1.089 36 HG13 VAL 5 3HG1 VAL 5 -3.898 -4.251 -2.297 37 HG21 VAL 5 3HG2 VAL 5 -4.769 -3.898 1.298 38 HG22 VAL 5 1HG2 VAL 5 -3.299 -3.048 1.782 39 HG23 VAL 5 2HG2 VAL 5 -3.232 -4.765 1.389 40 H ILE 6 H ILE 6 -0.780 -1.325 -1.799 41 HA ILE 6 HA ILE 6 0.470 -0.205 0.639 42 HB ILE 6 HB ILE 6 1.194 0.374 -2.277 43 HG12 ILE 6 2HG1 ILE 6 3.378 -0.953 -1.616 44 HG13 ILE 6 3HG1 ILE 6 2.384 -1.662 -0.353 45 HG21 ILE 6 1HG2 ILE 6 3.257 1.392 -1.347 46 HG22 ILE 6 2HG2 ILE 6 2.661 1.105 0.288 47 HG23 ILE 6 3HG2 ILE 6 1.803 2.218 -0.782 48 HD11 ILE 6 3HD1 ILE 6 1.892 -1.841 -3.327 49 HD12 ILE 6 1HD1 ILE 6 0.876 -2.558 -2.073 50 HD13 ILE 6 2HD1 ILE 6 2.538 -3.109 -2.286 51 H VAL 7 H VAL 7 -0.816 1.360 1.484 52 HA VAL 7 HA VAL 7 -2.543 3.010 -0.204 53 HB VAL 7 HB VAL 7 -2.206 3.124 2.836 54 HG11 VAL 7 1HG1 VAL 7 -4.450 4.168 1.051 55 HG12 VAL 7 2HG1 VAL 7 -3.250 5.154 1.891 56 HG13 VAL 7 3HG1 VAL 7 -4.426 4.219 2.816 57 HG21 VAL 7 3HG2 VAL 7 -4.219 1.548 1.206 58 HG22 VAL 7 1HG2 VAL 7 -4.219 1.716 2.963 59 HG23 VAL 7 2HG2 VAL 7 -2.891 0.879 2.157 60 H VAL 8 H VAL 8 -1.633 4.721 -1.135 61 HA VAL 8 HA VAL 8 0.371 6.328 0.334 62 HB VAL 8 HB VAL 8 0.048 6.158 -2.706 63 HG11 VAL 8 1HG1 VAL 8 2.193 7.520 -1.019 64 HG12 VAL 8 2HG1 VAL 8 0.908 8.341 -1.912 65 HG13 VAL 8 3HG1 VAL 8 2.149 7.444 -2.781 66 HG21 VAL 8 3HG2 VAL 8 2.185 4.902 -2.715 67 HG22 VAL 8 1HG2 VAL 8 0.930 4.027 -1.830 68 HG23 VAL 8 2HG2 VAL 8 2.193 4.889 -0.948 69 H SER 9 H SER 9 -0.083 8.394 0.726 70 HA SER 9 HA SER 9 -1.520 10.039 -1.149 71 HB2 SER 9 2HB SER 9 -3.171 10.950 0.448 72 HB3 SER 9 3HB SER 9 -3.443 9.229 0.209 73 HG SER 9 HG SER 9 -1.823 9.336 2.207 74 H ASN 10 H ASN 10 -1.095 12.262 -0.806 75 HA ASN 10 HA ASN 10 1.516 12.763 0.155 76 HB2 ASN 10 2HB ASN 10 -0.615 14.727 -0.790 77 HB3 ASN 10 3HB ASN 10 1.064 15.153 -0.463 78 HD21 ASN 10 1HD2 ASN 10 1.598 15.748 -2.529 79 HD22 ASN 10 2HD2 ASN 10 1.639 14.658 -3.867 80 H ASP 11 H ASP 11 -1.669 13.551 1.475 81 HA ASP 11 HA ASP 11 -0.591 15.075 3.709 82 HB2 ASP 11 2HB ASP 11 -2.758 15.711 2.618 83 HB3 ASP 11 3HB ASP 11 -3.459 14.192 3.160 84 H GLU 12 H GLU 12 -0.626 14.471 5.816 85 HA GLU 12 HA GLU 12 0.026 11.733 6.371 86 HB2 GLU 12 2HB GLU 12 -0.256 14.090 8.287 87 HB3 GLU 12 3HB GLU 12 0.531 12.555 8.651 88 HG2 GLU 12 2HG GLU 12 2.243 13.015 6.959 89 HG3 GLU 12 3HG GLU 12 1.448 14.532 6.548 90 H ARG 13 H ARG 13 -2.552 13.940 7.453 91 HA ARG 13 HA ARG 13 -3.739 12.294 9.405 92 HB2 ARG 13 2HB ARG 13 -5.039 14.491 7.759 93 HB3 ARG 13 3HB ARG 13 -5.647 13.850 9.285 94 HG2 ARG 13 2HG ARG 13 -3.911 14.868 10.542 95 HG3 ARG 13 3HG ARG 13 -2.916 15.148 9.108 96 HD2 ARG 13 2HD ARG 13 -5.549 16.530 9.739 97 HD3 ARG 13 3HD ARG 13 -3.938 17.246 9.882 98 HE ARG 13 HE ARG 13 -3.777 16.725 7.370 99 HH11 ARG 13 1HH1 ARG 13 -6.826 17.588 8.906 100 HH12 ARG 13 2HH1 ARG 13 -7.496 18.259 7.454 101 HH21 ARG 13 1HH2 ARG 13 -4.646 17.590 5.501 102 HH22 ARG 13 2HH2 ARG 13 -6.253 18.261 5.505 103 H ILE 14 H ILE 14 -4.135 12.431 5.950 104 HA ILE 14 HA ILE 14 -6.534 10.941 5.682 105 HB ILE 14 HB ILE 14 -4.165 11.150 3.758 106 HG12 ILE 14 2HG1 ILE 14 -4.954 13.381 4.170 107 HG13 ILE 14 3HG1 ILE 14 -5.638 12.912 2.623 108 HG21 ILE 14 1HG2 ILE 14 -5.763 10.531 1.975 109 HG22 ILE 14 2HG2 ILE 14 -7.022 10.281 3.185 110 HG23 ILE 14 3HG2 ILE 14 -5.597 9.240 3.171 111 HD11 ILE 14 3HD1 ILE 14 -7.808 12.478 3.756 112 HD12 ILE 14 1HD1 ILE 14 -7.258 14.145 3.914 113 HD13 ILE 14 2HD1 ILE 14 -7.101 13.037 5.274 114 H LEU 15 H LEU 15 -3.085 9.962 5.566 115 HA LEU 15 HA LEU 15 -3.502 7.164 5.435 116 HB2 LEU 15 2HB LEU 15 -1.132 8.785 6.444 117 HB3 LEU 15 3HB LEU 15 -1.095 7.037 6.239 118 HG LEU 15 HG LEU 15 -1.652 8.985 3.970 119 HD11 LEU 15 1HD1 LEU 15 0.629 9.304 4.800 120 HD12 LEU 15 2HD1 LEU 15 0.622 8.581 3.195 121 HD13 LEU 15 3HD1 LEU 15 0.952 7.578 4.612 122 HD21 LEU 15 3HD2 LEU 15 -2.620 6.775 3.565 123 HD22 LEU 15 1HD2 LEU 15 -1.078 5.996 3.934 124 HD23 LEU 15 2HD2 LEU 15 -1.234 7.026 2.506 125 H GLU 16 H GLU 16 -3.391 9.384 8.165 126 HA GLU 16 HA GLU 16 -3.300 7.422 10.233 127 HB2 GLU 16 2HB GLU 16 -3.842 10.383 10.106 128 HB3 GLU 16 3HB GLU 16 -4.388 9.525 11.541 129 HG2 GLU 16 2HG GLU 16 -2.214 10.515 11.925 130 HG3 GLU 16 3HG GLU 16 -2.106 8.763 11.995 131 H GLU 17 H GLU 17 -6.019 9.251 8.779 132 HA GLU 17 HA GLU 17 -8.105 8.113 10.336 133 HB2 GLU 17 2HB GLU 17 -8.362 10.212 9.041 134 HB3 GLU 17 3HB GLU 17 -8.198 9.326 7.526 135 HG2 GLU 17 2HG GLU 17 -10.290 8.131 7.972 136 HG3 GLU 17 3HG GLU 17 -10.440 8.936 9.535 137 H LEU 18 H LEU 18 -6.860 7.378 7.124 138 HA LEU 18 HA LEU 18 -8.443 5.142 6.488 139 HB2 LEU 18 2HB LEU 18 -5.861 6.295 5.428 140 HB3 LEU 18 3HB LEU 18 -6.350 4.699 4.893 141 HG LEU 18 HG LEU 18 -8.392 5.590 3.880 142 HD11 LEU 18 1HD1 LEU 18 -8.918 7.431 5.439 143 HD12 LEU 18 2HD1 LEU 18 -8.954 7.954 3.758 144 HD13 LEU 18 3HD1 LEU 18 -7.576 8.368 4.779 145 HD21 LEU 18 3HD2 LEU 18 -5.939 7.177 3.073 146 HD22 LEU 18 1HD2 LEU 18 -7.379 6.934 2.079 147 HD23 LEU 18 2HD2 LEU 18 -6.372 5.557 2.517 148 H LEU 19 H LEU 19 -5.432 5.461 8.334 149 HA LEU 19 HA LEU 19 -4.687 2.747 8.512 150 HB2 LEU 19 2HB LEU 19 -3.186 4.484 9.350 151 HB3 LEU 19 3HB LEU 19 -4.369 4.980 10.550 152 HG LEU 19 HG LEU 19 -4.108 2.633 11.593 153 HD11 LEU 19 1HD1 LEU 19 -1.624 2.518 9.860 154 HD12 LEU 19 2HD1 LEU 19 -3.061 1.504 9.691 155 HD13 LEU 19 3HD1 LEU 19 -2.076 1.386 11.145 156 HD21 LEU 19 3HD2 LEU 19 -2.113 3.226 12.843 157 HD22 LEU 19 1HD2 LEU 19 -3.165 4.623 12.619 158 HD23 LEU 19 2HD2 LEU 19 -1.700 4.458 11.647 159 H GLU 20 H GLU 20 -6.751 4.737 10.576 160 HA GLU 20 HA GLU 20 -7.414 2.764 12.489 161 HB2 GLU 20 2HB GLU 20 -8.947 5.297 11.749 162 HB3 GLU 20 3HB GLU 20 -9.089 4.392 13.258 163 HG2 GLU 20 2HG GLU 20 -6.799 4.950 13.875 164 HG3 GLU 20 3HG GLU 20 -6.536 5.723 12.308 165 H VAL 21 H VAL 21 -8.866 3.697 9.423 166 HA VAL 21 HA VAL 21 -11.334 2.360 9.548 167 HB VAL 21 HB VAL 21 -9.519 3.004 7.174 168 HG11 VAL 21 1HG1 VAL 21 -11.475 2.619 5.692 169 HG12 VAL 21 2HG1 VAL 21 -12.382 1.984 7.066 170 HG13 VAL 21 3HG1 VAL 21 -10.946 1.136 6.492 171 HG21 VAL 21 3HG2 VAL 21 -10.404 4.959 8.383 172 HG22 VAL 21 1HG2 VAL 21 -12.049 4.359 8.185 173 HG23 VAL 21 2HG2 VAL 21 -11.112 4.851 6.774 174 H VAL 22 H VAL 22 -8.212 1.238 8.179 175 HA VAL 22 HA VAL 22 -9.162 -1.398 7.562 176 HB VAL 22 HB VAL 22 -6.241 -0.516 7.742 177 HG11 VAL 22 1HG1 VAL 22 -5.886 -2.263 6.018 178 HG12 VAL 22 2HG1 VAL 22 -7.596 -2.687 6.087 179 HG13 VAL 22 3HG1 VAL 22 -6.566 -2.946 7.497 180 HG21 VAL 22 3HG2 VAL 22 -7.481 1.087 6.340 181 HG22 VAL 22 1HG2 VAL 22 -8.101 -0.238 5.355 182 HG23 VAL 22 2HG2 VAL 22 -6.371 0.118 5.370 183 H LEU 23 H LEU 23 -7.194 0.005 10.176 184 HA LEU 23 HA LEU 23 -6.284 -2.339 11.418 185 HB2 LEU 23 2HB LEU 23 -5.904 0.402 11.810 186 HB3 LEU 23 3HB LEU 23 -6.761 -0.038 13.272 187 HG LEU 23 HG LEU 23 -4.136 -1.249 12.307 188 HD11 LEU 23 1HD1 LEU 23 -3.839 1.038 13.053 189 HD12 LEU 23 2HD1 LEU 23 -3.120 -0.075 14.214 190 HD13 LEU 23 3HD1 LEU 23 -4.672 0.688 14.571 191 HD21 LEU 23 3HD2 LEU 23 -4.013 -2.366 14.500 192 HD22 LEU 23 1HD2 LEU 23 -5.387 -2.931 13.550 193 HD23 LEU 23 2HD2 LEU 23 -5.641 -1.802 14.883 194 H LYS 24 H LYS 24 -9.244 -0.427 11.970 195 HA LYS 24 HA LYS 24 -10.172 -2.138 14.117 196 HB2 LYS 24 2HB LYS 24 -12.006 -0.702 14.361 197 HB3 LYS 24 3HB LYS 24 -10.707 0.367 13.849 198 HG2 LYS 24 2HG LYS 24 -11.624 0.325 11.533 199 HG3 LYS 24 3HG LYS 24 -12.943 -0.704 12.103 200 HD2 LYS 24 2HD LYS 24 -13.576 1.134 13.723 201 HD3 LYS 24 3HD LYS 24 -12.371 2.167 12.941 202 HE2 LYS 24 2HE LYS 24 -14.800 0.919 11.627 203 HE3 LYS 24 3HE LYS 24 -14.600 2.617 12.050 204 HZ1 LYS 24 3HZ LYS 24 -13.049 1.101 10.035 205 HZ2 LYS 24 1HZ LYS 24 -12.727 2.698 10.486 206 HZ3 LYS 24 2HZ LYS 24 -14.191 2.308 9.730 207 H SER 25 H SER 25 -10.526 -2.020 10.645 208 HA SER 25 HA SER 25 -12.861 -3.622 10.366 209 HB2 SER 25 2HB SER 25 -12.022 -2.179 8.541 210 HB3 SER 25 3HB SER 25 -10.569 -3.166 8.398 211 HG SER 25 HG SER 25 -12.467 -4.885 8.145 212 H ASP 26 H ASP 26 -9.406 -4.331 10.623 213 HA ASP 26 HA ASP 26 -9.885 -6.930 11.695 214 HB2 ASP 26 2HB ASP 26 -10.106 -7.311 9.154 215 HB3 ASP 26 3HB ASP 26 -8.394 -6.926 9.027 216 HA PRO 27 HA PRO 27 -5.974 -5.235 13.331 217 HB2 PRO 27 2HB PRO 27 -5.827 -6.674 15.611 218 HB3 PRO 27 3HB PRO 27 -7.099 -5.455 15.379 219 HG2 PRO 27 2HG PRO 27 -7.283 -8.441 15.070 220 HG3 PRO 27 3HG PRO 27 -8.405 -7.325 15.884 221 HD2 PRO 27 2HD PRO 27 -8.784 -8.256 13.313 222 HD3 PRO 27 3HD PRO 27 -9.433 -6.711 13.908 223 H ASN 28 H ASN 28 -6.424 -8.381 12.095 224 HA ASN 28 HA ASN 28 -3.670 -9.293 12.653 225 HB2 ASN 28 2HB ASN 28 -6.142 -10.690 11.574 226 HB3 ASN 28 3HB ASN 28 -4.548 -11.417 11.413 227 HD21 ASN 28 1HD2 ASN 28 -6.994 -10.389 13.731 228 HD22 ASN 28 2HD2 ASN 28 -6.410 -11.353 15.042 229 H VAL 29 H VAL 29 -5.652 -8.027 10.074 230 HA VAL 29 HA VAL 29 -3.719 -8.305 7.965 231 HB VAL 29 HB VAL 29 -6.006 -6.292 8.318 232 HG11 VAL 29 1HG1 VAL 29 -4.393 -6.902 5.811 233 HG12 VAL 29 2HG1 VAL 29 -4.350 -5.400 6.737 234 HG13 VAL 29 3HG1 VAL 29 -5.823 -5.868 5.887 235 HG21 VAL 29 3HG2 VAL 29 -6.786 -8.621 8.190 236 HG22 VAL 29 1HG2 VAL 29 -5.892 -8.851 6.684 237 HG23 VAL 29 2HG2 VAL 29 -7.250 -7.723 6.744 238 H LYS 30 H LYS 30 -1.710 -7.404 8.164 239 HA LYS 30 HA LYS 30 -1.155 -5.628 10.345 240 HB2 LYS 30 2HB LYS 30 0.698 -6.834 8.262 241 HB3 LYS 30 3HB LYS 30 1.250 -5.848 9.613 242 HG2 LYS 30 2HG LYS 30 -0.134 -8.539 9.773 243 HG3 LYS 30 3HG LYS 30 1.544 -8.182 10.179 244 HD2 LYS 30 2HD LYS 30 -0.904 -7.127 11.672 245 HD3 LYS 30 3HD LYS 30 0.132 -8.442 12.219 246 HE2 LYS 30 2HE LYS 30 1.062 -5.573 11.813 247 HE3 LYS 30 3HE LYS 30 0.603 -6.268 13.365 248 HZ1 LYS 30 3HZ LYS 30 2.839 -7.188 11.648 249 HZ2 LYS 30 1HZ LYS 30 2.409 -7.849 13.140 250 HZ3 LYS 30 2HZ LYS 30 2.988 -6.264 13.054 251 H THR 31 H THR 31 -1.976 -3.676 10.024 252 HA THR 31 HA THR 31 -1.353 -2.013 7.730 253 HB THR 31 HB THR 31 -2.605 -0.288 9.024 254 HG1 THR 31 HG1 THR 31 -2.215 -0.794 11.130 255 HG21 THR 31 3HG2 THR 31 -4.805 -1.426 9.035 256 HG22 THR 31 1HG2 THR 31 -3.993 -2.987 8.880 257 HG23 THR 31 2HG2 THR 31 -3.884 -1.798 7.578 258 H VAL 32 H VAL 32 0.790 -1.483 7.638 259 HA VAL 32 HA VAL 32 2.191 -0.667 10.126 260 HB VAL 32 HB VAL 32 3.431 -1.807 7.572 261 HG11 VAL 32 1HG1 VAL 32 5.488 -2.066 8.927 262 HG12 VAL 32 2HG1 VAL 32 4.681 -1.322 10.310 263 HG13 VAL 32 3HG1 VAL 32 4.982 -0.376 8.851 264 HG21 VAL 32 3HG2 VAL 32 2.874 -3.260 10.191 265 HG22 VAL 32 1HG2 VAL 32 3.772 -3.922 8.822 266 HG23 VAL 32 2HG2 VAL 32 2.058 -3.539 8.652 267 H ARG 33 H ARG 33 2.176 1.500 10.172 268 HA ARG 33 HA ARG 33 2.904 3.154 7.875 269 HB2 ARG 33 2HB ARG 33 2.313 3.756 10.809 270 HB3 ARG 33 3HB ARG 33 2.921 4.982 9.707 271 HG2 ARG 33 2HG ARG 33 0.586 3.692 8.528 272 HG3 ARG 33 3HG ARG 33 0.203 4.241 10.157 273 HD2 ARG 33 2HD ARG 33 -0.303 5.908 8.359 274 HD3 ARG 33 3HD ARG 33 0.785 6.511 9.612 275 HE ARG 33 HE ARG 33 2.200 5.450 7.338 276 HH11 ARG 33 1HH1 ARG 33 0.554 8.346 8.491 277 HH12 ARG 33 2HH1 ARG 33 1.446 9.396 7.444 278 HH21 ARG 33 1HH2 ARG 33 3.346 6.887 5.969 279 HH22 ARG 33 2HH2 ARG 33 2.997 8.585 6.044 280 H THR 34 H THR 34 5.006 3.351 7.340 281 HA THR 34 HA THR 34 7.154 3.216 9.300 282 HB THR 34 HB THR 34 6.900 0.841 8.964 283 HG1 THR 34 HG1 THR 34 9.102 2.016 8.516 284 HG21 THR 34 3HG2 THR 34 7.005 1.298 5.959 285 HG22 THR 34 1HG2 THR 34 5.576 0.810 6.884 286 HG23 THR 34 2HG2 THR 34 6.967 -0.268 6.771 287 H ASP 35 H ASP 35 6.192 3.319 5.890 288 HA ASP 35 HA ASP 35 6.854 4.494 4.090 289 HB2 ASP 35 2HB ASP 35 7.834 6.474 6.181 290 HB3 ASP 35 3HB ASP 35 7.611 6.827 4.473 291 H ASP 36 H ASP 36 8.693 2.563 5.281 292 HA ASP 36 HA ASP 36 11.400 3.604 4.750 293 HB2 ASP 36 2HB ASP 36 10.692 2.492 6.995 294 HB3 ASP 36 3HB ASP 36 10.636 0.972 6.108 295 H LYS 37 H LYS 37 12.829 1.529 4.035 296 HA LYS 37 HA LYS 37 11.667 0.550 1.512 297 HB2 LYS 37 2HB LYS 37 14.084 0.381 0.725 298 HB3 LYS 37 3HB LYS 37 13.458 2.000 0.940 299 HG2 LYS 37 2HG LYS 37 15.244 0.633 2.967 300 HG3 LYS 37 3HG LYS 37 15.852 1.638 1.657 301 HD2 LYS 37 2HD LYS 37 14.028 2.564 3.909 302 HD3 LYS 37 3HD LYS 37 15.756 2.882 3.795 303 HE2 LYS 37 2HE LYS 37 13.553 3.969 2.018 304 HE3 LYS 37 3HE LYS 37 14.562 4.872 3.143 305 HZ1 LYS 37 3HZ LYS 37 15.291 5.210 0.910 306 HZ2 LYS 37 1HZ LYS 37 15.461 3.551 0.656 307 HZ3 LYS 37 2HZ LYS 37 16.471 4.344 1.750 308 H GLU 38 H GLU 38 14.080 -0.394 4.005 309 HA GLU 38 HA GLU 38 14.058 -3.143 3.152 310 HB2 GLU 38 2HB GLU 38 15.603 -3.542 5.045 311 HB3 GLU 38 3HB GLU 38 16.122 -2.192 4.044 312 HG2 GLU 38 2HG GLU 38 15.395 -0.590 5.688 313 HG3 GLU 38 3HG GLU 38 14.616 -1.843 6.649 314 H LYS 39 H LYS 39 12.567 -1.291 5.806 315 HA LYS 39 HA LYS 39 11.853 -3.485 7.414 316 HB2 LYS 39 2HB LYS 39 11.882 -1.271 8.411 317 HB3 LYS 39 3HB LYS 39 10.599 -0.705 7.337 318 HG2 LYS 39 2HG LYS 39 8.975 -2.152 8.394 319 HG3 LYS 39 3HG LYS 39 10.232 -2.994 9.300 320 HD2 LYS 39 2HD LYS 39 10.655 -0.943 10.621 321 HD3 LYS 39 3HD LYS 39 9.401 -0.099 9.701 322 HE2 LYS 39 2HE LYS 39 8.573 -0.906 11.895 323 HE3 LYS 39 3HE LYS 39 7.696 -1.635 10.548 324 HZ1 LYS 39 3HZ LYS 39 8.286 -3.257 12.273 325 HZ2 LYS 39 1HZ LYS 39 9.929 -2.936 12.022 326 HZ3 LYS 39 2HZ LYS 39 9.006 -3.633 10.791 327 H VAL 40 H VAL 40 10.002 -1.748 4.904 328 HA VAL 40 HA VAL 40 7.540 -3.032 5.124 329 HB VAL 40 HB VAL 40 8.901 -2.080 2.554 330 HG11 VAL 40 1HG1 VAL 40 5.951 -2.646 3.074 331 HG12 VAL 40 2HG1 VAL 40 7.019 -3.569 2.015 332 HG13 VAL 40 3HG1 VAL 40 6.605 -1.903 1.612 333 HG21 VAL 40 3HG2 VAL 40 6.978 -0.606 4.397 334 HG22 VAL 40 1HG2 VAL 40 7.629 0.014 2.875 335 HG23 VAL 40 2HG2 VAL 40 8.707 -0.288 4.238 336 H LYS 41 H LYS 41 10.450 -3.993 3.341 337 HA LYS 41 HA LYS 41 9.520 -6.340 2.080 338 HB2 LYS 41 2HB LYS 41 12.348 -5.684 3.014 339 HB3 LYS 41 3HB LYS 41 11.924 -6.907 1.819 340 HG2 LYS 41 2HG LYS 41 11.151 -5.195 0.267 341 HG3 LYS 41 3HG LYS 41 11.419 -3.933 1.475 342 HD2 LYS 41 2HD LYS 41 13.865 -4.495 1.462 343 HD3 LYS 41 3HD LYS 41 13.560 -5.677 0.186 344 HE2 LYS 41 2HE LYS 41 12.815 -3.875 -1.320 345 HE3 LYS 41 3HE LYS 41 13.056 -2.687 -0.037 346 HZ1 LYS 41 3HZ LYS 41 15.146 -4.293 -1.407 347 HZ2 LYS 41 1HZ LYS 41 15.444 -3.349 -0.036 348 HZ3 LYS 41 2HZ LYS 41 14.926 -2.618 -1.464 349 H GLU 42 H GLU 42 11.001 -5.794 5.256 350 HA GLU 42 HA GLU 42 11.256 -8.510 6.078 351 HB2 GLU 42 2HB GLU 42 10.993 -5.999 7.790 352 HB3 GLU 42 3HB GLU 42 11.562 -7.564 8.356 353 HG2 GLU 42 2HG GLU 42 12.932 -5.790 6.330 354 HG3 GLU 42 3HG GLU 42 13.407 -6.001 8.009 355 H GLU 43 H GLU 43 8.688 -6.084 6.408 356 HA GLU 43 HA GLU 43 6.978 -7.635 8.100 357 HB2 GLU 43 2HB GLU 43 6.104 -5.319 6.321 358 HB3 GLU 43 3HB GLU 43 5.293 -5.929 7.753 359 HG2 GLU 43 2HG GLU 43 7.822 -4.303 7.593 360 HG3 GLU 43 3HG GLU 43 6.299 -3.854 8.338 361 H ILE 44 H ILE 44 7.377 -7.279 4.618 362 HA ILE 44 HA ILE 44 5.037 -8.596 3.714 363 HB ILE 44 HB ILE 44 7.758 -8.150 2.404 364 HG12 ILE 44 2HG1 ILE 44 5.018 -6.950 1.755 365 HG13 ILE 44 3HG1 ILE 44 6.277 -6.140 2.679 366 HG21 ILE 44 1HG2 ILE 44 5.355 -9.440 1.070 367 HG22 ILE 44 2HG2 ILE 44 6.893 -10.227 1.428 368 HG23 ILE 44 3HG2 ILE 44 6.826 -8.922 0.246 369 HD11 ILE 44 3HD1 ILE 44 6.225 -5.325 0.403 370 HD12 ILE 44 1HD1 ILE 44 6.449 -6.962 -0.226 371 HD13 ILE 44 2HD1 ILE 44 7.738 -6.181 0.698 372 H GLU 45 H GLU 45 8.275 -9.808 4.606 373 HA GLU 45 HA GLU 45 7.929 -12.546 4.002 374 HB2 GLU 45 2HB GLU 45 10.063 -11.196 4.731 375 HB3 GLU 45 3HB GLU 45 9.573 -11.566 6.370 376 HG2 GLU 45 2HG GLU 45 10.200 -13.632 4.233 377 HG3 GLU 45 3HG GLU 45 11.343 -13.071 5.438 378 H LYS 46 H LYS 46 7.183 -10.661 6.944 379 HA LYS 46 HA LYS 46 6.148 -12.746 8.563 380 HB2 LYS 46 2HB LYS 46 5.385 -9.789 8.601 381 HB3 LYS 46 3HB LYS 46 5.134 -10.938 9.913 382 HG2 LYS 46 2HG LYS 46 7.544 -11.152 10.246 383 HG3 LYS 46 3HG LYS 46 7.853 -10.110 8.851 384 HD2 LYS 46 2HD LYS 46 6.652 -8.247 10.035 385 HD3 LYS 46 3HD LYS 46 6.494 -9.296 11.448 386 HE2 LYS 46 2HE LYS 46 8.954 -9.421 11.627 387 HE3 LYS 46 3HE LYS 46 9.106 -8.379 10.206 388 HZ1 LYS 46 3HZ LYS 46 9.347 -7.135 12.247 389 HZ2 LYS 46 1HZ LYS 46 7.817 -7.620 12.771 390 HZ3 LYS 46 2HZ LYS 46 7.972 -6.624 11.413 391 H ALA 47 H ALA 47 4.663 -10.687 6.120 392 HA ALA 47 HA ALA 47 1.918 -11.174 6.712 393 HB1 ALA 47 3HB ALA 47 2.696 -9.198 5.477 394 HB2 ALA 47 1HB ALA 47 1.484 -10.088 4.555 395 HB3 ALA 47 2HB ALA 47 3.195 -10.219 4.127 396 H ARG 48 H ARG 48 4.115 -12.469 4.245 397 HA ARG 48 HA ARG 48 2.267 -14.270 3.046 398 HB2 ARG 48 2HB ARG 48 4.122 -15.067 1.750 399 HB3 ARG 48 3HB ARG 48 4.437 -13.357 2.009 400 HG2 ARG 48 2HG ARG 48 6.047 -13.913 3.799 401 HG3 ARG 48 3HG ARG 48 5.702 -15.624 3.583 402 HD2 ARG 48 2HD ARG 48 6.530 -15.242 1.129 403 HD3 ARG 48 3HD ARG 48 7.254 -13.763 1.781 404 HE ARG 48 HE ARG 48 7.809 -16.233 3.224 405 HH11 ARG 48 1HH1 ARG 48 9.074 -13.932 0.875 406 HH12 ARG 48 2HH1 ARG 48 10.704 -14.497 1.060 407 HH21 ARG 48 1HH2 ARG 48 9.899 -16.970 3.421 408 HH22 ARG 48 2HH2 ARG 48 11.170 -16.221 2.507 409 H LYS 49 H LYS 49 4.358 -14.404 5.809 410 HA LYS 49 HA LYS 49 4.678 -17.212 6.144 411 HB2 LYS 49 2HB LYS 49 5.994 -15.110 7.101 412 HB3 LYS 49 3HB LYS 49 4.860 -15.216 8.435 413 HG2 LYS 49 2HG LYS 49 5.712 -17.377 9.070 414 HG3 LYS 49 3HG LYS 49 6.627 -17.525 7.559 415 HD2 LYS 49 2HD LYS 49 7.921 -15.432 8.282 416 HD3 LYS 49 3HD LYS 49 7.162 -15.609 9.864 417 HE2 LYS 49 2HE LYS 49 8.257 -17.735 10.218 418 HE3 LYS 49 3HE LYS 49 8.836 -17.767 8.550 419 HZ1 LYS 49 3HZ LYS 49 10.596 -17.104 10.031 420 HZ2 LYS 49 1HZ LYS 49 9.673 -15.827 10.649 421 HZ3 LYS 49 2HZ LYS 49 10.187 -15.798 9.036 422 H GLN 50 H GLN 50 2.643 -14.781 7.734 423 HA GLN 50 HA GLN 50 0.994 -16.579 9.225 424 HB2 GLN 50 2HB GLN 50 0.520 -13.681 8.369 425 HB3 GLN 50 3HB GLN 50 -0.478 -14.554 9.525 426 HG2 GLN 50 2HG GLN 50 2.462 -13.925 9.900 427 HG3 GLN 50 3HG GLN 50 1.125 -13.015 10.605 428 HE21 GLN 50 1HE2 GLN 50 -0.078 -13.963 12.281 429 HE22 GLN 50 2HE2 GLN 50 0.491 -15.325 13.175 430 H GLY 51 H GLY 51 0.936 -15.278 5.983 431 HA2 GLY 51 2HA GLY 51 -0.320 -15.871 4.142 432 HA3 GLY 51 3HA GLY 51 -1.260 -16.970 5.144 433 H ARG 52 H ARG 52 -0.745 -13.578 5.863 434 HA ARG 52 HA ARG 52 -3.643 -13.014 5.525 435 HB2 ARG 52 2HB ARG 52 -1.659 -11.834 7.535 436 HB3 ARG 52 3HB ARG 52 -3.352 -11.370 7.392 437 HG2 ARG 52 2HG ARG 52 -4.072 -13.580 8.110 438 HG3 ARG 52 3HG ARG 52 -2.404 -14.158 8.130 439 HD2 ARG 52 2HD ARG 52 -1.898 -12.466 9.907 440 HD3 ARG 52 3HD ARG 52 -3.616 -12.042 9.945 441 HE ARG 52 HE ARG 52 -3.701 -14.699 10.361 442 HH11 ARG 52 1HH1 ARG 52 -1.753 -12.192 11.905 443 HH12 ARG 52 2HH1 ARG 52 -1.660 -13.056 13.413 444 HH21 ARG 52 1HH2 ARG 52 -3.509 -15.824 12.341 445 HH22 ARG 52 2HH2 ARG 52 -2.642 -15.090 13.651 446 HA PRO 53 HA PRO 53 -2.331 -9.654 2.763 447 HB2 PRO 53 2HB PRO 53 -4.429 -7.872 3.140 448 HB3 PRO 53 3HB PRO 53 -4.528 -9.304 2.099 449 HG2 PRO 53 2HG PRO 53 -5.536 -8.939 4.891 450 HG3 PRO 53 3HG PRO 53 -6.296 -9.775 3.519 451 HD2 PRO 53 2HD PRO 53 -5.026 -11.130 5.511 452 HD3 PRO 53 3HD PRO 53 -5.051 -11.715 3.832 453 H ILE 54 H ILE 54 -1.356 -7.612 2.919 454 HA ILE 54 HA ILE 54 -0.985 -6.480 5.623 455 HB ILE 54 HB ILE 54 0.959 -7.878 5.076 456 HG12 ILE 54 2HG1 ILE 54 1.662 -4.915 4.893 457 HG13 ILE 54 3HG1 ILE 54 1.318 -5.785 6.385 458 HG21 ILE 54 1HG2 ILE 54 1.365 -6.160 2.599 459 HG22 ILE 54 2HG2 ILE 54 0.850 -7.845 2.611 460 HG23 ILE 54 3HG2 ILE 54 2.466 -7.416 3.173 461 HD11 ILE 54 3HD1 ILE 54 3.680 -5.468 6.093 462 HD12 ILE 54 1HD1 ILE 54 3.637 -6.276 4.527 463 HD13 ILE 54 2HD1 ILE 54 3.293 -7.185 6.002 464 H VAL 55 H VAL 55 -1.059 -4.288 5.709 465 HA VAL 55 HA VAL 55 -1.512 -2.815 3.176 466 HB VAL 55 HB VAL 55 -2.736 -2.060 5.875 467 HG11 VAL 55 1HG1 VAL 55 -3.452 -1.275 3.019 468 HG12 VAL 55 2HG1 VAL 55 -2.621 -0.254 4.198 469 HG13 VAL 55 3HG1 VAL 55 -4.294 -0.743 4.479 470 HG21 VAL 55 3HG2 VAL 55 -4.021 -3.738 3.690 471 HG22 VAL 55 1HG2 VAL 55 -4.848 -3.092 5.105 472 HG23 VAL 55 2HG2 VAL 55 -3.571 -4.290 5.300 473 H ILE 56 H ILE 56 0.252 -1.621 2.791 474 HA ILE 56 HA ILE 56 1.889 -0.603 5.038 475 HB ILE 56 HB ILE 56 2.582 -1.025 2.087 476 HG12 ILE 56 2HG1 ILE 56 2.371 -3.132 3.454 477 HG13 ILE 56 3HG1 ILE 56 4.004 -2.868 2.858 478 HG21 ILE 56 1HG2 ILE 56 4.912 -0.473 2.721 479 HG22 ILE 56 2HG2 ILE 56 4.373 -0.048 4.347 480 HG23 ILE 56 3HG2 ILE 56 3.829 0.897 2.959 481 HD11 ILE 56 3HD1 ILE 56 4.045 -3.688 5.135 482 HD12 ILE 56 1HD1 ILE 56 3.034 -2.349 5.675 483 HD13 ILE 56 2HD1 ILE 56 4.670 -2.043 5.088 484 H PHE 57 H PHE 57 1.558 1.476 5.552 485 HA PHE 57 HA PHE 57 0.283 3.327 3.661 486 HB2 PHE 57 2HB PHE 57 0.793 3.475 6.657 487 HB3 PHE 57 3HB PHE 57 0.120 4.812 5.731 488 HD1 PHE 57 HD2 PHE 57 -0.505 1.241 6.687 489 HD2 PHE 57 HD1 PHE 57 -2.210 4.917 5.306 490 HE1 PHE 57 HE2 PHE 57 -2.770 0.317 6.966 491 HE2 PHE 57 HE1 PHE 57 -4.464 3.977 5.610 492 HZ PHE 57 HZ PHE 57 -4.736 1.679 6.404 493 H ILE 58 H ILE 58 1.697 4.247 2.370 494 HA ILE 58 HA ILE 58 4.218 5.456 3.377 495 HB ILE 58 HB ILE 58 3.492 4.825 0.470 496 HG12 ILE 58 2HG1 ILE 58 3.662 2.700 1.863 497 HG13 ILE 58 3HG1 ILE 58 4.804 2.796 0.532 498 HG21 ILE 58 1HG2 ILE 58 5.924 5.105 0.062 499 HG22 ILE 58 2HG2 ILE 58 6.144 5.546 1.755 500 HG23 ILE 58 3HG2 ILE 58 5.171 6.569 0.698 501 HD11 ILE 58 3HD1 ILE 58 6.572 3.431 2.115 502 HD12 ILE 58 1HD1 ILE 58 5.848 1.868 2.491 503 HD13 ILE 58 2HD1 ILE 58 5.414 3.287 3.441 504 H ARG 59 H ARG 59 4.594 7.660 2.825 505 HA ARG 59 HA ARG 59 2.240 9.292 2.210 506 HB2 ARG 59 2HB ARG 59 3.895 9.732 4.110 507 HB3 ARG 59 3HB ARG 59 5.078 10.173 2.887 508 HG2 ARG 59 2HG ARG 59 3.552 12.007 2.138 509 HG3 ARG 59 3HG ARG 59 2.451 11.584 3.453 510 HD2 ARG 59 2HD ARG 59 4.219 12.066 5.111 511 HD3 ARG 59 3HD ARG 59 5.348 12.458 3.810 512 HE ARG 59 HE ARG 59 3.242 14.164 3.409 513 HH11 ARG 59 1HH1 ARG 59 5.368 13.515 6.162 514 HH12 ARG 59 2HH1 ARG 59 5.261 15.137 6.766 515 HH21 ARG 59 1HH2 ARG 59 3.107 16.278 4.240 516 HH22 ARG 59 2HH2 ARG 59 3.982 16.701 5.679 517 H GLY 60 H GLY 60 2.500 11.139 0.620 518 HA2 GLY 60 2HA GLY 60 3.012 10.252 -1.983 519 HA3 GLY 60 3HA GLY 60 2.819 11.930 -1.510 520 H ALA 61 H ALA 61 5.093 12.283 0.091 521 HA ALA 61 HA ALA 61 7.187 12.675 -1.832 522 HB1 ALA 61 3HB ALA 61 7.253 12.927 1.194 523 HB2 ALA 61 1HB ALA 61 6.822 14.201 0.058 524 HB3 ALA 61 2HB ALA 61 8.470 13.565 0.078 525 H TYR 62 H TYR 62 6.619 10.419 0.791 526 HA TYR 62 HA TYR 62 9.101 9.029 0.655 527 HB2 TYR 62 2HB TYR 62 6.476 8.468 2.071 528 HB3 TYR 62 3HB TYR 62 7.764 7.269 2.051 529 HD1 TYR 62 HD2 TYR 62 9.951 7.732 3.150 530 HD2 TYR 62 HD1 TYR 62 6.685 10.477 3.466 531 HE1 TYR 62 HE2 TYR 62 11.047 8.830 5.056 532 HE2 TYR 62 HE1 TYR 62 7.785 11.566 5.368 533 HH TYR 62 HH TYR 62 11.031 10.977 6.218 534 H GLU 63 H GLU 63 6.167 8.809 -1.178 535 HA GLU 63 HA GLU 63 5.982 6.129 -1.827 536 HB2 GLU 63 2HB GLU 63 4.314 7.920 -2.441 537 HB3 GLU 63 3HB GLU 63 5.374 8.398 -3.767 538 HG2 GLU 63 2HG GLU 63 5.191 6.011 -4.630 539 HG3 GLU 63 3HG GLU 63 3.964 5.738 -3.400 540 H GLU 64 H GLU 64 8.216 8.507 -3.054 541 HA GLU 64 HA GLU 64 9.264 7.335 -5.327 542 HB2 GLU 64 2HB GLU 64 9.829 9.593 -4.462 543 HB3 GLU 64 3HB GLU 64 10.730 8.867 -3.141 544 HG2 GLU 64 2HG GLU 64 12.306 9.638 -4.768 545 HG3 GLU 64 3HG GLU 64 12.293 7.877 -4.820 546 H VAL 65 H VAL 65 9.904 6.546 -1.944 547 HA VAL 65 HA VAL 65 12.072 4.757 -2.240 548 HB VAL 65 HB VAL 65 9.992 4.927 -0.001 549 HG11 VAL 65 1HG1 VAL 65 11.034 2.747 0.035 550 HG12 VAL 65 2HG1 VAL 65 11.598 3.725 1.389 551 HG13 VAL 65 3HG1 VAL 65 12.635 3.489 -0.020 552 HG21 VAL 65 3HG2 VAL 65 12.786 6.117 -0.157 553 HG22 VAL 65 1HG2 VAL 65 11.695 6.215 1.230 554 HG23 VAL 65 2HG2 VAL 65 11.277 7.024 -0.282 555 H VAL 66 H VAL 66 8.583 4.275 -2.610 556 HA VAL 66 HA VAL 66 8.298 1.573 -1.997 557 HB VAL 66 HB VAL 66 6.636 3.187 -3.989 558 HG11 VAL 66 1HG1 VAL 66 4.814 1.528 -3.570 559 HG12 VAL 66 2HG1 VAL 66 5.937 0.545 -2.627 560 HG13 VAL 66 3HG1 VAL 66 6.214 0.786 -4.352 561 HG21 VAL 66 3HG2 VAL 66 6.216 2.631 -1.030 562 HG22 VAL 66 1HG2 VAL 66 5.090 3.504 -2.074 563 HG23 VAL 66 2HG2 VAL 66 6.688 4.173 -1.742 564 H ARG 67 H ARG 67 9.492 2.983 -5.016 565 HA ARG 67 HA ARG 67 9.133 0.723 -6.701 566 HB2 ARG 67 2HB ARG 67 9.584 3.068 -7.468 567 HB3 ARG 67 3HB ARG 67 11.257 2.884 -6.972 568 HG2 ARG 67 2HG ARG 67 11.682 1.277 -8.693 569 HG3 ARG 67 3HG ARG 67 9.959 1.078 -9.029 570 HD2 ARG 67 2HD ARG 67 11.085 2.442 -10.757 571 HD3 ARG 67 3HD ARG 67 9.823 3.345 -9.917 572 HE ARG 67 HE ARG 67 12.697 3.636 -9.241 573 HH11 ARG 67 1HH1 ARG 67 9.614 5.159 -10.007 574 HH12 ARG 67 2HH1 ARG 67 10.216 6.767 -9.777 575 HH21 ARG 67 1HH2 ARG 67 13.468 5.752 -8.993 576 HH22 ARG 67 2HH2 ARG 67 12.394 7.102 -9.203 577 H ASP 68 H ASP 68 11.752 1.637 -4.528 578 HA ASP 68 HA ASP 68 13.671 -0.351 -5.120 579 HB2 ASP 68 2HB ASP 68 14.143 1.619 -3.678 580 HB3 ASP 68 3HB ASP 68 13.033 1.017 -2.450 581 H ILE 69 H ILE 69 10.813 -0.343 -3.087 582 HA ILE 69 HA ILE 69 11.155 -2.918 -1.861 583 HB ILE 69 HB ILE 69 8.574 -1.302 -2.083 584 HG12 ILE 69 2HG1 ILE 69 10.667 -1.042 0.134 585 HG13 ILE 69 3HG1 ILE 69 10.520 0.090 -1.208 586 HG21 ILE 69 1HG2 ILE 69 9.483 -3.322 0.013 587 HG22 ILE 69 2HG2 ILE 69 8.278 -3.607 -1.246 588 HG23 ILE 69 3HG2 ILE 69 7.958 -2.430 0.025 589 HD11 ILE 69 3HD1 ILE 69 8.250 0.641 -0.497 590 HD12 ILE 69 1HD1 ILE 69 9.442 0.954 0.763 591 HD13 ILE 69 2HD1 ILE 69 8.411 -0.472 0.864 592 H VAL 70 H VAL 70 9.459 -1.677 -4.709 593 HA VAL 70 HA VAL 70 7.606 -3.661 -5.257 594 HB VAL 70 HB VAL 70 9.132 -1.791 -7.125 595 HG11 VAL 70 1HG1 VAL 70 8.589 -3.753 -8.502 596 HG12 VAL 70 2HG1 VAL 70 7.561 -2.397 -8.959 597 HG13 VAL 70 3HG1 VAL 70 6.910 -3.699 -7.961 598 HG21 VAL 70 3HG2 VAL 70 7.487 -0.747 -5.626 599 HG22 VAL 70 1HG2 VAL 70 6.233 -1.850 -6.193 600 HG23 VAL 70 2HG2 VAL 70 6.921 -0.653 -7.294 601 H GLU 71 H GLU 71 11.048 -3.526 -6.216 602 HA GLU 71 HA GLU 71 11.201 -5.742 -7.873 603 HB2 GLU 71 2HB GLU 71 13.067 -4.124 -7.547 604 HB3 GLU 71 3HB GLU 71 13.367 -4.790 -5.944 605 HG2 GLU 71 2HG GLU 71 13.795 -7.033 -7.076 606 HG3 GLU 71 3HG GLU 71 13.710 -6.182 -8.620 607 H TYR 72 H TYR 72 11.705 -5.603 -4.355 608 HA TYR 72 HA TYR 72 12.244 -8.311 -3.870 609 HB2 TYR 72 2HB TYR 72 12.729 -6.659 -2.162 610 HB3 TYR 72 3HB TYR 72 11.045 -6.163 -2.068 611 HD1 TYR 72 HD1 TYR 72 13.434 -8.899 -1.207 612 HD2 TYR 72 HD2 TYR 72 9.463 -7.398 -0.679 613 HE1 TYR 72 HE1 TYR 72 13.035 -10.544 0.584 614 HE2 TYR 72 HE2 TYR 72 9.082 -9.033 1.103 615 HH TYR 72 HH TYR 72 9.950 -11.235 1.800 616 H ALA 73 H ALA 73 9.142 -6.537 -3.670 617 HA ALA 73 HA ALA 73 7.477 -8.635 -2.891 618 HB1 ALA 73 3HB ALA 73 6.861 -6.261 -2.747 619 HB2 ALA 73 1HB ALA 73 5.628 -7.185 -3.606 620 HB3 ALA 73 2HB ALA 73 6.761 -6.172 -4.506 621 H GLN 74 H GLN 74 8.604 -7.716 -6.108 622 HA GLN 74 HA GLN 74 6.933 -9.487 -7.623 623 HB2 GLN 74 2HB GLN 74 9.654 -8.281 -8.299 624 HB3 GLN 74 3HB GLN 74 8.625 -9.141 -9.444 625 HG2 GLN 74 2HG GLN 74 6.884 -7.420 -9.159 626 HG3 GLN 74 3HG GLN 74 7.935 -6.549 -8.046 627 HE21 GLN 74 1HE2 GLN 74 6.824 -5.686 -10.609 628 HE22 GLN 74 2HE2 GLN 74 8.179 -5.241 -11.580 629 H LYS 75 H LYS 75 10.202 -9.697 -6.232 630 HA LYS 75 HA LYS 75 10.934 -12.248 -7.245 631 HB2 LYS 75 2HB LYS 75 11.956 -10.735 -4.797 632 HB3 LYS 75 3HB LYS 75 12.714 -12.178 -5.457 633 HG2 LYS 75 2HG LYS 75 12.411 -9.543 -6.917 634 HG3 LYS 75 3HG LYS 75 13.871 -10.087 -6.101 635 HD2 LYS 75 2HD LYS 75 12.570 -11.443 -8.490 636 HD3 LYS 75 3HD LYS 75 13.992 -10.402 -8.549 637 HE2 LYS 75 2HE LYS 75 15.245 -12.003 -7.168 638 HE3 LYS 75 3HE LYS 75 13.821 -13.045 -7.060 639 HZ1 LYS 75 3HZ LYS 75 13.901 -13.262 -9.495 640 HZ2 LYS 75 1HZ LYS 75 15.296 -13.857 -8.750 641 HZ3 LYS 75 2HZ LYS 75 15.325 -12.359 -9.524 642 H GLU 76 H GLU 76 9.126 -11.238 -4.423 643 HA GLU 76 HA GLU 76 8.840 -13.683 -3.049 644 HB2 GLU 76 2HB GLU 76 6.841 -11.386 -3.395 645 HB3 GLU 76 3HB GLU 76 6.690 -12.662 -2.198 646 HG2 GLU 76 2HG GLU 76 8.987 -10.700 -2.298 647 HG3 GLU 76 3HG GLU 76 7.533 -10.473 -1.331 648 H GLY 77 H GLY 77 7.069 -12.199 -5.734 649 HA2 GLY 77 2HA GLY 77 5.753 -13.163 -7.388 650 HA3 GLY 77 3HA GLY 77 5.829 -14.714 -6.557 651 H LEU 78 H LEU 78 4.948 -11.633 -5.081 652 HA LEU 78 HA LEU 78 2.312 -12.702 -4.306 653 HB2 LEU 78 2HB LEU 78 3.868 -10.268 -3.340 654 HB3 LEU 78 3HB LEU 78 2.285 -10.733 -2.732 655 HG LEU 78 HG LEU 78 4.825 -12.386 -2.445 656 HD11 LEU 78 1HD1 LEU 78 4.898 -10.365 -1.079 657 HD12 LEU 78 2HD1 LEU 78 4.728 -11.806 -0.077 658 HD13 LEU 78 3HD1 LEU 78 3.327 -10.768 -0.370 659 HD21 LEU 78 3HD2 LEU 78 2.052 -12.885 -1.322 660 HD22 LEU 78 1HD2 LEU 78 3.505 -13.806 -0.920 661 HD23 LEU 78 2HD2 LEU 78 2.870 -13.838 -2.562 662 H ARG 79 H ARG 79 0.444 -11.329 -4.413 663 HA ARG 79 HA ARG 79 0.140 -9.737 -6.794 664 HB2 ARG 79 2HB ARG 79 -1.708 -11.144 -5.943 665 HB3 ARG 79 3HB ARG 79 -1.713 -10.260 -4.422 666 HG2 ARG 79 2HG ARG 79 -3.594 -9.584 -5.819 667 HG3 ARG 79 3HG ARG 79 -2.490 -8.228 -5.587 668 HD2 ARG 79 2HD ARG 79 -1.592 -8.513 -7.831 669 HD3 ARG 79 3HD ARG 79 -2.532 -9.992 -8.065 670 HE ARG 79 HE ARG 79 -4.517 -8.345 -7.648 671 HH11 ARG 79 1HH1 ARG 79 -1.654 -7.703 -9.575 672 HH12 ARG 79 2HH1 ARG 79 -2.467 -6.598 -10.632 673 HH21 ARG 79 1HH2 ARG 79 -5.577 -6.915 -9.063 674 HH22 ARG 79 2HH2 ARG 79 -4.689 -6.144 -10.344 675 H VAL 80 H VAL 80 0.881 -7.677 -6.867 676 HA VAL 80 HA VAL 80 1.130 -6.072 -4.387 677 HB VAL 80 HB VAL 80 2.628 -5.594 -7.023 678 HG11 VAL 80 1HG1 VAL 80 2.435 -3.606 -5.568 679 HG12 VAL 80 2HG1 VAL 80 4.105 -4.167 -5.639 680 HG13 VAL 80 3HG1 VAL 80 3.120 -4.512 -4.215 681 HG21 VAL 80 3HG2 VAL 80 3.643 -7.067 -4.556 682 HG22 VAL 80 1HG2 VAL 80 4.613 -6.631 -5.966 683 HG23 VAL 80 2HG2 VAL 80 3.295 -7.795 -6.125 684 H LEU 81 H LEU 81 -0.269 -4.466 -4.219 685 HA LEU 81 HA LEU 81 -1.649 -3.321 -6.569 686 HB2 LEU 81 2HB LEU 81 -2.953 -5.239 -5.537 687 HB3 LEU 81 3HB LEU 81 -2.972 -4.364 -4.026 688 HG LEU 81 HG LEU 81 -4.267 -2.510 -5.226 689 HD11 LEU 81 1HD1 LEU 81 -3.656 -3.064 -7.511 690 HD12 LEU 81 2HD1 LEU 81 -5.407 -3.120 -7.317 691 HD13 LEU 81 3HD1 LEU 81 -4.477 -4.622 -7.380 692 HD21 LEU 81 3HD2 LEU 81 -5.392 -4.101 -3.732 693 HD22 LEU 81 1HD2 LEU 81 -5.578 -5.248 -5.062 694 HD23 LEU 81 2HD2 LEU 81 -6.425 -3.697 -5.101 695 H VAL 82 H VAL 82 -1.065 -1.192 -6.374 696 HA VAL 82 HA VAL 82 -0.660 -0.020 -3.699 697 HB VAL 82 HB VAL 82 -0.008 1.147 -6.461 698 HG11 VAL 82 1HG1 VAL 82 0.734 2.175 -3.683 699 HG12 VAL 82 2HG1 VAL 82 -0.381 2.943 -4.817 700 HG13 VAL 82 3HG1 VAL 82 1.335 2.832 -5.209 701 HG21 VAL 82 3HG2 VAL 82 1.361 -0.845 -5.947 702 HG22 VAL 82 1HG2 VAL 82 1.843 -0.131 -4.404 703 HG23 VAL 82 2HG2 VAL 82 2.347 0.618 -5.921 704 H ILE 83 H ILE 83 -2.363 0.925 -2.804 705 HA ILE 83 HA ILE 83 -4.596 1.970 -4.428 706 HB ILE 83 HB ILE 83 -4.379 1.550 -1.392 707 HG12 ILE 83 2HG1 ILE 83 -5.808 -0.212 -3.448 708 HG13 ILE 83 3HG1 ILE 83 -4.224 -0.584 -2.777 709 HG21 ILE 83 1HG2 ILE 83 -6.826 2.133 -3.124 710 HG22 ILE 83 2HG2 ILE 83 -6.067 3.259 -1.995 711 HG23 ILE 83 3HG2 ILE 83 -6.851 1.800 -1.391 712 HD11 ILE 83 3HD1 ILE 83 -5.960 -1.853 -1.698 713 HD12 ILE 83 1HD1 ILE 83 -6.793 -0.370 -1.225 714 HD13 ILE 83 2HD1 ILE 83 -5.201 -0.748 -0.554 715 H LYS 84 H LYS 84 -4.472 4.082 -4.863 716 HA LYS 84 HA LYS 84 -2.618 5.830 -3.357 717 HB2 LYS 84 2HB LYS 84 -1.455 4.761 -5.254 718 HB3 LYS 84 3HB LYS 84 -2.757 5.208 -6.349 719 HG2 LYS 84 2HG LYS 84 -2.170 7.611 -5.975 720 HG3 LYS 84 3HG LYS 84 -0.772 7.083 -5.025 721 HD2 LYS 84 2HD LYS 84 0.167 5.935 -6.962 722 HD3 LYS 84 3HD LYS 84 -1.271 6.290 -7.926 723 HE2 LYS 84 2HE LYS 84 0.523 7.802 -8.521 724 HE3 LYS 84 3HE LYS 84 -0.774 8.700 -7.745 725 HZ1 LYS 84 3HZ LYS 84 1.727 7.812 -6.427 726 HZ2 LYS 84 1HZ LYS 84 0.508 8.737 -5.725 727 HZ3 LYS 84 2HZ LYS 84 1.428 9.374 -6.988 728 H VAL 85 H VAL 85 -3.500 7.731 -2.946 729 HA VAL 85 HA VAL 85 -6.013 8.586 -4.146 730 HB VAL 85 HB VAL 85 -4.274 9.920 -2.008 731 HG11 VAL 85 1HG1 VAL 85 -7.110 10.579 -2.887 732 HG12 VAL 85 2HG1 VAL 85 -5.678 11.572 -3.158 733 HG13 VAL 85 3HG1 VAL 85 -6.272 11.312 -1.517 734 HG21 VAL 85 3HG2 VAL 85 -5.938 9.079 -0.375 735 HG22 VAL 85 1HG2 VAL 85 -5.161 7.749 -1.240 736 HG23 VAL 85 2HG2 VAL 85 -6.797 8.247 -1.673 737 H ALA 86 H ALA 86 -5.667 9.278 -6.203 738 HA ALA 86 HA ALA 86 -3.507 11.053 -6.968 739 HB1 ALA 86 3HB ALA 86 -4.384 9.410 -8.574 740 HB2 ALA 86 1HB ALA 86 -4.626 11.051 -9.176 741 HB3 ALA 86 2HB ALA 86 -5.983 10.152 -8.489 742 H GLN 87 H GLN 87 -3.812 13.279 -7.601 743 HA GLN 87 HA GLN 87 -6.253 14.711 -7.186 744 HB2 GLN 87 2HB GLN 87 -5.422 16.075 -5.177 745 HB3 GLN 87 3HB GLN 87 -5.926 14.428 -4.844 746 HG2 GLN 87 2HG GLN 87 -3.513 13.742 -4.845 747 HG3 GLN 87 3HG GLN 87 -3.078 15.439 -5.024 748 HE21 GLN 87 1HE2 GLN 87 -5.729 14.235 -2.980 749 HE22 GLN 87 2HE2 GLN 87 -4.997 14.669 -1.480 750 H ASP 88 H ASP 88 -4.469 14.482 -9.261 751 HA ASP 88 HA ASP 88 -3.428 15.635 -10.888 752 HB2 ASP 88 2HB ASP 88 -5.551 16.872 -10.878 753 HB3 ASP 88 3HB ASP 88 -4.955 17.957 -9.626 754 H GLN 89 H GLN 89 -1.347 15.137 -9.858 755 HA GLN 89 HA GLN 89 0.212 17.583 -9.369 756 HB2 GLN 89 2HB GLN 89 0.213 15.179 -7.500 757 HB3 GLN 89 3HB GLN 89 1.510 16.369 -7.518 758 HG2 GLN 89 2HG GLN 89 -0.106 18.130 -6.893 759 HG3 GLN 89 3HG GLN 89 -1.398 16.925 -6.871 760 HE21 GLN 89 1HE2 GLN 89 -1.425 15.395 -5.192 761 HE22 GLN 89 2HE2 GLN 89 -0.575 15.646 -3.713 762 H GLU 90 H GLU 90 2.137 17.542 -10.315 763 HA GLU 90 HA GLU 90 2.745 15.668 -12.327 764 HB2 GLU 90 2HB GLU 90 4.830 17.046 -12.623 765 HB3 GLU 90 3HB GLU 90 3.344 17.989 -12.604 766 HG2 GLU 90 2HG GLU 90 3.779 18.564 -10.211 767 HG3 GLU 90 3HG GLU 90 5.307 17.695 -10.311 768 H LEU 91 H LEU 91 4.102 16.129 -9.066 769 HA LEU 91 HA LEU 91 6.247 14.249 -9.247 770 HB2 LEU 91 2HB LEU 91 5.870 16.164 -7.572 771 HB3 LEU 91 3HB LEU 91 4.761 15.110 -6.724 772 HG LEU 91 HG LEU 91 7.701 14.402 -7.143 773 HD11 LEU 91 1HD1 LEU 91 7.585 16.527 -5.940 774 HD12 LEU 91 2HD1 LEU 91 8.143 15.236 -4.882 775 HD13 LEU 91 3HD1 LEU 91 6.482 15.824 -4.753 776 HD21 LEU 91 3HD2 LEU 91 5.677 13.332 -5.137 777 HD22 LEU 91 1HD2 LEU 91 7.388 12.898 -5.207 778 HD23 LEU 91 2HD2 LEU 91 6.317 12.470 -6.536 779 H LEU 92 H LEU 92 2.981 14.101 -7.941 780 HA LEU 92 HA LEU 92 2.875 11.457 -7.070 781 HB2 LEU 92 2HB LEU 92 1.284 13.162 -6.404 782 HB3 LEU 92 3HB LEU 92 0.737 13.387 -8.046 783 HG LEU 92 HG LEU 92 0.256 10.721 -6.672 784 HD11 LEU 92 1HD1 LEU 92 -0.579 12.376 -5.070 785 HD12 LEU 92 2HD1 LEU 92 -1.914 11.514 -5.835 786 HD13 LEU 92 3HD1 LEU 92 -1.521 13.164 -6.340 787 HD21 LEU 92 3HD2 LEU 92 -1.285 12.251 -8.804 788 HD22 LEU 92 1HD2 LEU 92 -1.756 10.684 -8.135 789 HD23 LEU 92 2HD2 LEU 92 -0.268 10.835 -9.063 790 H GLU 93 H GLU 93 2.265 12.862 -10.276 791 HA GLU 93 HA GLU 93 1.306 10.443 -11.508 792 HB2 GLU 93 2HB GLU 93 0.770 12.838 -12.213 793 HB3 GLU 93 3HB GLU 93 2.387 12.949 -12.879 794 HG2 GLU 93 2HG GLU 93 0.314 10.929 -13.799 795 HG3 GLU 93 3HG GLU 93 0.530 12.506 -14.538 796 H ARG 94 H ARG 94 4.404 12.122 -11.229 797 HA ARG 94 HA ARG 94 5.884 10.979 -13.267 798 HB2 ARG 94 2HB ARG 94 6.643 12.893 -11.855 799 HB3 ARG 94 3HB ARG 94 6.906 11.782 -10.515 800 HG2 ARG 94 2HG ARG 94 8.604 10.580 -12.006 801 HG3 ARG 94 3HG ARG 94 8.438 11.937 -13.129 802 HD2 ARG 94 2HD ARG 94 10.372 12.296 -11.699 803 HD3 ARG 94 3HD ARG 94 9.131 13.494 -11.311 804 HE ARG 94 HE ARG 94 9.419 11.025 -9.704 805 HH11 ARG 94 1HH1 ARG 94 9.410 14.553 -9.799 806 HH12 ARG 94 2HH1 ARG 94 9.462 14.701 -8.072 807 HH21 ARG 94 1HH2 ARG 94 9.516 11.242 -7.473 808 HH22 ARG 94 2HH2 ARG 94 9.517 12.820 -6.747 809 H PHE 95 H PHE 95 5.629 9.932 -9.888 810 HA PHE 95 HA PHE 95 7.212 7.581 -10.191 811 HB2 PHE 95 2HB PHE 95 6.921 8.811 -8.022 812 HB3 PHE 95 3HB PHE 95 5.244 8.264 -7.956 813 HD1 PHE 95 HD2 PHE 95 8.781 7.134 -7.928 814 HD2 PHE 95 HD1 PHE 95 4.709 6.014 -7.240 815 HE1 PHE 95 HE2 PHE 95 9.517 5.014 -6.941 816 HE2 PHE 95 HE1 PHE 95 5.467 3.887 -6.268 817 HZ PHE 95 HZ PHE 95 7.865 3.390 -6.116 818 H TYR 96 H TYR 96 3.770 8.252 -10.171 819 HA TYR 96 HA TYR 96 2.564 5.769 -9.999 820 HB2 TYR 96 2HB TYR 96 1.225 7.697 -9.832 821 HB3 TYR 96 3HB TYR 96 1.870 8.402 -11.291 822 HD1 TYR 96 HD1 TYR 96 -0.323 5.540 -10.159 823 HD2 TYR 96 HD2 TYR 96 0.582 8.390 -13.231 824 HE1 TYR 96 HE1 TYR 96 -2.355 4.899 -11.375 825 HE2 TYR 96 HE2 TYR 96 -1.442 7.727 -14.435 826 HH TYR 96 HH TYR 96 -2.994 5.833 -14.569 827 H GLU 97 H GLU 97 4.042 7.291 -12.803 828 HA GLU 97 HA GLU 97 2.878 5.667 -14.827 829 HB2 GLU 97 2HB GLU 97 3.743 7.842 -15.396 830 HB3 GLU 97 3HB GLU 97 5.336 7.458 -14.743 831 HG2 GLU 97 2HG GLU 97 5.406 7.494 -17.173 832 HG3 GLU 97 3HG GLU 97 5.718 5.862 -16.594 833 H GLN 98 H GLN 98 5.789 5.412 -12.848 834 HA GLN 98 HA GLN 98 7.127 3.349 -14.190 835 HB2 GLN 98 2HB GLN 98 7.138 4.292 -11.317 836 HB3 GLN 98 3HB GLN 98 8.044 2.847 -11.758 837 HG2 GLN 98 2HG GLN 98 9.634 4.570 -11.838 838 HG3 GLN 98 3HG GLN 98 9.209 4.317 -13.527 839 HE21 GLN 98 1HE2 GLN 98 7.814 5.911 -14.537 840 HE22 GLN 98 2HE2 GLN 98 7.761 7.523 -13.921 841 H LEU 99 H LEU 99 4.427 3.193 -11.916 842 HA LEU 99 HA LEU 99 4.605 0.429 -11.219 843 HB2 LEU 99 2HB LEU 99 2.327 2.441 -11.055 844 HB3 LEU 99 3HB LEU 99 2.126 0.774 -10.541 845 HG LEU 99 HG LEU 99 3.828 1.076 -8.773 846 HD11 LEU 99 1HD1 LEU 99 5.278 2.735 -9.819 847 HD12 LEU 99 2HD1 LEU 99 4.749 3.278 -8.232 848 HD13 LEU 99 3HD1 LEU 99 4.013 3.959 -9.684 849 HD21 LEU 99 3HD2 LEU 99 1.676 3.214 -8.721 850 HD22 LEU 99 1HD2 LEU 99 2.555 2.598 -7.318 851 HD23 LEU 99 2HD2 LEU 99 1.492 1.529 -8.227 852 H LYS 100 H LYS 100 2.671 2.201 -13.593 853 HA LYS 100 HA LYS 100 1.194 -0.089 -14.511 854 HB2 LYS 100 2HB LYS 100 1.420 2.723 -15.676 855 HB3 LYS 100 3HB LYS 100 0.251 1.499 -16.180 856 HG2 LYS 100 2HG LYS 100 -0.674 1.474 -13.860 857 HG3 LYS 100 3HG LYS 100 0.443 2.771 -13.435 858 HD2 LYS 100 2HD LYS 100 -1.769 3.683 -13.852 859 HD3 LYS 100 3HD LYS 100 -0.654 4.253 -15.091 860 HE2 LYS 100 2HE LYS 100 -2.432 1.852 -15.577 861 HE3 LYS 100 3HE LYS 100 -3.032 3.492 -15.805 862 HZ1 LYS 100 3HZ LYS 100 -1.166 3.850 -17.373 863 HZ2 LYS 100 1HZ LYS 100 -2.264 2.672 -17.878 864 HZ3 LYS 100 2HZ LYS 100 -0.774 2.212 -17.240 865 H LYS 101 H LYS 101 3.957 1.779 -15.718 866 HA LYS 101 HA LYS 101 4.198 0.562 -18.270 867 HB2 LYS 101 2HB LYS 101 5.253 2.743 -17.590 868 HB3 LYS 101 3HB LYS 101 6.397 1.852 -16.590 869 HG2 LYS 101 2HG LYS 101 7.288 0.729 -18.600 870 HG3 LYS 101 3HG LYS 101 6.130 1.593 -19.610 871 HD2 LYS 101 2HD LYS 101 8.409 2.811 -18.005 872 HD3 LYS 101 3HD LYS 101 8.329 2.652 -19.760 873 HE2 LYS 101 2HE LYS 101 6.597 4.426 -18.006 874 HE3 LYS 101 3HE LYS 101 7.826 4.948 -19.156 875 HZ1 LYS 101 3HZ LYS 101 5.625 5.221 -20.063 876 HZ2 LYS 101 1HZ LYS 101 5.279 3.583 -19.832 877 HZ3 LYS 101 2HZ LYS 101 6.463 4.050 -20.944 878 H ASP 102 H ASP 102 5.401 -0.238 -15.076 879 HA ASP 102 HA ASP 102 7.144 -2.390 -15.814 880 HB2 ASP 102 2HB ASP 102 7.488 -1.253 -13.708 881 HB3 ASP 102 3HB ASP 102 5.837 -1.553 -13.191 882 H GLY 103 H GLY 103 3.966 -2.379 -14.149 883 HA2 GLY 103 2HA GLY 103 2.332 -4.012 -15.355 884 HA3 GLY 103 3HA GLY 103 3.529 -5.210 -14.869 885 H VAL 104 H VAL 104 3.822 -3.228 -12.387 886 HA VAL 104 HA VAL 104 2.141 -4.624 -10.578 887 HB VAL 104 HB VAL 104 3.732 -2.032 -10.292 888 HG11 VAL 104 1HG1 VAL 104 2.153 -3.432 -8.092 889 HG12 VAL 104 2HG1 VAL 104 1.834 -1.823 -8.744 890 HG13 VAL 104 3HG1 VAL 104 3.315 -2.128 -7.837 891 HG21 VAL 104 3HG2 VAL 104 5.179 -3.445 -8.840 892 HG22 VAL 104 1HG2 VAL 104 5.057 -4.092 -10.476 893 HG23 VAL 104 2HG2 VAL 104 4.140 -4.832 -9.162 894 H ASP 105 H ASP 105 0.093 -4.255 -9.922 895 HA ASP 105 HA ASP 105 -1.582 -2.471 -11.435 896 HB2 ASP 105 2HB ASP 105 -2.074 -4.898 -10.420 897 HB3 ASP 105 3HB ASP 105 -2.564 -3.998 -9.003 898 H VAL 106 H VAL 106 -2.545 -0.598 -10.718 899 HA VAL 106 HA VAL 106 -2.168 0.308 -7.942 900 HB VAL 106 HB VAL 106 -0.351 1.405 -9.089 901 HG11 VAL 106 1HG1 VAL 106 -1.053 1.133 -11.412 902 HG12 VAL 106 2HG1 VAL 106 -0.587 2.803 -11.090 903 HG13 VAL 106 3HG1 VAL 106 -2.294 2.370 -11.201 904 HG21 VAL 106 3HG2 VAL 106 -1.556 2.828 -7.483 905 HG22 VAL 106 1HG2 VAL 106 -2.610 3.417 -8.772 906 HG23 VAL 106 2HG2 VAL 106 -0.887 3.799 -8.796 907 H ARG 107 H ARG 107 -4.136 0.655 -7.179 908 HA ARG 107 HA ARG 107 -6.350 1.497 -8.897 909 HB2 ARG 107 2HB ARG 107 -6.246 0.962 -5.892 910 HB3 ARG 107 3HB ARG 107 -7.704 1.350 -6.794 911 HG2 ARG 107 2HG ARG 107 -6.025 -1.156 -7.100 912 HG3 ARG 107 3HG ARG 107 -7.581 -1.025 -6.286 913 HD2 ARG 107 2HD ARG 107 -8.187 -1.922 -8.349 914 HD3 ARG 107 3HD ARG 107 -8.467 -0.201 -8.611 915 HE ARG 107 HE ARG 107 -6.009 -1.599 -9.498 916 HH11 ARG 107 1HH1 ARG 107 -8.595 0.683 -10.235 917 HH12 ARG 107 2HH1 ARG 107 -7.969 1.029 -11.822 918 HH21 ARG 107 1HH2 ARG 107 -5.276 -1.208 -11.569 919 HH22 ARG 107 2HH2 ARG 107 -6.088 -0.038 -12.583 920 H VAL 108 H VAL 108 -6.072 3.655 -9.473 921 HA VAL 108 HA VAL 108 -5.532 5.663 -7.411 922 HB VAL 108 HB VAL 108 -6.109 7.351 -9.288 923 HG11 VAL 108 1HG1 VAL 108 -3.892 7.119 -10.352 924 HG12 VAL 108 2HG1 VAL 108 -3.754 5.471 -9.733 925 HG13 VAL 108 3HG1 VAL 108 -3.802 6.834 -8.612 926 HG21 VAL 108 3HG2 VAL 108 -5.996 6.543 -11.634 927 HG22 VAL 108 1HG2 VAL 108 -7.389 5.863 -10.789 928 HG23 VAL 108 2HG2 VAL 108 -5.957 4.873 -11.061 929 H THR 109 H THR 109 -7.038 6.015 -6.012 930 HA THR 109 HA THR 109 -9.857 5.612 -6.432 931 HB THR 109 HB THR 109 -8.346 6.932 -4.129 932 HG1 THR 109 HG1 THR 109 -7.957 4.958 -3.502 933 HG21 THR 109 3HG2 THR 109 -11.173 5.825 -4.176 934 HG22 THR 109 1HG2 THR 109 -10.766 7.544 -4.209 935 HG23 THR 109 2HG2 THR 109 -10.347 6.566 -2.810 936 H ASP 110 H ASP 110 -7.611 8.280 -6.252 937 HA ASP 110 HA ASP 110 -7.562 10.397 -6.898 938 HB2 ASP 110 2HB ASP 110 -8.731 9.559 -8.986 939 HB3 ASP 110 3HB ASP 110 -10.261 10.029 -8.266 940 H ASN 111 H ASN 111 -9.481 9.321 -4.544 941 HA ASN 111 HA ASN 111 -9.747 11.980 -3.387 942 HB2 ASN 111 2HB ASN 111 -12.152 10.135 -3.748 943 HB3 ASN 111 3HB ASN 111 -12.108 11.377 -2.495 944 HD21 ASN 111 1HD2 ASN 111 -11.841 13.594 -3.201 945 HD22 ASN 111 2HD2 ASN 111 -12.482 14.087 -4.732 946 H GLU 112 H GLU 112 -10.226 11.869 -1.096 947 HA GLU 112 HA GLU 112 -8.836 9.663 0.230 948 HB2 GLU 112 2HB GLU 112 -9.947 12.225 1.478 949 HB3 GLU 112 3HB GLU 112 -8.822 11.080 2.207 950 HG2 GLU 112 2HG GLU 112 -7.426 12.830 1.585 951 HG3 GLU 112 3HG GLU 112 -7.222 11.685 0.270 952 H ASP 113 H ASP 113 -12.042 11.163 0.088 953 HA ASP 113 HA ASP 113 -13.343 9.884 2.222 954 HB2 ASP 113 2HB ASP 113 -14.528 10.833 -0.434 955 HB3 ASP 113 3HB ASP 113 -15.477 10.444 0.997 956 H GLU 114 H GLU 114 -13.142 8.954 -1.202 957 HA GLU 114 HA GLU 114 -14.561 6.478 -0.839 958 HB2 GLU 114 2HB GLU 114 -14.672 7.688 -2.996 959 HB3 GLU 114 3HB GLU 114 -12.938 7.468 -3.225 960 HG2 GLU 114 2HG GLU 114 -13.285 4.989 -3.262 961 HG3 GLU 114 3HG GLU 114 -15.018 5.251 -3.107 962 H ALA 115 H ALA 115 -11.186 7.476 -0.665 963 HA ALA 115 HA ALA 115 -9.839 5.094 -1.331 964 HB1 ALA 115 3HB ALA 115 -7.933 5.998 -0.086 965 HB2 ALA 115 1HB ALA 115 -8.977 7.200 0.682 966 HB3 ALA 115 2HB ALA 115 -8.697 7.253 -1.060 967 H LYS 116 H LYS 116 -10.875 6.249 1.872 968 HA LYS 116 HA LYS 116 -10.005 4.007 3.339 969 HB2 LYS 116 2HB LYS 116 -11.514 4.877 5.126 970 HB3 LYS 116 3HB LYS 116 -10.423 6.079 4.460 971 HG2 LYS 116 2HG LYS 116 -12.279 6.973 3.074 972 HG3 LYS 116 3HG LYS 116 -13.378 5.821 3.849 973 HD2 LYS 116 2HD LYS 116 -12.897 6.841 6.054 974 HD3 LYS 116 3HD LYS 116 -11.771 7.971 5.294 975 HE2 LYS 116 2HE LYS 116 -13.638 8.944 3.993 976 HE3 LYS 116 3HE LYS 116 -14.760 7.820 4.768 977 HZ1 LYS 116 3HZ LYS 116 -14.807 9.948 5.856 978 HZ2 LYS 116 1HZ LYS 116 -13.138 9.900 6.130 979 HZ3 LYS 116 2HZ LYS 116 -14.158 8.797 6.908 980 H LYS 117 H LYS 117 -13.070 4.715 1.716 981 HA LYS 117 HA LYS 117 -14.579 2.506 2.636 982 HB2 LYS 117 2HB LYS 117 -14.775 4.078 0.036 983 HB3 LYS 117 3HB LYS 117 -15.952 2.867 0.536 984 HG2 LYS 117 2HG LYS 117 -16.506 4.213 2.528 985 HG3 LYS 117 3HG LYS 117 -15.317 5.423 2.038 986 HD2 LYS 117 2HD LYS 117 -17.548 6.183 1.412 987 HD3 LYS 117 3HD LYS 117 -16.618 5.843 -0.044 988 HE2 LYS 117 2HE LYS 117 -18.612 3.878 1.140 989 HE3 LYS 117 3HE LYS 117 -19.051 5.084 -0.062 990 HZ1 LYS 117 3HZ LYS 117 -18.663 3.105 -1.224 991 HZ2 LYS 117 1HZ LYS 117 -17.225 2.767 -0.401 992 HZ3 LYS 117 2HZ LYS 117 -17.289 4.039 -1.511 993 H ARG 118 H ARG 118 -12.455 2.964 -0.128 994 HA ARG 118 HA ARG 118 -12.821 0.600 -1.574 995 HB2 ARG 118 2HB ARG 118 -11.590 2.679 -2.358 996 HB3 ARG 118 3HB ARG 118 -10.264 2.267 -1.278 997 HG2 ARG 118 2HG ARG 118 -9.503 1.501 -3.356 998 HG3 ARG 118 3HG ARG 118 -10.140 0.031 -2.617 999 HD2 ARG 118 2HD ARG 118 -10.847 0.107 -4.928 1000 HD3 ARG 118 3HD ARG 118 -12.268 0.387 -3.917 1001 HE ARG 118 HE ARG 118 -12.016 2.794 -4.414 1002 HH11 ARG 118 1HH1 ARG 118 -10.508 0.537 -6.668 1003 HH12 ARG 118 2HH1 ARG 118 -10.520 1.666 -7.983 1004 HH21 ARG 118 1HH2 ARG 118 -12.019 4.249 -6.147 1005 HH22 ARG 118 2HH2 ARG 118 -11.372 3.764 -7.683 1006 H LEU 119 H LEU 119 -10.530 1.472 0.989 1007 HA LEU 119 HA LEU 119 -8.914 -0.791 1.111 1008 HB2 LEU 119 2HB LEU 119 -9.774 1.097 3.342 1009 HB3 LEU 119 3HB LEU 119 -8.446 -0.047 3.476 1010 HG LEU 119 HG LEU 119 -8.550 2.281 1.525 1011 HD11 LEU 119 1HD1 LEU 119 -6.834 3.330 2.902 1012 HD12 LEU 119 2HD1 LEU 119 -6.892 1.984 4.041 1013 HD13 LEU 119 3HD1 LEU 119 -8.293 3.039 3.850 1014 HD21 LEU 119 3HD2 LEU 119 -7.283 0.409 0.621 1015 HD22 LEU 119 1HD2 LEU 119 -6.317 0.329 2.099 1016 HD23 LEU 119 2HD2 LEU 119 -6.214 1.743 1.045 1017 H LYS 120 H LYS 120 -11.798 -0.036 3.066 1018 HA LYS 120 HA LYS 120 -11.782 -2.435 4.592 1019 HB2 LYS 120 2HB LYS 120 -12.865 -0.113 5.108 1020 HB3 LYS 120 3HB LYS 120 -14.230 -0.671 4.159 1021 HG2 LYS 120 2HG LYS 120 -13.541 -2.697 6.142 1022 HG3 LYS 120 3HG LYS 120 -13.693 -1.133 6.930 1023 HD2 LYS 120 2HD LYS 120 -15.807 -2.360 7.008 1024 HD3 LYS 120 3HD LYS 120 -15.982 -0.892 6.050 1025 HE2 LYS 120 2HE LYS 120 -15.957 -2.157 3.991 1026 HE3 LYS 120 3HE LYS 120 -15.507 -3.637 4.844 1027 HZ1 LYS 120 3HZ LYS 120 -18.085 -2.185 5.098 1028 HZ2 LYS 120 1HZ LYS 120 -17.644 -3.549 5.995 1029 HZ3 LYS 120 2HZ LYS 120 -17.832 -3.668 4.320 1030 H GLU 121 H GLU 121 -13.442 -1.423 1.636 1031 HA GLU 121 HA GLU 121 -15.145 -3.680 1.323 1032 HB2 GLU 121 2HB GLU 121 -14.225 -1.532 -0.614 1033 HB3 GLU 121 3HB GLU 121 -15.280 -2.851 -1.125 1034 HG2 GLU 121 2HG GLU 121 -16.963 -2.189 0.530 1035 HG3 GLU 121 3HG GLU 121 -15.908 -0.908 1.116 1036 H LEU 122 H LEU 122 -11.824 -3.079 0.409 1037 HA LEU 122 HA LEU 122 -11.554 -5.452 -1.205 1038 HB2 LEU 122 2HB LEU 122 -9.486 -3.569 0.001 1039 HB3 LEU 122 3HB LEU 122 -9.071 -4.945 -1.008 1040 HG LEU 122 HG LEU 122 -10.650 -2.486 -1.867 1041 HD11 LEU 122 1HD1 LEU 122 -8.239 -2.121 -1.719 1042 HD12 LEU 122 2HD1 LEU 122 -8.789 -2.064 -3.391 1043 HD13 LEU 122 3HD1 LEU 122 -7.949 -3.495 -2.788 1044 HD21 LEU 122 3HD2 LEU 122 -10.738 -3.445 -4.140 1045 HD22 LEU 122 1HD2 LEU 122 -11.633 -4.433 -2.985 1046 HD23 LEU 122 2HD2 LEU 122 -10.040 -4.950 -3.538 1047 H LEU 123 H LEU 123 -11.101 -4.649 2.226 1048 HA LEU 123 HA LEU 123 -9.930 -7.148 3.008 1049 HB2 LEU 123 2HB LEU 123 -11.052 -4.791 4.477 1050 HB3 LEU 123 3HB LEU 123 -11.069 -6.310 5.352 1051 HG LEU 123 HG LEU 123 -8.564 -6.492 4.947 1052 HD11 LEU 123 1HD1 LEU 123 -7.297 -4.480 4.363 1053 HD12 LEU 123 2HD1 LEU 123 -8.799 -3.622 4.018 1054 HD13 LEU 123 3HD1 LEU 123 -8.326 -5.003 3.028 1055 HD21 LEU 123 3HD2 LEU 123 -7.975 -4.928 6.746 1056 HD22 LEU 123 1HD2 LEU 123 -9.481 -5.776 7.102 1057 HD23 LEU 123 2HD2 LEU 123 -9.520 -4.100 6.548 1058 H GLU 124 H GLU 124 -13.212 -6.208 2.326 1059 HA GLU 124 HA GLU 124 -14.695 -8.193 3.645 1060 HB2 GLU 124 2HB GLU 124 -15.194 -7.056 0.860 1061 HB3 GLU 124 3HB GLU 124 -16.387 -7.911 1.830 1062 HG2 GLU 124 2HG GLU 124 -15.101 -5.294 2.648 1063 HG3 GLU 124 3HG GLU 124 -16.618 -5.407 1.773 1064 H LYS 125 H LYS 125 -12.553 -8.433 0.922 1065 HA LYS 125 HA LYS 125 -13.209 -11.288 0.513 1066 HB2 LYS 125 2HB LYS 125 -14.114 -9.844 -1.314 1067 HB3 LYS 125 3HB LYS 125 -12.493 -9.246 -1.641 1068 HG2 LYS 125 2HG LYS 125 -11.785 -11.537 -2.293 1069 HG3 LYS 125 3HG LYS 125 -13.415 -12.128 -1.960 1070 HD2 LYS 125 2HD LYS 125 -12.667 -10.067 -4.070 1071 HD3 LYS 125 3HD LYS 125 -13.080 -11.755 -4.373 1072 HE2 LYS 125 2HE LYS 125 -15.359 -11.383 -3.571 1073 HE3 LYS 125 3HE LYS 125 -14.964 -9.719 -3.131 1074 HZ1 LYS 125 3HZ LYS 125 -16.127 -9.823 -5.225 1075 HZ2 LYS 125 1HZ LYS 125 -14.949 -10.841 -5.875 1076 HZ3 LYS 125 2HZ LYS 125 -14.557 -9.248 -5.469 1077 H VAL 126 H VAL 126 -10.688 -8.997 -0.690 1078 HA VAL 126 HA VAL 126 -8.518 -10.232 0.672 1079 HB VAL 126 HB VAL 126 -8.921 -12.103 -0.880 1080 HG11 VAL 126 1HG1 VAL 126 -8.484 -10.135 -3.160 1081 HG12 VAL 126 2HG1 VAL 126 -10.009 -10.916 -2.737 1082 HG13 VAL 126 3HG1 VAL 126 -8.662 -11.887 -3.330 1083 HG21 VAL 126 3HG2 VAL 126 -6.662 -12.314 -1.850 1084 HG22 VAL 126 1HG2 VAL 126 -6.594 -11.661 -0.212 1085 HG23 VAL 126 2HG2 VAL 126 -6.382 -10.591 -1.602 1086 H GLY 127 H GLY 127 -9.580 -8.304 -2.118 1087 HA2 GLY 127 2HA GLY 127 -8.808 -6.279 -2.922 1088 HA3 GLY 127 3HA GLY 127 -7.552 -6.273 -1.689 1089 H SER 128 H SER 128 -8.488 -7.507 -4.856 1090 HA SER 128 HA SER 128 -5.710 -7.657 -5.729 1091 HB2 SER 128 2HB SER 128 -6.178 -9.911 -4.747 1092 HB3 SER 128 3HB SER 128 -7.542 -10.097 -5.845 1093 HG SER 128 HG SER 128 -6.200 -10.404 -7.502 1094 H LEU 129 H LEU 129 -8.579 -6.373 -6.350 1095 HA LEU 129 HA LEU 129 -8.226 -6.090 -9.170 1096 HB2 LEU 129 2HB LEU 129 -9.214 -8.416 -9.069 1097 HB3 LEU 129 3HB LEU 129 -10.636 -7.744 -8.298 1098 HG LEU 129 HG LEU 129 -11.177 -6.473 -10.361 1099 HD11 LEU 129 1HD1 LEU 129 -8.929 -6.104 -11.252 1100 HD12 LEU 129 2HD1 LEU 129 -9.952 -6.866 -12.468 1101 HD13 LEU 129 3HD1 LEU 129 -8.756 -7.826 -11.594 1102 HD21 LEU 129 3HD2 LEU 129 -11.839 -8.379 -11.772 1103 HD22 LEU 129 1HD2 LEU 129 -12.140 -8.712 -10.067 1104 HD23 LEU 129 2HD2 LEU 129 -10.749 -9.439 -10.876 1105 H GLU 130 H GLU 130 -9.701 -4.577 -10.115 1106 HA GLU 130 HA GLU 130 -10.921 -2.519 -8.729 1107 HB2 GLU 130 2HB GLU 130 -11.292 -3.712 -11.487 1108 HB3 GLU 130 3HB GLU 130 -12.416 -2.463 -10.967 1109 HG2 GLU 130 2HG GLU 130 -9.436 -2.007 -10.826 1110 HG3 GLU 130 3HG GLU 130 -10.317 -1.788 -12.335 1111 H HIS 131 H HIS 131 -12.925 -2.123 -7.902 1112 HA HIS 131 HA HIS 131 -14.885 -4.329 -7.714 1113 HB2 HIS 131 2HB HIS 131 -14.093 -3.283 -5.586 1114 HB3 HIS 131 3HB HIS 131 -14.704 -1.726 -6.117 1115 HD1 HIS 131 HD1 HIS 131 -16.122 -5.216 -5.517 1116 HD2 HIS 131 HD2 HIS 131 -17.182 -1.216 -5.107 1117 HE1 HIS 131 HE1 HIS 131 -18.413 -5.230 -4.505 1118 HE2 HIS 131 HE2 HIS 131 -19.085 -2.816 -4.395 1119 H HIS 132 H HIS 132 -14.272 -1.854 -9.768 1120 HA HIS 132 HA HIS 132 -17.048 -1.795 -10.725 1121 HB2 HIS 132 2HB HIS 132 -16.904 0.646 -11.260 1122 HB3 HIS 132 3HB HIS 132 -16.852 0.332 -9.530 1123 HD1 HIS 132 HD1 HIS 132 -14.820 1.156 -8.251 1124 HD2 HIS 132 HD2 HIS 132 -14.401 1.564 -12.363 1125 HE1 HIS 132 HE1 HIS 132 -12.751 2.533 -8.591 1126 HE2 HIS 132 HE2 HIS 132 -12.402 2.553 -11.067 1127 H HIS 133 H HIS 133 -17.220 -1.901 -12.923 1128 HA HIS 133 HA HIS 133 -14.908 -2.664 -14.457 1129 HB2 HIS 133 2HB HIS 133 -17.191 -3.687 -14.787 1130 HB3 HIS 133 3HB HIS 133 -17.761 -2.150 -15.425 1131 HD1 HIS 133 HD1 HIS 133 -18.223 -2.838 -17.800 1132 HD2 HIS 133 HD2 HIS 133 -14.410 -3.948 -16.565 1133 HE1 HIS 133 HE1 HIS 133 -17.078 -3.731 -19.853 1134 HE2 HIS 133 HE2 HIS 133 -14.716 -4.170 -19.117 1135 H HIS 134 H HIS 134 -13.510 -1.099 -14.949 1136 HA HIS 134 HA HIS 134 -14.232 1.702 -15.017 1137 HB2 HIS 134 2HB HIS 134 -12.119 0.569 -13.961 1138 HB3 HIS 134 3HB HIS 134 -11.468 0.546 -15.592 1139 HD1 HIS 134 HD1 HIS 134 -10.607 2.184 -12.906 1140 HD2 HIS 134 HD2 HIS 134 -12.244 3.690 -16.417 1141 HE1 HIS 134 HE1 HIS 134 -9.925 4.597 -12.980 1142 HE2 HIS 134 HE2 HIS 134 -11.065 5.524 -15.028 1143 H HIS 135 H HIS 135 -15.543 1.805 -16.906 1144 HA HIS 135 HA HIS 135 -14.537 1.210 -19.546 1145 HB2 HIS 135 2HB HIS 135 -17.017 1.262 -18.899 1146 HB3 HIS 135 3HB HIS 135 -16.910 3.015 -18.817 1147 HD1 HIS 135 HD1 HIS 135 -18.133 0.575 -20.977 1148 HD2 HIS 135 HD2 HIS 135 -15.738 3.910 -21.601 1149 HE1 HIS 135 HE1 HIS 135 -18.364 1.121 -23.422 1150 HE2 HIS 135 HE2 HIS 135 -17.060 3.250 -23.712 1151 H HIS 136 H HIS 136 -15.171 4.169 -17.678 1152 HA HIS 136 HA HIS 136 -12.871 5.560 -18.722 1153 HB2 HIS 136 2HB HIS 136 -14.504 6.004 -20.547 1154 HB3 HIS 136 3HB HIS 136 -15.672 6.613 -19.377 1155 HD1 HIS 136 HD1 HIS 136 -12.287 7.486 -20.851 1156 HD2 HIS 136 HD2 HIS 136 -15.394 9.306 -18.768 1157 HE1 HIS 136 HE1 HIS 136 -11.753 9.939 -20.840 1158 HE2 HIS 136 HE2 HIS 136 -13.548 10.989 -19.442 Start of MODEL 2 1 H1 MET 1 1H MET 1 -3.209 -15.637 1.983 2 H2 MET 1 2H MET 1 -2.660 -14.084 2.348 3 H3 MET 1 3H MET 1 -1.560 -15.285 1.906 4 HA MET 1 HA MET 1 -2.474 -15.409 -0.295 5 HB2 MET 1 2HB MET 1 -4.280 -13.117 0.604 6 HB3 MET 1 3HB MET 1 -4.131 -13.705 -1.050 7 HG2 MET 1 2HG MET 1 -6.154 -14.572 -0.044 8 HG3 MET 1 3HG MET 1 -5.024 -15.889 -0.357 9 HE1 MET 1 3HE MET 1 -6.851 -17.117 2.912 10 HE2 MET 1 1HE MET 1 -6.365 -17.564 1.277 11 HE3 MET 1 2HE MET 1 -7.552 -16.284 1.526 12 H GLY 2 H GLY 2 -1.775 -13.930 -2.012 13 HA2 GLY 2 2HA GLY 2 0.435 -12.224 -1.129 14 HA3 GLY 2 3HA GLY 2 0.117 -12.791 -2.760 15 H THR 3 H THR 3 -1.551 -10.785 -0.322 16 HA THR 3 HA THR 3 -2.066 -8.752 -2.423 17 HB THR 3 HB THR 3 -4.114 -8.147 -1.055 18 HG1 THR 3 HG1 THR 3 -3.540 -9.150 0.911 19 HG21 THR 3 3HG2 THR 3 -4.062 -10.993 -2.133 20 HG22 THR 3 1HG2 THR 3 -4.345 -9.533 -3.088 21 HG23 THR 3 2HG2 THR 3 -5.509 -10.023 -1.855 22 H VAL 4 H VAL 4 -0.585 -7.225 -2.089 23 HA VAL 4 HA VAL 4 -0.035 -6.229 0.660 24 HB VAL 4 HB VAL 4 1.688 -5.862 -1.856 25 HG11 VAL 4 1HG1 VAL 4 1.981 -4.051 -0.217 26 HG12 VAL 4 2HG1 VAL 4 3.434 -5.043 -0.320 27 HG13 VAL 4 3HG1 VAL 4 2.338 -5.231 1.050 28 HG21 VAL 4 3HG2 VAL 4 3.267 -7.500 -0.907 29 HG22 VAL 4 1HG2 VAL 4 1.689 -8.234 -1.209 30 HG23 VAL 4 2HG2 VAL 4 2.160 -7.802 0.436 31 H VAL 5 H VAL 5 -1.193 -4.388 1.008 32 HA VAL 5 HA VAL 5 -1.754 -2.602 -1.306 33 HB VAL 5 HB VAL 5 -3.837 -1.866 -0.159 34 HG11 VAL 5 1HG1 VAL 5 -3.727 -4.866 -0.654 35 HG12 VAL 5 2HG1 VAL 5 -3.955 -3.617 -1.878 36 HG13 VAL 5 3HG1 VAL 5 -5.194 -3.874 -0.650 37 HG21 VAL 5 3HG2 VAL 5 -3.322 -4.130 1.801 38 HG22 VAL 5 1HG2 VAL 5 -4.797 -3.160 1.708 39 HG23 VAL 5 2HG2 VAL 5 -3.270 -2.408 2.176 40 H ILE 6 H ILE 6 -1.221 -0.472 -1.105 41 HA ILE 6 HA ILE 6 0.238 0.336 1.350 42 HB ILE 6 HB ILE 6 1.027 1.054 -1.533 43 HG12 ILE 6 2HG1 ILE 6 3.205 -0.242 -0.885 44 HG13 ILE 6 3HG1 ILE 6 2.250 -0.965 0.400 45 HG21 ILE 6 1HG2 ILE 6 3.027 2.104 -0.518 46 HG22 ILE 6 2HG2 ILE 6 2.418 1.725 1.093 47 HG23 ILE 6 3HG2 ILE 6 1.541 2.860 0.067 48 HD11 ILE 6 3HD1 ILE 6 2.429 -2.417 -1.533 49 HD12 ILE 6 1HD1 ILE 6 1.698 -1.182 -2.557 50 HD13 ILE 6 2HD1 ILE 6 0.755 -1.937 -1.271 51 H VAL 7 H VAL 7 -0.922 1.905 2.266 52 HA VAL 7 HA VAL 7 -2.582 3.777 0.793 53 HB VAL 7 HB VAL 7 -1.908 3.628 3.777 54 HG11 VAL 7 1HG1 VAL 7 -3.868 5.089 4.127 55 HG12 VAL 7 2HG1 VAL 7 -4.076 5.243 2.383 56 HG13 VAL 7 3HG1 VAL 7 -2.631 5.892 3.158 57 HG21 VAL 7 3HG2 VAL 7 -4.370 2.624 2.314 58 HG22 VAL 7 1HG2 VAL 7 -4.108 2.584 4.059 59 HG23 VAL 7 2HG2 VAL 7 -3.085 1.621 2.990 60 H VAL 8 H VAL 8 -1.665 5.467 -0.138 61 HA VAL 8 HA VAL 8 0.494 6.985 1.202 62 HB VAL 8 HB VAL 8 0.152 6.847 -1.821 63 HG11 VAL 8 1HG1 VAL 8 1.385 8.790 -0.971 64 HG12 VAL 8 2HG1 VAL 8 2.426 7.728 -1.919 65 HG13 VAL 8 3HG1 VAL 8 2.524 7.713 -0.156 66 HG21 VAL 8 3HG2 VAL 8 0.639 4.564 -1.095 67 HG22 VAL 8 1HG2 VAL 8 2.049 5.136 -0.204 68 HG23 VAL 8 2HG2 VAL 8 2.011 5.251 -1.963 69 H SER 9 H SER 9 0.195 9.228 1.171 70 HA SER 9 HA SER 9 -1.632 10.662 -0.451 71 HB2 SER 9 2HB SER 9 -3.387 9.605 0.931 72 HB3 SER 9 3HB SER 9 -2.596 10.155 2.408 73 HG SER 9 HG SER 9 -4.415 11.437 1.040 74 H ASN 10 H ASN 10 -1.088 12.763 -0.388 75 HA ASN 10 HA ASN 10 1.187 13.762 0.873 76 HB2 ASN 10 2HB ASN 10 0.323 14.807 -1.127 77 HB3 ASN 10 3HB ASN 10 -1.228 15.146 -0.372 78 HD21 ASN 10 1HD2 ASN 10 -1.392 16.903 1.068 79 HD22 ASN 10 2HD2 ASN 10 -0.211 18.165 1.112 80 H ASP 11 H ASP 11 -2.045 13.493 2.086 81 HA ASP 11 HA ASP 11 -1.521 15.281 4.366 82 HB2 ASP 11 2HB ASP 11 -4.108 14.145 3.240 83 HB3 ASP 11 3HB ASP 11 -4.005 15.159 4.680 84 H GLU 12 H GLU 12 -1.126 14.489 6.289 85 HA GLU 12 HA GLU 12 -0.737 11.748 6.859 86 HB2 GLU 12 2HB GLU 12 -0.230 12.538 9.179 87 HB3 GLU 12 3HB GLU 12 0.628 13.444 7.932 88 HG2 GLU 12 2HG GLU 12 -0.912 15.323 8.148 89 HG3 GLU 12 3HG GLU 12 -1.923 14.411 9.268 90 H ARG 13 H ARG 13 -3.469 13.882 7.466 91 HA ARG 13 HA ARG 13 -4.831 12.324 9.396 92 HB2 ARG 13 2HB ARG 13 -5.966 14.250 7.341 93 HB3 ARG 13 3HB ARG 13 -6.905 13.516 8.639 94 HG2 ARG 13 2HG ARG 13 -5.345 14.630 10.285 95 HG3 ARG 13 3HG ARG 13 -4.626 15.499 8.922 96 HD2 ARG 13 2HD ARG 13 -7.534 15.628 9.818 97 HD3 ARG 13 3HD ARG 13 -6.324 16.893 10.020 98 HE ARG 13 HE ARG 13 -6.333 17.243 7.641 99 HH11 ARG 13 1HH1 ARG 13 -8.976 15.200 8.767 100 HH12 ARG 13 2HH1 ARG 13 -9.945 15.478 7.353 101 HH21 ARG 13 1HH2 ARG 13 -7.607 17.565 5.784 102 HH22 ARG 13 2HH2 ARG 13 -9.170 16.811 5.671 103 H ILE 14 H ILE 14 -4.570 12.020 5.928 104 HA ILE 14 HA ILE 14 -6.734 10.155 5.591 105 HB ILE 14 HB ILE 14 -4.344 10.800 3.799 106 HG12 ILE 14 2HG1 ILE 14 -5.796 12.759 4.148 107 HG13 ILE 14 3HG1 ILE 14 -5.951 12.181 2.495 108 HG21 ILE 14 1HG2 ILE 14 -6.865 9.265 3.069 109 HG22 ILE 14 2HG2 ILE 14 -5.239 8.594 3.205 110 HG23 ILE 14 3HG2 ILE 14 -5.601 9.776 1.947 111 HD11 ILE 14 3HD1 ILE 14 -8.089 12.857 3.405 112 HD12 ILE 14 1HD1 ILE 14 -7.931 11.705 4.729 113 HD13 ILE 14 2HD1 ILE 14 -8.094 11.127 3.067 114 H LEU 15 H LEU 15 -3.210 9.919 6.135 115 HA LEU 15 HA LEU 15 -3.006 7.082 6.049 116 HB2 LEU 15 2HB LEU 15 -1.347 9.112 7.596 117 HB3 LEU 15 3HB LEU 15 -0.930 7.408 7.449 118 HG LEU 15 HG LEU 15 -1.095 9.393 5.146 119 HD11 LEU 15 1HD1 LEU 15 0.851 9.780 6.595 120 HD12 LEU 15 2HD1 LEU 15 1.335 9.162 5.020 121 HD13 LEU 15 3HD1 LEU 15 1.336 8.089 6.422 122 HD21 LEU 15 3HD2 LEU 15 -0.154 7.552 3.770 123 HD22 LEU 15 1HD2 LEU 15 -1.762 7.170 4.392 124 HD23 LEU 15 2HD2 LEU 15 -0.335 6.446 5.136 125 H GLU 16 H GLU 16 -3.911 9.341 8.601 126 HA GLU 16 HA GLU 16 -4.001 7.465 10.755 127 HB2 GLU 16 2HB GLU 16 -3.781 9.947 11.053 128 HB3 GLU 16 3HB GLU 16 -5.422 10.151 10.447 129 HG2 GLU 16 2HG GLU 16 -6.100 8.557 12.404 130 HG3 GLU 16 3HG GLU 16 -4.510 8.933 13.062 131 H GLU 17 H GLU 17 -6.469 8.968 8.687 132 HA GLU 17 HA GLU 17 -8.780 7.865 9.827 133 HB2 GLU 17 2HB GLU 17 -8.801 9.839 8.342 134 HB3 GLU 17 3HB GLU 17 -8.252 8.861 6.989 135 HG2 GLU 17 2HG GLU 17 -10.625 9.369 6.780 136 HG3 GLU 17 3HG GLU 17 -10.382 7.637 6.985 137 H LEU 18 H LEU 18 -6.932 6.898 6.977 138 HA LEU 18 HA LEU 18 -8.525 4.646 6.310 139 HB2 LEU 18 2HB LEU 18 -5.910 5.787 5.336 140 HB3 LEU 18 3HB LEU 18 -6.365 4.171 4.835 141 HG LEU 18 HG LEU 18 -8.436 5.048 3.789 142 HD11 LEU 18 1HD1 LEU 18 -8.849 7.440 3.489 143 HD12 LEU 18 2HD1 LEU 18 -7.491 7.818 4.553 144 HD13 LEU 18 3HD1 LEU 18 -8.906 6.981 5.194 145 HD21 LEU 18 3HD2 LEU 18 -5.954 6.498 2.840 146 HD22 LEU 18 1HD2 LEU 18 -7.405 6.182 1.883 147 HD23 LEU 18 2HD2 LEU 18 -6.406 4.840 2.436 148 H LEU 19 H LEU 19 -5.708 5.087 8.387 149 HA LEU 19 HA LEU 19 -4.899 2.423 8.728 150 HB2 LEU 19 2HB LEU 19 -3.648 4.327 9.711 151 HB3 LEU 19 3HB LEU 19 -4.971 4.628 10.827 152 HG LEU 19 HG LEU 19 -4.566 2.291 11.789 153 HD11 LEU 19 1HD1 LEU 19 -2.005 2.426 10.189 154 HD12 LEU 19 2HD1 LEU 19 -3.350 1.310 9.925 155 HD13 LEU 19 3HD1 LEU 19 -2.416 1.220 11.416 156 HD21 LEU 19 3HD2 LEU 19 -2.685 2.949 13.183 157 HD22 LEU 19 1HD2 LEU 19 -3.812 4.287 12.960 158 HD23 LEU 19 2HD2 LEU 19 -2.286 4.262 12.067 159 H GLU 20 H GLU 20 -7.364 4.308 10.434 160 HA GLU 20 HA GLU 20 -8.103 2.266 12.269 161 HB2 GLU 20 2HB GLU 20 -9.733 4.684 11.391 162 HB3 GLU 20 3HB GLU 20 -9.921 3.771 12.888 163 HG2 GLU 20 2HG GLU 20 -7.505 5.430 12.107 164 HG3 GLU 20 3HG GLU 20 -8.758 5.912 13.250 165 H VAL 21 H VAL 21 -9.295 3.238 9.089 166 HA VAL 21 HA VAL 21 -11.586 1.596 8.930 167 HB VAL 21 HB VAL 21 -9.742 2.553 6.691 168 HG11 VAL 21 1HG1 VAL 21 -12.576 1.463 6.478 169 HG12 VAL 21 2HG1 VAL 21 -11.109 0.686 5.879 170 HG13 VAL 21 3HG1 VAL 21 -11.658 2.199 5.160 171 HG21 VAL 21 3HG2 VAL 21 -11.399 4.355 6.375 172 HG22 VAL 21 1HG2 VAL 21 -10.692 4.405 7.986 173 HG23 VAL 21 2HG2 VAL 21 -12.320 3.763 7.757 174 H VAL 22 H VAL 22 -8.146 0.945 8.317 175 HA VAL 22 HA VAL 22 -8.458 -1.705 7.274 176 HB VAL 22 HB VAL 22 -6.053 -0.232 8.448 177 HG11 VAL 22 1HG1 VAL 22 -4.619 -2.080 7.617 178 HG12 VAL 22 2HG1 VAL 22 -6.062 -3.017 7.223 179 HG13 VAL 22 3HG1 VAL 22 -5.705 -2.612 8.903 180 HG21 VAL 22 3HG2 VAL 22 -5.252 -0.181 6.108 181 HG22 VAL 22 1HG2 VAL 22 -6.832 0.593 6.260 182 HG23 VAL 22 2HG2 VAL 22 -6.708 -1.033 5.585 183 H LEU 23 H LEU 23 -7.609 -0.372 10.472 184 HA LEU 23 HA LEU 23 -7.116 -2.761 11.836 185 HB2 LEU 23 2HB LEU 23 -8.039 -0.047 12.850 186 HB3 LEU 23 3HB LEU 23 -7.522 -1.344 13.902 187 HG LEU 23 HG LEU 23 -5.766 0.086 11.869 188 HD11 LEU 23 1HD1 LEU 23 -6.280 1.483 13.811 189 HD12 LEU 23 2HD1 LEU 23 -4.587 0.999 13.823 190 HD13 LEU 23 3HD1 LEU 23 -5.738 0.205 14.905 191 HD21 LEU 23 3HD2 LEU 23 -5.077 -2.257 12.066 192 HD22 LEU 23 1HD2 LEU 23 -5.011 -2.115 13.827 193 HD23 LEU 23 2HD2 LEU 23 -3.888 -1.199 12.817 194 H LYS 24 H LYS 24 -10.170 -0.967 11.434 195 HA LYS 24 HA LYS 24 -11.667 -2.658 13.257 196 HB2 LYS 24 2HB LYS 24 -13.597 -1.301 12.719 197 HB3 LYS 24 3HB LYS 24 -12.212 -0.236 12.933 198 HG2 LYS 24 2HG LYS 24 -11.984 -0.037 10.469 199 HG3 LYS 24 3HG LYS 24 -13.376 -1.104 10.262 200 HD2 LYS 24 2HD LYS 24 -14.047 1.236 9.977 201 HD3 LYS 24 3HD LYS 24 -14.824 0.546 11.402 202 HE2 LYS 24 2HE LYS 24 -13.228 1.685 12.860 203 HE3 LYS 24 3HE LYS 24 -12.346 2.301 11.459 204 HZ1 LYS 24 3HZ LYS 24 -13.865 3.936 12.462 205 HZ2 LYS 24 1HZ LYS 24 -15.184 2.956 12.069 206 HZ3 LYS 24 2HZ LYS 24 -14.227 3.626 10.844 207 H SER 25 H SER 25 -10.990 -2.633 9.833 208 HA SER 25 HA SER 25 -13.217 -4.303 9.049 209 HB2 SER 25 2HB SER 25 -12.133 -2.634 7.508 210 HB3 SER 25 3HB SER 25 -10.694 -3.650 7.469 211 HG SER 25 HG SER 25 -12.026 -4.100 5.697 212 H ASP 26 H ASP 26 -9.778 -4.722 9.697 213 HA ASP 26 HA ASP 26 -10.103 -7.592 10.092 214 HB2 ASP 26 2HB ASP 26 -9.508 -7.217 7.628 215 HB3 ASP 26 3HB ASP 26 -7.977 -6.535 8.164 216 HA PRO 27 HA PRO 27 -7.344 -5.811 13.306 217 HB2 PRO 27 2HB PRO 27 -7.868 -7.578 15.285 218 HB3 PRO 27 3HB PRO 27 -9.087 -6.405 14.754 219 HG2 PRO 27 2HG PRO 27 -8.843 -9.301 14.004 220 HG3 PRO 27 3HG PRO 27 -10.287 -8.400 14.520 221 HD2 PRO 27 2HD PRO 27 -9.691 -8.894 11.882 222 HD3 PRO 27 3HD PRO 27 -10.624 -7.478 12.421 223 H ASN 28 H ASN 28 -6.979 -8.588 11.479 224 HA ASN 28 HA ASN 28 -4.777 -9.809 12.919 225 HB2 ASN 28 2HB ASN 28 -5.706 -10.357 10.064 226 HB3 ASN 28 3HB ASN 28 -4.652 -11.374 11.041 227 HD21 ASN 28 1HD2 ASN 28 -7.882 -10.320 10.472 228 HD22 ASN 28 2HD2 ASN 28 -8.680 -11.501 11.453 229 H VAL 29 H VAL 29 -5.287 -7.680 10.121 230 HA VAL 29 HA VAL 29 -2.770 -7.687 8.956 231 HB VAL 29 HB VAL 29 -4.573 -5.224 9.217 232 HG11 VAL 29 1HG1 VAL 29 -2.366 -5.842 7.208 233 HG12 VAL 29 2HG1 VAL 29 -2.273 -4.664 8.522 234 HG13 VAL 29 3HG1 VAL 29 -3.405 -4.416 7.197 235 HG21 VAL 29 3HG2 VAL 29 -4.511 -7.318 7.011 236 HG22 VAL 29 1HG2 VAL 29 -5.459 -5.826 6.986 237 HG23 VAL 29 2HG2 VAL 29 -5.809 -7.077 8.179 238 H LYS 30 H LYS 30 -0.855 -7.303 9.843 239 HA LYS 30 HA LYS 30 -0.434 -6.330 12.442 240 HB2 LYS 30 2HB LYS 30 0.991 -7.915 10.928 241 HB3 LYS 30 3HB LYS 30 1.722 -6.457 10.286 242 HG2 LYS 30 2HG LYS 30 1.759 -7.197 13.232 243 HG3 LYS 30 3HG LYS 30 3.012 -7.694 12.099 244 HD2 LYS 30 2HD LYS 30 2.295 -4.814 12.773 245 HD3 LYS 30 3HD LYS 30 3.662 -5.707 13.437 246 HE2 LYS 30 2HE LYS 30 4.645 -5.911 11.183 247 HE3 LYS 30 3HE LYS 30 3.263 -5.050 10.494 248 HZ1 LYS 30 3HZ LYS 30 3.870 -3.092 11.729 249 HZ2 LYS 30 1HZ LYS 30 5.213 -3.612 10.842 250 HZ3 LYS 30 2HZ LYS 30 5.131 -3.906 12.503 251 H THR 31 H THR 31 -0.378 -4.756 9.328 252 HA THR 31 HA THR 31 -0.063 -2.734 8.479 253 HB THR 31 HB THR 31 -0.789 -0.699 9.673 254 HG1 THR 31 HG1 THR 31 -1.152 -2.349 11.963 255 HG21 THR 31 3HG2 THR 31 -3.132 -1.314 10.119 256 HG22 THR 31 1HG2 THR 31 -2.685 -3.021 10.172 257 HG23 THR 31 2HG2 THR 31 -2.544 -2.116 8.663 258 H VAL 32 H VAL 32 1.630 -1.473 7.951 259 HA VAL 32 HA VAL 32 3.851 -1.080 9.883 260 HB VAL 32 HB VAL 32 4.222 -1.651 6.892 261 HG11 VAL 32 1HG1 VAL 32 6.251 -1.591 9.156 262 HG12 VAL 32 2HG1 VAL 32 6.040 -0.346 7.921 263 HG13 VAL 32 3HG1 VAL 32 6.595 -1.957 7.464 264 HG21 VAL 32 3HG2 VAL 32 3.305 -3.669 7.984 265 HG22 VAL 32 1HG2 VAL 32 4.623 -3.632 9.159 266 HG23 VAL 32 2HG2 VAL 32 4.969 -3.911 7.449 267 H ARG 33 H ARG 33 4.212 1.105 10.108 268 HA ARG 33 HA ARG 33 3.687 2.865 7.770 269 HB2 ARG 33 2HB ARG 33 2.163 3.373 9.651 270 HB3 ARG 33 3HB ARG 33 3.537 3.615 10.729 271 HG2 ARG 33 2HG ARG 33 4.254 5.577 9.460 272 HG3 ARG 33 3HG ARG 33 3.020 5.279 8.235 273 HD2 ARG 33 2HD ARG 33 2.457 5.973 11.135 274 HD3 ARG 33 3HD ARG 33 2.415 7.116 9.790 275 HE ARG 33 HE ARG 33 0.690 5.164 9.016 276 HH11 ARG 33 1HH1 ARG 33 0.897 7.137 11.902 277 HH12 ARG 33 2HH1 ARG 33 -0.814 7.118 12.185 278 HH21 ARG 33 1HH2 ARG 33 -1.574 5.177 9.373 279 HH22 ARG 33 2HH2 ARG 33 -2.211 6.009 10.755 280 H THR 34 H THR 34 5.646 2.834 6.849 281 HA THR 34 HA THR 34 7.676 4.543 7.757 282 HB THR 34 HB THR 34 8.269 2.596 9.264 283 HG1 THR 34 HG1 THR 34 9.899 4.035 8.528 284 HG21 THR 34 3HG2 THR 34 7.611 0.720 7.776 285 HG22 THR 34 1HG2 THR 34 9.280 0.564 8.319 286 HG23 THR 34 2HG2 THR 34 8.936 1.128 6.685 287 H ASP 35 H ASP 35 9.240 4.897 6.130 288 HA ASP 35 HA ASP 35 8.676 3.746 3.469 289 HB2 ASP 35 2HB ASP 35 10.026 5.595 2.572 290 HB3 ASP 35 3HB ASP 35 8.765 6.220 3.629 291 H ASP 36 H ASP 36 10.629 3.042 6.058 292 HA ASP 36 HA ASP 36 13.214 2.710 5.047 293 HB2 ASP 36 2HB ASP 36 12.437 2.549 7.491 294 HB3 ASP 36 3HB ASP 36 11.939 0.896 7.152 295 H LYS 37 H LYS 37 13.599 1.681 3.246 296 HA LYS 37 HA LYS 37 11.824 0.067 1.855 297 HB2 LYS 37 2HB LYS 37 13.742 -0.219 0.234 298 HB3 LYS 37 3HB LYS 37 13.365 1.434 0.683 299 HG2 LYS 37 2HG LYS 37 15.268 1.187 2.436 300 HG3 LYS 37 3HG LYS 37 15.750 -0.219 1.491 301 HD2 LYS 37 2HD LYS 37 15.639 2.680 0.589 302 HD3 LYS 37 3HD LYS 37 17.063 1.649 0.728 303 HE2 LYS 37 2HE LYS 37 16.038 0.192 -1.088 304 HE3 LYS 37 3HE LYS 37 14.824 1.456 -1.308 305 HZ1 LYS 37 3HZ LYS 37 16.592 1.703 -2.897 306 HZ2 LYS 37 1HZ LYS 37 17.760 1.758 -1.676 307 HZ3 LYS 37 2HZ LYS 37 16.631 3.002 -1.824 308 H GLU 38 H GLU 38 14.766 -0.915 3.603 309 HA GLU 38 HA GLU 38 14.563 -3.685 2.834 310 HB2 GLU 38 2HB GLU 38 16.494 -4.022 4.341 311 HB3 GLU 38 3HB GLU 38 16.748 -2.647 3.270 312 HG2 GLU 38 2HG GLU 38 16.043 -1.130 5.149 313 HG3 GLU 38 3HG GLU 38 15.985 -2.543 6.197 314 H LYS 39 H LYS 39 13.441 -1.719 5.539 315 HA LYS 39 HA LYS 39 12.784 -3.841 7.307 316 HB2 LYS 39 2HB LYS 39 12.954 -1.580 8.182 317 HB3 LYS 39 3HB LYS 39 11.640 -1.030 7.143 318 HG2 LYS 39 2HG LYS 39 10.052 -2.461 8.343 319 HG3 LYS 39 3HG LYS 39 11.357 -3.107 9.337 320 HD2 LYS 39 2HD LYS 39 11.689 -0.932 10.397 321 HD3 LYS 39 3HD LYS 39 10.504 -0.191 9.310 322 HE2 LYS 39 2HE LYS 39 9.536 -0.657 11.539 323 HE3 LYS 39 3HE LYS 39 8.719 -1.563 10.265 324 HZ1 LYS 39 3HZ LYS 39 9.140 -2.928 12.224 325 HZ2 LYS 39 1HZ LYS 39 10.799 -2.660 12.083 326 HZ3 LYS 39 2HZ LYS 39 9.978 -3.524 10.888 327 H VAL 40 H VAL 40 10.842 -2.039 4.900 328 HA VAL 40 HA VAL 40 8.371 -3.252 5.493 329 HB VAL 40 HB VAL 40 9.281 -1.975 2.866 330 HG11 VAL 40 1HG1 VAL 40 6.852 -1.656 2.403 331 HG12 VAL 40 2HG1 VAL 40 6.463 -2.617 3.832 332 HG13 VAL 40 3HG1 VAL 40 7.303 -3.362 2.470 333 HG21 VAL 40 3HG2 VAL 40 8.137 0.058 3.689 334 HG22 VAL 40 1HG2 VAL 40 9.420 -0.429 4.796 335 HG23 VAL 40 2HG2 VAL 40 7.736 -0.761 5.202 336 H LYS 41 H LYS 41 10.935 -4.164 3.212 337 HA LYS 41 HA LYS 41 9.759 -6.425 2.009 338 HB2 LYS 41 2HB LYS 41 12.679 -5.910 2.711 339 HB3 LYS 41 3HB LYS 41 12.115 -7.168 1.611 340 HG2 LYS 41 2HG LYS 41 11.217 -5.447 0.089 341 HG3 LYS 41 3HG LYS 41 11.778 -4.180 1.189 342 HD2 LYS 41 2HD LYS 41 14.116 -4.902 0.854 343 HD3 LYS 41 3HD LYS 41 13.573 -6.217 -0.196 344 HE2 LYS 41 2HE LYS 41 12.635 -4.505 -1.761 345 HE3 LYS 41 3HE LYS 41 13.328 -3.244 -0.738 346 HZ1 LYS 41 3HZ LYS 41 14.693 -3.832 -2.688 347 HZ2 LYS 41 1HZ LYS 41 14.913 -5.381 -2.058 348 HZ3 LYS 41 2HZ LYS 41 15.519 -4.037 -1.231 349 H GLU 42 H GLU 42 11.566 -6.062 5.016 350 HA GLU 42 HA GLU 42 11.739 -8.822 5.744 351 HB2 GLU 42 2HB GLU 42 13.106 -6.654 6.486 352 HB3 GLU 42 3HB GLU 42 11.881 -6.518 7.727 353 HG2 GLU 42 2HG GLU 42 13.543 -9.023 7.378 354 HG3 GLU 42 3HG GLU 42 14.121 -7.653 8.313 355 H GLU 43 H GLU 43 9.371 -6.272 6.211 356 HA GLU 43 HA GLU 43 7.686 -7.642 8.098 357 HB2 GLU 43 2HB GLU 43 7.099 -5.254 6.292 358 HB3 GLU 43 3HB GLU 43 6.090 -5.783 7.632 359 HG2 GLU 43 2HG GLU 43 8.962 -4.903 8.024 360 HG3 GLU 43 3HG GLU 43 7.626 -3.765 8.014 361 H ILE 44 H ILE 44 7.771 -7.286 4.546 362 HA ILE 44 HA ILE 44 5.378 -8.649 3.884 363 HB ILE 44 HB ILE 44 7.988 -8.341 2.316 364 HG12 ILE 44 2HG1 ILE 44 5.302 -6.921 1.933 365 HG13 ILE 44 3HG1 ILE 44 6.715 -6.215 2.707 366 HG21 ILE 44 1HG2 ILE 44 5.359 -9.438 1.255 367 HG22 ILE 44 2HG2 ILE 44 6.854 -10.349 1.478 368 HG23 ILE 44 3HG2 ILE 44 6.781 -9.060 0.279 369 HD11 ILE 44 3HD1 ILE 44 6.489 -5.418 0.432 370 HD12 ILE 44 1HD1 ILE 44 6.522 -7.073 -0.186 371 HD13 ILE 44 2HD1 ILE 44 7.954 -6.387 0.592 372 H GLU 45 H GLU 45 8.656 -9.786 4.608 373 HA GLU 45 HA GLU 45 8.491 -12.503 3.990 374 HB2 GLU 45 2HB GLU 45 10.496 -11.012 4.847 375 HB3 GLU 45 3HB GLU 45 9.984 -11.505 6.449 376 HG2 GLU 45 2HG GLU 45 10.875 -13.368 4.222 377 HG3 GLU 45 3HG GLU 45 11.874 -12.845 5.568 378 H LYS 46 H LYS 46 7.423 -10.755 6.872 379 HA LYS 46 HA LYS 46 6.573 -13.023 8.389 380 HB2 LYS 46 2HB LYS 46 5.718 -10.105 8.641 381 HB3 LYS 46 3HB LYS 46 5.483 -11.361 9.858 382 HG2 LYS 46 2HG LYS 46 7.962 -11.583 10.059 383 HG3 LYS 46 3HG LYS 46 8.147 -10.259 8.901 384 HD2 LYS 46 2HD LYS 46 6.910 -8.755 10.468 385 HD3 LYS 46 3HD LYS 46 6.796 -10.090 11.622 386 HE2 LYS 46 2HE LYS 46 8.620 -8.588 12.242 387 HE3 LYS 46 3HE LYS 46 9.274 -10.155 11.768 388 HZ1 LYS 46 3HZ LYS 46 10.522 -8.299 10.836 389 HZ2 LYS 46 1HZ LYS 46 9.152 -7.751 10.014 390 HZ3 LYS 46 2HZ LYS 46 9.841 -9.244 9.610 391 H ALA 47 H ALA 47 4.906 -10.694 6.273 392 HA ALA 47 HA ALA 47 2.249 -11.459 6.913 393 HB1 ALA 47 3HB ALA 47 2.848 -9.260 5.997 394 HB2 ALA 47 1HB ALA 47 1.592 -10.043 5.037 395 HB3 ALA 47 2HB ALA 47 3.259 -10.007 4.451 396 H ARG 48 H ARG 48 4.463 -12.504 4.345 397 HA ARG 48 HA ARG 48 2.620 -14.131 2.899 398 HB2 ARG 48 2HB ARG 48 4.546 -15.048 1.735 399 HB3 ARG 48 3HB ARG 48 4.825 -13.327 1.963 400 HG2 ARG 48 2HG ARG 48 6.387 -13.749 3.765 401 HG3 ARG 48 3HG ARG 48 6.013 -15.470 3.754 402 HD2 ARG 48 2HD ARG 48 6.959 -15.591 1.428 403 HD3 ARG 48 3HD ARG 48 7.464 -13.905 1.593 404 HE ARG 48 HE ARG 48 8.662 -14.896 3.720 405 HH11 ARG 48 1HH1 ARG 48 8.510 -16.385 0.521 406 HH12 ARG 48 2HH1 ARG 48 10.018 -17.223 0.714 407 HH21 ARG 48 1HH2 ARG 48 10.616 -16.039 3.949 408 HH22 ARG 48 2HH2 ARG 48 11.204 -17.023 2.656 409 H LYS 49 H LYS 49 4.643 -14.619 5.704 410 HA LYS 49 HA LYS 49 4.730 -17.458 5.752 411 HB2 LYS 49 2HB LYS 49 6.364 -15.868 6.854 412 HB3 LYS 49 3HB LYS 49 5.144 -15.523 8.073 413 HG2 LYS 49 2HG LYS 49 5.171 -17.957 8.700 414 HG3 LYS 49 3HG LYS 49 6.494 -18.201 7.557 415 HD2 LYS 49 2HD LYS 49 6.516 -16.472 10.059 416 HD3 LYS 49 3HD LYS 49 7.413 -17.968 9.801 417 HE2 LYS 49 2HE LYS 49 7.868 -15.316 8.388 418 HE3 LYS 49 3HE LYS 49 8.914 -16.054 9.598 419 HZ1 LYS 49 3HZ LYS 49 9.383 -17.851 8.063 420 HZ2 LYS 49 1HZ LYS 49 9.754 -16.364 7.353 421 HZ3 LYS 49 2HZ LYS 49 8.351 -17.186 6.904 422 H GLN 50 H GLN 50 2.636 -15.048 7.233 423 HA GLN 50 HA GLN 50 1.114 -17.006 8.785 424 HB2 GLN 50 2HB GLN 50 1.683 -14.797 9.768 425 HB3 GLN 50 3HB GLN 50 0.777 -13.982 8.499 426 HG2 GLN 50 2HG GLN 50 -0.518 -14.056 10.571 427 HG3 GLN 50 3HG GLN 50 -1.309 -15.008 9.315 428 HE21 GLN 50 1HE2 GLN 50 -2.458 -16.315 10.740 429 HE22 GLN 50 2HE2 GLN 50 -1.710 -17.459 11.797 430 H GLY 51 H GLY 51 0.627 -14.767 6.053 431 HA2 GLY 51 2HA GLY 51 -0.692 -15.344 4.152 432 HA3 GLY 51 3HA GLY 51 -1.733 -16.331 5.163 433 H ARG 52 H ARG 52 -1.405 -13.780 7.058 434 HA ARG 52 HA ARG 52 -3.894 -12.515 6.368 435 HB2 ARG 52 2HB ARG 52 -3.448 -11.070 8.333 436 HB3 ARG 52 3HB ARG 52 -3.184 -12.766 8.724 437 HG2 ARG 52 2HG ARG 52 -0.737 -12.431 8.482 438 HG3 ARG 52 3HG ARG 52 -1.015 -10.725 8.134 439 HD2 ARG 52 2HD ARG 52 -1.845 -10.336 10.368 440 HD3 ARG 52 3HD ARG 52 -1.854 -12.064 10.728 441 HE ARG 52 HE ARG 52 0.727 -11.656 10.161 442 HH11 ARG 52 1HH1 ARG 52 -1.393 -9.869 12.336 443 HH12 ARG 52 2HH1 ARG 52 -0.105 -9.407 13.403 444 HH21 ARG 52 1HH2 ARG 52 2.386 -11.075 11.569 445 HH22 ARG 52 2HH2 ARG 52 2.050 -10.098 12.962 446 HA PRO 53 HA PRO 53 -2.370 -9.283 3.673 447 HB2 PRO 53 2HB PRO 53 -4.154 -7.216 4.832 448 HB3 PRO 53 3HB PRO 53 -4.243 -8.008 3.248 449 HG2 PRO 53 2HG PRO 53 -6.049 -8.472 5.230 450 HG3 PRO 53 3HG PRO 53 -5.631 -9.679 3.998 451 HD2 PRO 53 2HD PRO 53 -4.710 -9.498 6.854 452 HD3 PRO 53 3HD PRO 53 -5.133 -10.929 5.883 453 H ILE 54 H ILE 54 -1.236 -7.235 3.558 454 HA ILE 54 HA ILE 54 -0.303 -6.077 6.116 455 HB ILE 54 HB ILE 54 1.489 -7.557 5.357 456 HG12 ILE 54 2HG1 ILE 54 2.224 -4.642 4.838 457 HG13 ILE 54 3HG1 ILE 54 2.154 -5.414 6.416 458 HG21 ILE 54 1HG2 ILE 54 0.959 -7.723 2.966 459 HG22 ILE 54 2HG2 ILE 54 2.656 -7.306 3.203 460 HG23 ILE 54 3HG2 ILE 54 1.503 -6.061 2.716 461 HD11 ILE 54 3HD1 ILE 54 4.013 -6.893 5.749 462 HD12 ILE 54 1HD1 ILE 54 4.435 -5.182 5.687 463 HD13 ILE 54 2HD1 ILE 54 4.098 -6.056 4.196 464 H VAL 55 H VAL 55 -0.531 -3.901 6.159 465 HA VAL 55 HA VAL 55 -1.004 -2.470 3.610 466 HB VAL 55 HB VAL 55 -2.273 -1.683 6.274 467 HG11 VAL 55 1HG1 VAL 55 -2.878 -0.822 3.416 468 HG12 VAL 55 2HG1 VAL 55 -2.044 0.147 4.639 469 HG13 VAL 55 3HG1 VAL 55 -3.741 -0.286 4.860 470 HG21 VAL 55 3HG2 VAL 55 -3.172 -3.882 5.604 471 HG22 VAL 55 1HG2 VAL 55 -3.584 -3.243 4.017 472 HG23 VAL 55 2HG2 VAL 55 -4.398 -2.627 5.452 473 H ILE 56 H ILE 56 0.489 -0.962 3.174 474 HA ILE 56 HA ILE 56 2.381 -0.119 5.284 475 HB ILE 56 HB ILE 56 2.649 0.240 2.258 476 HG12 ILE 56 2HG1 ILE 56 2.547 -2.157 2.689 477 HG13 ILE 56 3HG1 ILE 56 4.211 -1.726 2.326 478 HG21 ILE 56 1HG2 ILE 56 5.056 0.573 2.717 479 HG22 ILE 56 2HG2 ILE 56 4.754 0.434 4.451 480 HG23 ILE 56 3HG2 ILE 56 4.069 1.783 3.542 481 HD11 ILE 56 3HD1 ILE 56 4.726 -1.804 4.743 482 HD12 ILE 56 1HD1 ILE 56 4.129 -3.338 4.109 483 HD13 ILE 56 2HD1 ILE 56 3.062 -2.304 5.056 484 H PHE 57 H PHE 57 2.604 2.039 5.851 485 HA PHE 57 HA PHE 57 0.794 4.011 4.566 486 HB2 PHE 57 2HB PHE 57 1.443 3.599 7.513 487 HB3 PHE 57 3HB PHE 57 0.739 5.096 6.910 488 HD1 PHE 57 HD2 PHE 57 0.146 1.438 7.288 489 HD2 PHE 57 HD1 PHE 57 -1.589 5.244 6.390 490 HE1 PHE 57 HE2 PHE 57 -2.104 0.444 7.371 491 HE2 PHE 57 HE1 PHE 57 -3.831 4.244 6.490 492 HZ PHE 57 HZ PHE 57 -4.078 1.854 6.949 493 H ILE 58 H ILE 58 1.833 5.542 3.591 494 HA ILE 58 HA ILE 58 4.220 6.843 4.694 495 HB ILE 58 HB ILE 58 5.221 6.844 2.276 496 HG12 ILE 58 2HG1 ILE 58 3.365 4.433 2.043 497 HG13 ILE 58 3HG1 ILE 58 3.263 5.922 1.108 498 HG21 ILE 58 1HG2 ILE 58 6.291 5.663 4.159 499 HG22 ILE 58 2HG2 ILE 58 6.477 4.768 2.652 500 HG23 ILE 58 3HG2 ILE 58 5.289 4.242 3.847 501 HD11 ILE 58 3HD1 ILE 58 4.231 4.211 -0.228 502 HD12 ILE 58 1HD1 ILE 58 5.454 3.865 0.994 503 HD13 ILE 58 2HD1 ILE 58 5.472 5.409 0.136 504 H ARG 59 H ARG 59 4.496 9.013 3.844 505 HA ARG 59 HA ARG 59 1.940 10.247 3.397 506 HB2 ARG 59 2HB ARG 59 3.756 11.193 4.875 507 HB3 ARG 59 3HB ARG 59 4.654 11.609 3.422 508 HG2 ARG 59 2HG ARG 59 2.808 13.108 2.721 509 HG3 ARG 59 3HG ARG 59 1.928 12.697 4.196 510 HD2 ARG 59 2HD ARG 59 3.779 13.646 5.547 511 HD3 ARG 59 3HD ARG 59 4.632 14.074 4.059 512 HE ARG 59 HE ARG 59 1.945 15.152 4.374 513 HH11 ARG 59 1HH1 ARG 59 5.395 15.790 4.782 514 HH12 ARG 59 2HH1 ARG 59 5.188 17.513 4.814 515 HH21 ARG 59 1HH2 ARG 59 1.696 17.395 4.363 516 HH22 ARG 59 2HH2 ARG 59 3.080 18.423 4.573 517 H GLY 60 H GLY 60 4.914 11.104 1.467 518 HA2 GLY 60 2HA GLY 60 3.346 10.750 -1.010 519 HA3 GLY 60 3HA GLY 60 3.841 12.385 -0.595 520 H ALA 61 H ALA 61 6.243 12.643 -0.168 521 HA ALA 61 HA ALA 61 7.796 11.883 -2.376 522 HB1 ALA 61 3HB ALA 61 8.236 13.875 -0.995 523 HB2 ALA 61 1HB ALA 61 9.683 12.881 -1.163 524 HB3 ALA 61 2HB ALA 61 8.751 12.841 0.337 525 H TYR 62 H TYR 62 7.184 10.264 0.576 526 HA TYR 62 HA TYR 62 9.361 8.464 0.711 527 HB2 TYR 62 2HB TYR 62 6.546 8.162 1.814 528 HB3 TYR 62 3HB TYR 62 7.970 7.283 2.353 529 HD1 TYR 62 HD2 TYR 62 9.901 8.683 3.407 530 HD2 TYR 62 HD1 TYR 62 5.969 10.230 2.841 531 HE1 TYR 62 HE2 TYR 62 10.338 10.417 5.092 532 HE2 TYR 62 HE1 TYR 62 6.406 11.962 4.525 533 HH TYR 62 HH TYR 62 7.902 12.300 6.481 534 H GLU 63 H GLU 63 6.346 8.454 -1.111 535 HA GLU 63 HA GLU 63 6.039 5.716 -1.628 536 HB2 GLU 63 2HB GLU 63 4.361 7.600 -2.104 537 HB3 GLU 63 3HB GLU 63 5.238 7.884 -3.605 538 HG2 GLU 63 2HG GLU 63 4.806 5.361 -4.108 539 HG3 GLU 63 3HG GLU 63 3.639 5.432 -2.789 540 H GLU 64 H GLU 64 8.196 8.055 -3.027 541 HA GLU 64 HA GLU 64 8.884 6.995 -5.489 542 HB2 GLU 64 2HB GLU 64 9.602 9.184 -4.537 543 HB3 GLU 64 3HB GLU 64 10.689 8.343 -3.439 544 HG2 GLU 64 2HG GLU 64 11.944 9.296 -5.284 545 HG3 GLU 64 3HG GLU 64 12.007 7.536 -5.362 546 H VAL 65 H VAL 65 9.798 5.893 -2.316 547 HA VAL 65 HA VAL 65 12.038 4.261 -3.061 548 HB VAL 65 HB VAL 65 10.523 4.241 -0.422 549 HG11 VAL 65 1HG1 VAL 65 12.123 2.422 -0.642 550 HG12 VAL 65 2HG1 VAL 65 12.677 3.587 0.560 551 HG13 VAL 65 3HG1 VAL 65 13.406 3.567 -1.049 552 HG21 VAL 65 3HG2 VAL 65 12.052 6.008 0.390 553 HG22 VAL 65 1HG2 VAL 65 11.081 6.581 -0.970 554 HG23 VAL 65 2HG2 VAL 65 12.771 6.136 -1.218 555 H VAL 66 H VAL 66 8.584 3.715 -2.850 556 HA VAL 66 HA VAL 66 8.362 1.027 -2.173 557 HB VAL 66 HB VAL 66 6.578 2.633 -4.058 558 HG11 VAL 66 1HG1 VAL 66 4.779 0.986 -3.583 559 HG12 VAL 66 2HG1 VAL 66 5.928 -0.015 -2.692 560 HG13 VAL 66 3HG1 VAL 66 6.139 0.234 -4.424 561 HG21 VAL 66 3HG2 VAL 66 5.149 2.937 -2.068 562 HG22 VAL 66 1HG2 VAL 66 6.769 3.585 -1.806 563 HG23 VAL 66 2HG2 VAL 66 6.312 2.036 -1.091 564 H ARG 67 H ARG 67 9.285 2.384 -5.296 565 HA ARG 67 HA ARG 67 8.992 0.164 -6.988 566 HB2 ARG 67 2HB ARG 67 9.521 2.354 -7.863 567 HB3 ARG 67 3HB ARG 67 11.040 2.407 -6.980 568 HG2 ARG 67 2HG ARG 67 11.899 0.544 -8.431 569 HG3 ARG 67 3HG ARG 67 10.388 0.615 -9.348 570 HD2 ARG 67 2HD ARG 67 12.285 1.872 -10.411 571 HD3 ARG 67 3HD ARG 67 10.857 2.863 -10.097 572 HE ARG 67 HE ARG 67 13.366 2.902 -8.498 573 HH11 ARG 67 1HH1 ARG 67 10.454 4.521 -9.628 574 HH12 ARG 67 2HH1 ARG 67 10.858 6.030 -8.881 575 HH21 ARG 67 1HH2 ARG 67 13.818 4.868 -7.423 576 HH22 ARG 67 2HH2 ARG 67 12.760 6.231 -7.631 577 H ASP 68 H ASP 68 11.583 0.915 -4.708 578 HA ASP 68 HA ASP 68 13.313 -1.271 -5.379 579 HB2 ASP 68 2HB ASP 68 13.097 0.265 -2.751 580 HB3 ASP 68 3HB ASP 68 14.454 -0.736 -3.255 581 H ILE 69 H ILE 69 10.780 -0.711 -3.001 582 HA ILE 69 HA ILE 69 11.126 -3.021 -1.407 583 HB ILE 69 HB ILE 69 8.657 -1.261 -1.761 584 HG12 ILE 69 2HG1 ILE 69 10.890 -1.060 0.324 585 HG13 ILE 69 3HG1 ILE 69 10.701 0.008 -1.062 586 HG21 ILE 69 1HG2 ILE 69 8.081 -3.408 -0.706 587 HG22 ILE 69 2HG2 ILE 69 7.947 -2.085 0.451 588 HG23 ILE 69 3HG2 ILE 69 9.341 -3.164 0.509 589 HD11 ILE 69 3HD1 ILE 69 9.907 1.070 0.953 590 HD12 ILE 69 1HD1 ILE 69 8.775 -0.253 1.247 591 HD13 ILE 69 2HD1 ILE 69 8.566 0.795 -0.158 592 H VAL 70 H VAL 70 9.135 -2.329 -4.223 593 HA VAL 70 HA VAL 70 7.297 -4.467 -3.938 594 HB VAL 70 HB VAL 70 6.799 -2.352 -5.172 595 HG11 VAL 70 1HG1 VAL 70 7.495 -2.029 -7.497 596 HG12 VAL 70 2HG1 VAL 70 8.504 -3.475 -7.410 597 HG13 VAL 70 3HG1 VAL 70 8.896 -2.068 -6.421 598 HG21 VAL 70 3HG2 VAL 70 5.419 -3.365 -6.904 599 HG22 VAL 70 1HG2 VAL 70 5.410 -4.367 -5.455 600 HG23 VAL 70 2HG2 VAL 70 6.384 -4.843 -6.846 601 H GLU 71 H GLU 71 10.413 -4.135 -5.521 602 HA GLU 71 HA GLU 71 10.396 -6.284 -7.307 603 HB2 GLU 71 2HB GLU 71 12.130 -4.519 -7.254 604 HB3 GLU 71 3HB GLU 71 12.741 -5.140 -5.722 605 HG2 GLU 71 2HG GLU 71 13.322 -7.281 -6.863 606 HG3 GLU 71 3HG GLU 71 12.771 -6.597 -8.390 607 H TYR 72 H TYR 72 10.828 -6.198 -3.838 608 HA TYR 72 HA TYR 72 11.772 -8.882 -3.447 609 HB2 TYR 72 2HB TYR 72 12.058 -7.125 -1.734 610 HB3 TYR 72 3HB TYR 72 10.319 -6.994 -1.543 611 HD1 TYR 72 HD2 TYR 72 9.055 -8.777 -0.330 612 HD2 TYR 72 HD1 TYR 72 13.306 -8.962 -0.685 613 HE1 TYR 72 HE2 TYR 72 9.133 -10.434 1.474 614 HE2 TYR 72 HE1 TYR 72 13.383 -10.618 1.126 615 HH TYR 72 HH TYR 72 11.887 -11.237 3.121 616 H ALA 73 H ALA 73 8.573 -7.333 -3.227 617 HA ALA 73 HA ALA 73 7.072 -9.674 -2.673 618 HB1 ALA 73 3HB ALA 73 6.232 -7.434 -2.169 619 HB2 ALA 73 1HB ALA 73 5.107 -8.297 -3.219 620 HB3 ALA 73 2HB ALA 73 6.164 -7.050 -3.892 621 H GLN 74 H GLN 74 8.252 -8.243 -5.650 622 HA GLN 74 HA GLN 74 6.692 -9.774 -7.492 623 HB2 GLN 74 2HB GLN 74 9.361 -8.340 -7.843 624 HB3 GLN 74 3HB GLN 74 8.477 -9.101 -9.165 625 HG2 GLN 74 2HG GLN 74 6.600 -7.548 -8.828 626 HG3 GLN 74 3HG GLN 74 7.448 -6.797 -7.476 627 HE21 GLN 74 1HE2 GLN 74 6.524 -5.575 -9.977 628 HE22 GLN 74 2HE2 GLN 74 7.918 -4.896 -10.731 629 H LYS 75 H LYS 75 9.916 -10.221 -6.002 630 HA LYS 75 HA LYS 75 10.600 -12.720 -7.109 631 HB2 LYS 75 2HB LYS 75 11.156 -11.597 -4.322 632 HB3 LYS 75 3HB LYS 75 11.845 -13.109 -4.896 633 HG2 LYS 75 2HG LYS 75 12.333 -10.381 -6.121 634 HG3 LYS 75 3HG LYS 75 13.439 -11.246 -5.049 635 HD2 LYS 75 2HD LYS 75 13.560 -13.096 -6.743 636 HD3 LYS 75 3HD LYS 75 12.547 -12.133 -7.821 637 HE2 LYS 75 2HE LYS 75 14.295 -10.365 -7.845 638 HE3 LYS 75 3HE LYS 75 15.305 -11.373 -6.803 639 HZ1 LYS 75 3HZ LYS 75 15.280 -13.074 -8.566 640 HZ2 LYS 75 1HZ LYS 75 15.977 -11.621 -9.077 641 HZ3 LYS 75 2HZ LYS 75 14.412 -12.020 -9.560 642 H GLU 76 H GLU 76 8.624 -11.851 -4.330 643 HA GLU 76 HA GLU 76 7.946 -14.525 -3.555 644 HB2 GLU 76 2HB GLU 76 6.860 -11.803 -2.709 645 HB3 GLU 76 3HB GLU 76 6.347 -13.330 -1.993 646 HG2 GLU 76 2HG GLU 76 9.107 -12.101 -1.892 647 HG3 GLU 76 3HG GLU 76 7.983 -12.314 -0.549 648 H GLY 77 H GLY 77 6.787 -12.483 -6.017 649 HA2 GLY 77 2HA GLY 77 5.213 -12.849 -7.642 650 HA3 GLY 77 3HA GLY 77 4.821 -14.375 -6.876 651 H LEU 78 H LEU 78 4.622 -11.792 -4.707 652 HA LEU 78 HA LEU 78 1.778 -12.018 -4.399 653 HB2 LEU 78 2HB LEU 78 3.508 -9.845 -3.147 654 HB3 LEU 78 3HB LEU 78 2.009 -10.528 -2.537 655 HG LEU 78 HG LEU 78 4.747 -11.835 -2.559 656 HD11 LEU 78 1HD1 LEU 78 2.986 -10.985 -0.251 657 HD12 LEU 78 2HD1 LEU 78 4.460 -10.182 -0.800 658 HD13 LEU 78 3HD1 LEU 78 4.544 -11.806 -0.122 659 HD21 LEU 78 3HD2 LEU 78 2.154 -13.089 -1.630 660 HD22 LEU 78 1HD2 LEU 78 3.770 -13.774 -1.438 661 HD23 LEU 78 2HD2 LEU 78 3.089 -13.563 -3.047 662 H ARG 79 H ARG 79 0.175 -10.627 -5.190 663 HA ARG 79 HA ARG 79 0.832 -8.550 -7.047 664 HB2 ARG 79 2HB ARG 79 -1.397 -8.485 -7.579 665 HB3 ARG 79 3HB ARG 79 -1.475 -9.985 -6.676 666 HG2 ARG 79 2HG ARG 79 -2.395 -8.863 -4.738 667 HG3 ARG 79 3HG ARG 79 -2.107 -7.272 -5.448 668 HD2 ARG 79 2HD ARG 79 -3.696 -7.921 -7.310 669 HD3 ARG 79 3HD ARG 79 -4.082 -9.375 -6.387 670 HE ARG 79 HE ARG 79 -4.922 -7.855 -4.603 671 HH11 ARG 79 1HH1 ARG 79 -4.708 -6.617 -7.902 672 HH12 ARG 79 2HH1 ARG 79 -5.953 -5.432 -7.660 673 HH21 ARG 79 1HH2 ARG 79 -6.588 -6.303 -4.336 674 HH22 ARG 79 2HH2 ARG 79 -7.016 -5.252 -5.654 675 H VAL 80 H VAL 80 0.957 -6.398 -6.712 676 HA VAL 80 HA VAL 80 0.830 -5.372 -3.943 677 HB VAL 80 HB VAL 80 2.867 -4.677 -6.125 678 HG11 VAL 80 1HG1 VAL 80 2.587 -3.457 -3.351 679 HG12 VAL 80 2HG1 VAL 80 2.242 -2.638 -4.875 680 HG13 VAL 80 3HG1 VAL 80 3.892 -3.134 -4.496 681 HG21 VAL 80 3HG2 VAL 80 3.219 -5.983 -3.399 682 HG22 VAL 80 1HG2 VAL 80 4.519 -5.578 -4.524 683 HG23 VAL 80 2HG2 VAL 80 3.323 -6.798 -4.962 684 H LEU 81 H LEU 81 -0.207 -3.503 -3.708 685 HA LEU 81 HA LEU 81 -1.570 -2.276 -5.998 686 HB2 LEU 81 2HB LEU 81 -2.969 -4.126 -5.089 687 HB3 LEU 81 3HB LEU 81 -2.840 -3.437 -3.485 688 HG LEU 81 HG LEU 81 -4.139 -1.444 -4.256 689 HD11 LEU 81 1HD1 LEU 81 -4.417 -2.999 -6.817 690 HD12 LEU 81 2HD1 LEU 81 -3.578 -1.461 -6.593 691 HD13 LEU 81 3HD1 LEU 81 -5.324 -1.545 -6.392 692 HD21 LEU 81 3HD2 LEU 81 -6.317 -2.561 -4.378 693 HD22 LEU 81 1HD2 LEU 81 -5.287 -3.311 -3.159 694 HD23 LEU 81 2HD2 LEU 81 -5.518 -4.098 -4.720 695 H VAL 82 H VAL 82 -0.775 -0.229 -5.767 696 HA VAL 82 HA VAL 82 -0.493 0.916 -3.057 697 HB VAL 82 HB VAL 82 0.479 2.034 -5.740 698 HG11 VAL 82 1HG1 VAL 82 0.080 3.812 -4.091 699 HG12 VAL 82 2HG1 VAL 82 1.809 3.616 -4.384 700 HG13 VAL 82 3HG1 VAL 82 1.086 2.966 -2.909 701 HG21 VAL 82 3HG2 VAL 82 2.747 1.355 -5.026 702 HG22 VAL 82 1HG2 VAL 82 1.677 -0.045 -5.166 703 HG23 VAL 82 2HG2 VAL 82 2.074 0.607 -3.574 704 H ILE 83 H ILE 83 -2.310 1.839 -2.366 705 HA ILE 83 HA ILE 83 -4.173 3.169 -4.217 706 HB ILE 83 HB ILE 83 -4.486 2.273 -1.311 707 HG12 ILE 83 2HG1 ILE 83 -5.780 1.247 -3.881 708 HG13 ILE 83 3HG1 ILE 83 -4.465 0.453 -3.022 709 HG21 ILE 83 1HG2 ILE 83 -5.808 4.328 -1.674 710 HG22 ILE 83 2HG2 ILE 83 -6.867 2.931 -1.484 711 HG23 ILE 83 3HG2 ILE 83 -6.569 3.599 -3.091 712 HD11 ILE 83 3HD1 ILE 83 -5.923 0.093 -1.108 713 HD12 ILE 83 1HD1 ILE 83 -6.571 -0.613 -2.585 714 HD13 ILE 83 2HD1 ILE 83 -7.251 0.888 -1.962 715 H LYS 84 H LYS 84 -3.735 5.280 -4.476 716 HA LYS 84 HA LYS 84 -2.807 6.886 -2.222 717 HB2 LYS 84 2HB LYS 84 -0.952 7.860 -3.600 718 HB3 LYS 84 3HB LYS 84 -0.739 6.190 -3.123 719 HG2 LYS 84 2HG LYS 84 0.052 6.146 -5.266 720 HG3 LYS 84 3HG LYS 84 -1.620 5.644 -5.525 721 HD2 LYS 84 2HD LYS 84 -2.220 7.677 -6.524 722 HD3 LYS 84 3HD LYS 84 -0.921 8.580 -5.731 723 HE2 LYS 84 2HE LYS 84 -0.544 6.543 -7.951 724 HE3 LYS 84 3HE LYS 84 -0.501 8.295 -8.134 725 HZ1 LYS 84 3HZ LYS 84 1.732 7.420 -7.983 726 HZ2 LYS 84 1HZ LYS 84 1.376 6.657 -6.521 727 HZ3 LYS 84 2HZ LYS 84 1.411 8.339 -6.601 728 H VAL 85 H VAL 85 -3.245 8.998 -2.251 729 HA VAL 85 HA VAL 85 -5.450 9.856 -3.938 730 HB VAL 85 HB VAL 85 -4.039 11.214 -1.581 731 HG11 VAL 85 1HG1 VAL 85 -5.993 12.694 -1.424 732 HG12 VAL 85 2HG1 VAL 85 -6.682 11.960 -2.874 733 HG13 VAL 85 3HG1 VAL 85 -5.181 12.877 -2.980 734 HG21 VAL 85 3HG2 VAL 85 -6.659 9.658 -1.614 735 HG22 VAL 85 1HG2 VAL 85 -5.955 10.476 -0.214 736 HG23 VAL 85 2HG2 VAL 85 -5.131 9.090 -0.934 737 H ALA 86 H ALA 86 -5.223 11.180 -5.688 738 HA ALA 86 HA ALA 86 -2.608 11.586 -6.772 739 HB1 ALA 86 3HB ALA 86 -5.294 12.440 -7.876 740 HB2 ALA 86 1HB ALA 86 -4.515 10.880 -8.150 741 HB3 ALA 86 2HB ALA 86 -3.773 12.357 -8.769 742 H GLN 87 H GLN 87 -5.247 13.977 -6.536 743 HA GLN 87 HA GLN 87 -5.394 16.185 -6.192 744 HB2 GLN 87 2HB GLN 87 -2.881 15.789 -4.510 745 HB3 GLN 87 3HB GLN 87 -3.851 17.261 -4.513 746 HG2 GLN 87 2HG GLN 87 -4.827 14.514 -3.686 747 HG3 GLN 87 3HG GLN 87 -4.355 15.805 -2.580 748 HE21 GLN 87 1HE2 GLN 87 -6.956 14.363 -3.235 749 HE22 GLN 87 2HE2 GLN 87 -8.096 15.646 -3.395 750 H ASP 88 H ASP 88 -1.846 16.045 -6.223 751 HA ASP 88 HA ASP 88 -1.360 18.094 -8.076 752 HB2 ASP 88 2HB ASP 88 0.398 17.374 -6.599 753 HB3 ASP 88 3HB ASP 88 0.258 15.696 -7.109 754 H GLN 89 H GLN 89 -1.440 14.551 -8.501 755 HA GLN 89 HA GLN 89 -1.929 13.161 -10.178 756 HB2 GLN 89 2HB GLN 89 -2.750 15.590 -11.816 757 HB3 GLN 89 3HB GLN 89 -2.981 13.921 -12.326 758 HG2 GLN 89 2HG GLN 89 -4.520 13.537 -10.455 759 HG3 GLN 89 3HG GLN 89 -4.257 15.186 -9.880 760 HE21 GLN 89 1HE2 GLN 89 -5.051 16.933 -11.179 761 HE22 GLN 89 2HE2 GLN 89 -6.348 16.689 -12.291 762 H GLU 90 H GLU 90 -0.381 16.020 -11.739 763 HA GLU 90 HA GLU 90 0.599 14.431 -13.895 764 HB2 GLU 90 2HB GLU 90 1.089 17.347 -13.156 765 HB3 GLU 90 3HB GLU 90 1.592 16.603 -14.674 766 HG2 GLU 90 2HG GLU 90 -0.760 16.125 -15.248 767 HG3 GLU 90 3HG GLU 90 -1.279 16.809 -13.708 768 H LEU 91 H LEU 91 2.347 16.094 -11.216 769 HA LEU 91 HA LEU 91 4.937 15.053 -12.035 770 HB2 LEU 91 2HB LEU 91 4.061 16.501 -9.496 771 HB3 LEU 91 3HB LEU 91 5.713 15.986 -9.797 772 HG LEU 91 HG LEU 91 5.767 17.521 -11.815 773 HD11 LEU 91 1HD1 LEU 91 3.379 17.719 -12.280 774 HD12 LEU 91 2HD1 LEU 91 4.101 19.307 -12.029 775 HD13 LEU 91 3HD1 LEU 91 3.127 18.568 -10.752 776 HD21 LEU 91 3HD2 LEU 91 6.761 18.183 -9.683 777 HD22 LEU 91 1HD2 LEU 91 5.216 18.848 -9.144 778 HD23 LEU 91 2HD2 LEU 91 6.069 19.579 -10.508 779 H LEU 92 H LEU 92 2.391 14.179 -9.836 780 HA LEU 92 HA LEU 92 3.668 12.052 -8.436 781 HB2 LEU 92 2HB LEU 92 1.822 13.035 -7.383 782 HB3 LEU 92 3HB LEU 92 0.855 13.074 -8.832 783 HG LEU 92 HG LEU 92 1.405 10.321 -7.763 784 HD11 LEU 92 1HD1 LEU 92 -0.433 12.213 -6.249 785 HD12 LEU 92 2HD1 LEU 92 1.067 11.506 -5.643 786 HD13 LEU 92 3HD1 LEU 92 -0.309 10.467 -5.998 787 HD21 LEU 92 3HD2 LEU 92 -1.131 11.699 -8.740 788 HD22 LEU 92 1HD2 LEU 92 -0.967 9.978 -8.368 789 HD23 LEU 92 2HD2 LEU 92 -0.067 10.678 -9.711 790 H GLU 93 H GLU 93 2.221 12.367 -11.555 791 HA GLU 93 HA GLU 93 1.666 9.635 -12.150 792 HB2 GLU 93 2HB GLU 93 0.544 11.514 -13.278 793 HB3 GLU 93 3HB GLU 93 2.065 12.021 -14.004 794 HG2 GLU 93 2HG GLU 93 2.141 10.004 -15.359 795 HG3 GLU 93 3HG GLU 93 0.723 9.353 -14.542 796 H ARG 94 H ARG 94 4.581 11.552 -12.233 797 HA ARG 94 HA ARG 94 6.245 10.113 -13.927 798 HB2 ARG 94 2HB ARG 94 6.996 12.170 -12.863 799 HB3 ARG 94 3HB ARG 94 6.859 11.455 -11.263 800 HG2 ARG 94 2HG ARG 94 9.191 11.588 -11.848 801 HG3 ARG 94 3HG ARG 94 8.721 9.889 -11.836 802 HD2 ARG 94 2HD ARG 94 10.158 10.290 -13.725 803 HD3 ARG 94 3HD ARG 94 8.528 9.989 -14.338 804 HE ARG 94 HE ARG 94 8.871 12.757 -13.996 805 HH11 ARG 94 1HH1 ARG 94 10.100 10.213 -16.090 806 HH12 ARG 94 2HH1 ARG 94 10.415 11.293 -17.411 807 HH21 ARG 94 1HH2 ARG 94 9.280 14.157 -15.726 808 HH22 ARG 94 2HH2 ARG 94 9.950 13.532 -17.206 809 H PHE 95 H PHE 95 5.645 9.456 -10.425 810 HA PHE 95 HA PHE 95 7.013 6.909 -10.534 811 HB2 PHE 95 2HB PHE 95 6.964 8.339 -8.455 812 HB3 PHE 95 3HB PHE 95 5.251 7.965 -8.279 813 HD1 PHE 95 HD2 PHE 95 8.610 6.333 -8.555 814 HD2 PHE 95 HD1 PHE 95 4.617 6.002 -7.060 815 HE1 PHE 95 HE2 PHE 95 9.215 4.267 -7.386 816 HE2 PHE 95 HE1 PHE 95 5.232 3.924 -5.894 817 HZ PHE 95 HZ PHE 95 7.534 3.054 -6.058 818 H TYR 96 H TYR 96 3.641 8.000 -10.479 819 HA TYR 96 HA TYR 96 2.299 5.607 -10.034 820 HB2 TYR 96 2HB TYR 96 1.092 7.685 -9.956 821 HB3 TYR 96 3HB TYR 96 1.519 8.081 -11.611 822 HD1 TYR 96 HD1 TYR 96 -0.497 5.656 -9.585 823 HD2 TYR 96 HD2 TYR 96 -0.011 7.562 -13.370 824 HE1 TYR 96 HE1 TYR 96 -2.641 4.734 -10.315 825 HE2 TYR 96 HE2 TYR 96 -2.156 6.634 -14.109 826 HH TYR 96 HH TYR 96 -3.693 4.854 -13.592 827 H GLU 97 H GLU 97 3.350 7.001 -13.153 828 HA GLU 97 HA GLU 97 2.182 5.025 -14.822 829 HB2 GLU 97 2HB GLU 97 2.760 7.348 -15.545 830 HB3 GLU 97 3HB GLU 97 4.476 6.936 -15.446 831 HG2 GLU 97 2HG GLU 97 4.120 5.192 -17.196 832 HG3 GLU 97 3HG GLU 97 2.434 5.684 -17.325 833 H GLN 98 H GLN 98 5.270 5.256 -13.163 834 HA GLN 98 HA GLN 98 6.861 3.448 -14.593 835 HB2 GLN 98 2HB GLN 98 7.416 5.043 -12.553 836 HB3 GLN 98 3HB GLN 98 6.985 3.671 -11.550 837 HG2 GLN 98 2HG GLN 98 9.231 3.757 -13.596 838 HG3 GLN 98 3HG GLN 98 9.416 3.875 -11.851 839 HE21 GLN 98 1HE2 GLN 98 8.790 1.720 -14.529 840 HE22 GLN 98 2HE2 GLN 98 9.024 0.248 -13.657 841 H LEU 99 H LEU 99 4.595 2.911 -11.912 842 HA LEU 99 HA LEU 99 5.050 0.078 -11.712 843 HB2 LEU 99 2HB LEU 99 2.999 1.934 -10.468 844 HB3 LEU 99 3HB LEU 99 2.973 0.203 -10.182 845 HG LEU 99 HG LEU 99 5.239 0.352 -9.129 846 HD11 LEU 99 1HD1 LEU 99 6.189 2.544 -8.548 847 HD12 LEU 99 2HD1 LEU 99 4.938 3.334 -9.520 848 HD13 LEU 99 3HD1 LEU 99 6.126 2.286 -10.293 849 HD21 LEU 99 3HD2 LEU 99 4.532 1.458 -7.046 850 HD22 LEU 99 1HD2 LEU 99 3.237 0.464 -7.717 851 HD23 LEU 99 2HD2 LEU 99 3.185 2.218 -7.899 852 H LYS 100 H LYS 100 2.733 2.136 -13.378 853 HA LYS 100 HA LYS 100 0.886 0.069 -14.132 854 HB2 LYS 100 2HB LYS 100 1.402 2.801 -15.392 855 HB3 LYS 100 3HB LYS 100 0.006 1.786 -15.722 856 HG2 LYS 100 2HG LYS 100 0.567 2.771 -12.914 857 HG3 LYS 100 3HG LYS 100 -0.217 3.810 -14.098 858 HD2 LYS 100 2HD LYS 100 -1.947 2.818 -12.770 859 HD3 LYS 100 3HD LYS 100 -2.027 2.083 -14.365 860 HE2 LYS 100 2HE LYS 100 -0.927 0.058 -13.482 861 HE3 LYS 100 3HE LYS 100 -0.794 0.812 -11.896 862 HZ1 LYS 100 3HZ LYS 100 -3.359 0.206 -13.286 863 HZ2 LYS 100 1HZ LYS 100 -3.197 0.875 -11.742 864 HZ3 LYS 100 2HZ LYS 100 -2.690 -0.710 -12.032 865 H LYS 101 H LYS 101 3.811 1.403 -15.456 866 HA LYS 101 HA LYS 101 3.717 0.177 -18.069 867 HB2 LYS 101 2HB LYS 101 4.837 2.379 -17.518 868 HB3 LYS 101 3HB LYS 101 6.031 1.505 -16.567 869 HG2 LYS 101 2HG LYS 101 6.789 0.339 -18.631 870 HG3 LYS 101 3HG LYS 101 5.603 1.262 -19.565 871 HD2 LYS 101 2HD LYS 101 6.730 3.382 -18.827 872 HD3 LYS 101 3HD LYS 101 7.955 2.411 -18.000 873 HE2 LYS 101 2HE LYS 101 7.385 2.421 -20.981 874 HE3 LYS 101 3HE LYS 101 8.774 3.157 -20.180 875 HZ1 LYS 101 3HZ LYS 101 8.140 0.259 -20.278 876 HZ2 LYS 101 1HZ LYS 101 9.443 0.935 -19.443 877 HZ3 LYS 101 2HZ LYS 101 9.367 1.045 -21.122 878 H ASP 102 H ASP 102 5.057 -0.526 -14.910 879 HA ASP 102 HA ASP 102 6.672 -2.780 -15.625 880 HB2 ASP 102 2HB ASP 102 7.130 -1.549 -13.573 881 HB3 ASP 102 3HB ASP 102 5.503 -1.834 -12.971 882 H GLY 103 H GLY 103 3.641 -2.591 -13.761 883 HA2 GLY 103 2HA GLY 103 1.931 -4.338 -14.851 884 HA3 GLY 103 3HA GLY 103 3.088 -5.432 -14.086 885 H VAL 104 H VAL 104 3.549 -3.284 -11.967 886 HA VAL 104 HA VAL 104 1.840 -4.244 -9.942 887 HB VAL 104 HB VAL 104 3.491 -1.673 -9.987 888 HG11 VAL 104 1HG1 VAL 104 2.327 -3.146 -7.591 889 HG12 VAL 104 2HG1 VAL 104 1.829 -1.560 -8.184 890 HG13 VAL 104 3HG1 VAL 104 3.443 -1.781 -7.505 891 HG21 VAL 104 3HG2 VAL 104 4.833 -3.689 -10.398 892 HG22 VAL 104 1HG2 VAL 104 4.201 -4.426 -8.922 893 HG23 VAL 104 2HG2 VAL 104 5.218 -2.983 -8.828 894 H ASP 105 H ASP 105 -0.067 -3.493 -9.065 895 HA ASP 105 HA ASP 105 -1.609 -1.680 -10.751 896 HB2 ASP 105 2HB ASP 105 -2.451 -3.975 -9.893 897 HB3 ASP 105 3HB ASP 105 -2.638 -3.206 -8.335 898 H VAL 106 H VAL 106 -0.540 0.283 -10.135 899 HA VAL 106 HA VAL 106 -1.146 1.325 -7.451 900 HB VAL 106 HB VAL 106 1.050 1.844 -8.370 901 HG11 VAL 106 1HG1 VAL 106 1.382 3.311 -10.306 902 HG12 VAL 106 2HG1 VAL 106 -0.352 3.255 -10.631 903 HG13 VAL 106 3HG1 VAL 106 0.612 1.781 -10.737 904 HG21 VAL 106 3HG2 VAL 106 -0.636 4.359 -8.202 905 HG22 VAL 106 1HG2 VAL 106 1.119 4.275 -8.016 906 HG23 VAL 106 2HG2 VAL 106 0.067 3.490 -6.838 907 H ARG 107 H ARG 107 -2.516 3.134 -7.164 908 HA ARG 107 HA ARG 107 -4.679 3.369 -9.152 909 HB2 ARG 107 2HB ARG 107 -4.994 2.625 -6.204 910 HB3 ARG 107 3HB ARG 107 -6.321 2.944 -7.311 911 HG2 ARG 107 2HG ARG 107 -4.344 0.672 -7.681 912 HG3 ARG 107 3HG ARG 107 -5.876 0.516 -6.822 913 HD2 ARG 107 2HD ARG 107 -5.595 1.339 -9.730 914 HD3 ARG 107 3HD ARG 107 -5.997 -0.288 -9.175 915 HE ARG 107 HE ARG 107 -7.772 1.926 -9.433 916 HH11 ARG 107 1HH1 ARG 107 -7.247 -0.943 -7.447 917 HH12 ARG 107 2HH1 ARG 107 -8.907 -1.059 -6.959 918 HH21 ARG 107 1HH2 ARG 107 -9.937 1.775 -8.719 919 HH22 ARG 107 2HH2 ARG 107 -10.418 0.475 -7.678 920 H VAL 108 H VAL 108 -5.190 5.483 -9.394 921 HA VAL 108 HA VAL 108 -4.702 7.390 -7.207 922 HB VAL 108 HB VAL 108 -5.478 9.151 -8.884 923 HG11 VAL 108 1HG1 VAL 108 -3.351 9.189 -10.135 924 HG12 VAL 108 2HG1 VAL 108 -3.048 7.505 -9.701 925 HG13 VAL 108 3HG1 VAL 108 -3.089 8.747 -8.448 926 HG21 VAL 108 3HG2 VAL 108 -5.516 8.576 -11.290 927 HG22 VAL 108 1HG2 VAL 108 -6.775 7.707 -10.410 928 HG23 VAL 108 2HG2 VAL 108 -5.303 6.867 -10.896 929 H THR 109 H THR 109 -6.227 7.519 -5.718 930 HA THR 109 HA THR 109 -9.052 6.969 -6.298 931 HB THR 109 HB THR 109 -9.296 7.431 -3.777 932 HG1 THR 109 HG1 THR 109 -7.151 7.227 -2.679 933 HG21 THR 109 3HG2 THR 109 -8.306 5.276 -3.093 934 HG22 THR 109 1HG2 THR 109 -7.385 5.208 -4.600 935 HG23 THR 109 2HG2 THR 109 -9.148 5.128 -4.634 936 H ASP 110 H ASP 110 -7.083 9.570 -4.887 937 HA ASP 110 HA ASP 110 -6.987 11.798 -5.158 938 HB2 ASP 110 2HB ASP 110 -7.537 11.480 -7.563 939 HB3 ASP 110 3HB ASP 110 -9.251 11.535 -7.179 940 H ASN 111 H ASN 111 -10.411 10.761 -5.024 941 HA ASN 111 HA ASN 111 -11.261 12.870 -3.291 942 HB2 ASN 111 2HB ASN 111 -12.829 11.693 -4.794 943 HB3 ASN 111 3HB ASN 111 -12.569 10.185 -3.928 944 HD21 ASN 111 1HD2 ASN 111 -14.038 13.365 -3.771 945 HD22 ASN 111 2HD2 ASN 111 -15.088 13.038 -2.442 946 H GLU 112 H GLU 112 -11.897 12.709 -1.108 947 HA GLU 112 HA GLU 112 -10.041 11.541 0.655 948 HB2 GLU 112 2HB GLU 112 -12.795 12.696 1.248 949 HB3 GLU 112 3HB GLU 112 -11.531 12.432 2.444 950 HG2 GLU 112 2HG GLU 112 -11.246 14.296 0.073 951 HG3 GLU 112 3HG GLU 112 -11.813 14.814 1.658 952 H ASP 113 H ASP 113 -13.563 10.858 0.388 953 HA ASP 113 HA ASP 113 -13.350 8.717 2.295 954 HB2 ASP 113 2HB ASP 113 -15.371 10.398 1.898 955 HB3 ASP 113 3HB ASP 113 -15.914 9.181 0.751 956 H GLU 114 H GLU 114 -13.553 8.889 -1.225 957 HA GLU 114 HA GLU 114 -14.199 6.190 -1.759 958 HB2 GLU 114 2HB GLU 114 -12.492 8.107 -3.401 959 HB3 GLU 114 3HB GLU 114 -13.079 6.552 -3.980 960 HG2 GLU 114 2HG GLU 114 -14.760 8.954 -3.222 961 HG3 GLU 114 3HG GLU 114 -14.451 8.365 -4.849 962 H ALA 115 H ALA 115 -11.176 7.705 -0.813 963 HA ALA 115 HA ALA 115 -9.346 5.672 -1.507 964 HB1 ALA 115 3HB ALA 115 -8.683 7.983 -0.979 965 HB2 ALA 115 1HB ALA 115 -7.793 6.821 0.006 966 HB3 ALA 115 2HB ALA 115 -9.133 7.734 0.709 967 H LYS 116 H LYS 116 -11.062 6.279 1.574 968 HA LYS 116 HA LYS 116 -9.952 3.996 2.931 969 HB2 LYS 116 2HB LYS 116 -11.826 4.500 4.644 970 HB3 LYS 116 3HB LYS 116 -10.575 5.709 4.407 971 HG2 LYS 116 2HG LYS 116 -12.008 7.153 3.220 972 HG3 LYS 116 3HG LYS 116 -13.203 5.893 2.935 973 HD2 LYS 116 2HD LYS 116 -12.568 7.032 5.687 974 HD3 LYS 116 3HD LYS 116 -13.867 7.627 4.648 975 HE2 LYS 116 2HE LYS 116 -14.800 5.247 4.653 976 HE3 LYS 116 3HE LYS 116 -13.631 4.883 5.924 977 HZ1 LYS 116 3HZ LYS 116 -15.809 6.902 6.048 978 HZ2 LYS 116 1HZ LYS 116 -14.636 6.692 7.245 979 HZ3 LYS 116 2HZ LYS 116 -15.730 5.452 6.906 980 H LYS 117 H LYS 117 -12.923 4.564 1.088 981 HA LYS 117 HA LYS 117 -14.394 2.293 1.803 982 HB2 LYS 117 2HB LYS 117 -14.316 3.780 -0.856 983 HB3 LYS 117 3HB LYS 117 -15.459 2.482 -0.514 984 HG2 LYS 117 2HG LYS 117 -16.444 3.786 1.309 985 HG3 LYS 117 3HG LYS 117 -15.277 5.086 1.036 986 HD2 LYS 117 2HD LYS 117 -16.197 5.378 -1.276 987 HD3 LYS 117 3HD LYS 117 -17.395 4.127 -0.935 988 HE2 LYS 117 2HE LYS 117 -18.288 5.541 0.910 989 HE3 LYS 117 3HE LYS 117 -17.122 6.795 0.479 990 HZ1 LYS 117 3HZ LYS 117 -19.118 7.378 -0.554 991 HZ2 LYS 117 1HZ LYS 117 -19.410 5.811 -1.108 992 HZ3 LYS 117 2HZ LYS 117 -18.175 6.730 -1.796 993 H ARG 118 H ARG 118 -11.937 2.704 -0.745 994 HA ARG 118 HA ARG 118 -12.095 0.227 -1.998 995 HB2 ARG 118 2HB ARG 118 -10.040 2.383 -1.826 996 HB3 ARG 118 3HB ARG 118 -9.371 0.804 -2.182 997 HG2 ARG 118 2HG ARG 118 -9.742 1.995 -4.238 998 HG3 ARG 118 3HG ARG 118 -10.842 0.622 -4.161 999 HD2 ARG 118 2HD ARG 118 -11.663 3.454 -3.461 1000 HD3 ARG 118 3HD ARG 118 -11.798 2.782 -5.083 1001 HE ARG 118 HE ARG 118 -13.161 0.989 -3.534 1002 HH11 ARG 118 1HH1 ARG 118 -13.406 4.472 -3.994 1003 HH12 ARG 118 2HH1 ARG 118 -15.111 4.516 -3.688 1004 HH21 ARG 118 1HH2 ARG 118 -15.422 1.080 -3.134 1005 HH22 ARG 118 2HH2 ARG 118 -16.252 2.600 -3.202 1006 H LEU 119 H LEU 119 -10.029 1.178 0.760 1007 HA LEU 119 HA LEU 119 -8.552 -1.154 1.096 1008 HB2 LEU 119 2HB LEU 119 -9.478 0.888 3.141 1009 HB3 LEU 119 3HB LEU 119 -8.330 -0.386 3.528 1010 HG LEU 119 HG LEU 119 -7.872 1.767 1.425 1011 HD11 LEU 119 1HD1 LEU 119 -6.746 1.533 4.231 1012 HD12 LEU 119 2HD1 LEU 119 -7.959 2.697 3.689 1013 HD13 LEU 119 3HD1 LEU 119 -6.329 2.759 3.029 1014 HD21 LEU 119 3HD2 LEU 119 -6.646 -0.305 0.922 1015 HD22 LEU 119 1HD2 LEU 119 -5.969 -0.326 2.555 1016 HD23 LEU 119 2HD2 LEU 119 -5.538 0.966 1.429 1017 H LYS 120 H LYS 120 -11.608 -0.262 2.704 1018 HA LYS 120 HA LYS 120 -11.740 -2.507 4.416 1019 HB2 LYS 120 2HB LYS 120 -12.976 -0.319 4.714 1020 HB3 LYS 120 3HB LYS 120 -14.072 -0.813 3.427 1021 HG2 LYS 120 2HG LYS 120 -14.753 -2.782 4.787 1022 HG3 LYS 120 3HG LYS 120 -13.671 -2.243 6.081 1023 HD2 LYS 120 2HD LYS 120 -14.998 -0.151 6.318 1024 HD3 LYS 120 3HD LYS 120 -16.061 -0.674 5.006 1025 HE2 LYS 120 2HE LYS 120 -16.735 -2.640 6.366 1026 HE3 LYS 120 3HE LYS 120 -15.714 -2.059 7.683 1027 HZ1 LYS 120 3HZ LYS 120 -18.015 -1.451 8.023 1028 HZ2 LYS 120 1HZ LYS 120 -18.065 -0.627 6.550 1029 HZ3 LYS 120 2HZ LYS 120 -17.086 -0.062 7.802 1030 H GLU 121 H GLU 121 -13.077 -1.858 1.198 1031 HA GLU 121 HA GLU 121 -14.729 -4.178 0.990 1032 HB2 GLU 121 2HB GLU 121 -13.628 -2.354 -1.179 1033 HB3 GLU 121 3HB GLU 121 -14.878 -3.580 -1.429 1034 HG2 GLU 121 2HG GLU 121 -16.370 -2.424 0.128 1035 HG3 GLU 121 3HG GLU 121 -15.121 -1.223 0.465 1036 H LEU 122 H LEU 122 -11.411 -3.483 0.070 1037 HA LEU 122 HA LEU 122 -10.855 -5.908 -1.324 1038 HB2 LEU 122 2HB LEU 122 -9.002 -4.077 0.263 1039 HB3 LEU 122 3HB LEU 122 -8.472 -5.334 -0.843 1040 HG LEU 122 HG LEU 122 -10.072 -2.894 -1.681 1041 HD11 LEU 122 1HD1 LEU 122 -7.969 -2.044 -2.612 1042 HD12 LEU 122 2HD1 LEU 122 -7.104 -3.415 -1.911 1043 HD13 LEU 122 3HD1 LEU 122 -7.889 -2.233 -0.860 1044 HD21 LEU 122 3HD2 LEU 122 -9.471 -3.500 -3.971 1045 HD22 LEU 122 1HD2 LEU 122 -10.401 -4.786 -3.199 1046 HD23 LEU 122 2HD2 LEU 122 -8.656 -4.955 -3.390 1047 H LEU 123 H LEU 123 -10.457 -4.845 2.031 1048 HA LEU 123 HA LEU 123 -9.356 -7.202 3.135 1049 HB2 LEU 123 2HB LEU 123 -10.493 -4.649 4.213 1050 HB3 LEU 123 3HB LEU 123 -10.415 -5.993 5.335 1051 HG LEU 123 HG LEU 123 -7.967 -6.118 5.090 1052 HD11 LEU 123 1HD1 LEU 123 -6.667 -4.479 3.833 1053 HD12 LEU 123 2HD1 LEU 123 -8.151 -3.791 3.171 1054 HD13 LEU 123 3HD1 LEU 123 -7.688 -5.442 2.765 1055 HD21 LEU 123 3HD2 LEU 123 -7.397 -3.956 6.159 1056 HD22 LEU 123 1HD2 LEU 123 -8.869 -4.673 6.819 1057 HD23 LEU 123 2HD2 LEU 123 -8.981 -3.321 5.689 1058 H GLU 124 H GLU 124 -12.670 -6.454 2.317 1059 HA GLU 124 HA GLU 124 -14.094 -8.146 4.033 1060 HB2 GLU 124 2HB GLU 124 -14.637 -7.626 1.083 1061 HB3 GLU 124 3HB GLU 124 -15.782 -8.376 2.187 1062 HG2 GLU 124 2HG GLU 124 -14.752 -5.534 2.278 1063 HG3 GLU 124 3HG GLU 124 -16.369 -6.062 1.834 1064 H LYS 125 H LYS 125 -12.152 -8.930 1.212 1065 HA LYS 125 HA LYS 125 -12.534 -11.833 1.642 1066 HB2 LYS 125 2HB LYS 125 -11.401 -10.284 -0.728 1067 HB3 LYS 125 3HB LYS 125 -11.290 -12.031 -0.581 1068 HG2 LYS 125 2HG LYS 125 -13.309 -12.239 -1.577 1069 HG3 LYS 125 3HG LYS 125 -14.060 -11.420 -0.212 1070 HD2 LYS 125 2HD LYS 125 -12.924 -10.026 -2.665 1071 HD3 LYS 125 3HD LYS 125 -14.627 -10.415 -2.429 1072 HE2 LYS 125 2HE LYS 125 -14.624 -8.970 -0.392 1073 HE3 LYS 125 3HE LYS 125 -12.953 -8.524 -0.748 1074 HZ1 LYS 125 3HZ LYS 125 -14.440 -6.850 -1.571 1075 HZ2 LYS 125 1HZ LYS 125 -15.326 -7.987 -2.453 1076 HZ3 LYS 125 2HZ LYS 125 -13.732 -7.632 -2.882 1077 H VAL 126 H VAL 126 -9.858 -9.572 0.799 1078 HA VAL 126 HA VAL 126 -8.262 -10.241 3.040 1079 HB VAL 126 HB VAL 126 -7.889 -12.369 1.852 1080 HG11 VAL 126 1HG1 VAL 126 -6.735 -12.530 -0.311 1081 HG12 VAL 126 2HG1 VAL 126 -6.773 -10.771 -0.470 1082 HG13 VAL 126 3HG1 VAL 126 -8.280 -11.689 -0.459 1083 HG21 VAL 126 3HG2 VAL 126 -6.050 -11.494 3.212 1084 HG22 VAL 126 1HG2 VAL 126 -5.393 -10.638 1.815 1085 HG23 VAL 126 2HG2 VAL 126 -5.425 -12.402 1.835 1086 H GLY 127 H GLY 127 -8.027 -9.197 -0.369 1087 HA2 GLY 127 2HA GLY 127 -7.321 -6.525 0.116 1088 HA3 GLY 127 3HA GLY 127 -5.835 -7.448 -0.135 1089 H SER 128 H SER 128 -9.053 -7.850 -1.556 1090 HA SER 128 HA SER 128 -8.327 -7.001 -4.197 1091 HB2 SER 128 2HB SER 128 -7.146 -9.197 -4.074 1092 HB3 SER 128 3HB SER 128 -8.679 -9.993 -3.721 1093 HG SER 128 HG SER 128 -7.754 -9.744 -6.043 1094 H LEU 129 H LEU 129 -10.106 -7.046 -5.634 1095 HA LEU 129 HA LEU 129 -12.191 -6.716 -6.329 1096 HB2 LEU 129 2HB LEU 129 -12.566 -9.109 -5.787 1097 HB3 LEU 129 3HB LEU 129 -13.052 -8.658 -4.162 1098 HG LEU 129 HG LEU 129 -15.011 -7.397 -5.158 1099 HD11 LEU 129 1HD1 LEU 129 -14.169 -8.706 -7.755 1100 HD12 LEU 129 2HD1 LEU 129 -14.163 -6.976 -7.397 1101 HD13 LEU 129 3HD1 LEU 129 -15.690 -7.854 -7.473 1102 HD21 LEU 129 3HD2 LEU 129 -15.343 -9.640 -4.239 1103 HD22 LEU 129 1HD2 LEU 129 -14.925 -10.364 -5.795 1104 HD23 LEU 129 2HD2 LEU 129 -16.384 -9.380 -5.637 1105 H GLU 130 H GLU 130 -13.814 -5.237 -6.041 1106 HA GLU 130 HA GLU 130 -14.420 -3.980 -3.511 1107 HB2 GLU 130 2HB GLU 130 -13.374 -1.774 -4.119 1108 HB3 GLU 130 3HB GLU 130 -12.173 -3.051 -3.883 1109 HG2 GLU 130 2HG GLU 130 -11.973 -3.357 -6.299 1110 HG3 GLU 130 3HG GLU 130 -13.224 -2.156 -6.583 1111 H HIS 131 H HIS 131 -15.670 -1.824 -4.006 1112 HA HIS 131 HA HIS 131 -17.578 -2.324 -6.193 1113 HB2 HIS 131 2HB HIS 131 -18.298 -1.760 -3.764 1114 HB3 HIS 131 3HB HIS 131 -17.812 -0.110 -4.109 1115 HD1 HIS 131 HD1 HIS 131 -20.593 -2.463 -4.452 1116 HD2 HIS 131 HD2 HIS 131 -19.478 1.145 -6.191 1117 HE1 HIS 131 HE1 HIS 131 -22.674 -1.559 -5.527 1118 HE2 HIS 131 HE2 HIS 131 -22.012 0.690 -6.425 1119 H HIS 132 H HIS 132 -15.263 -1.723 -7.281 1120 HA HIS 132 HA HIS 132 -15.046 1.023 -8.061 1121 HB2 HIS 132 2HB HIS 132 -13.657 0.085 -9.992 1122 HB3 HIS 132 3HB HIS 132 -13.071 -0.290 -8.380 1123 HD1 HIS 132 HD1 HIS 132 -11.898 -2.447 -8.712 1124 HD2 HIS 132 HD2 HIS 132 -15.636 -2.492 -10.514 1125 HE1 HIS 132 HE1 HIS 132 -12.229 -4.786 -9.533 1126 HE2 HIS 132 HE2 HIS 132 -14.387 -4.727 -10.789 1127 H HIS 133 H HIS 133 -15.845 2.009 -9.889 1128 HA HIS 133 HA HIS 133 -17.452 0.602 -11.844 1129 HB2 HIS 133 2HB HIS 133 -19.457 2.082 -11.575 1130 HB3 HIS 133 3HB HIS 133 -19.205 1.043 -10.180 1131 HD1 HIS 133 HD1 HIS 133 -19.903 4.464 -11.050 1132 HD2 HIS 133 HD2 HIS 133 -17.894 2.547 -7.955 1133 HE1 HIS 133 HE1 HIS 133 -19.739 6.153 -9.200 1134 HE2 HIS 133 HE2 HIS 133 -18.305 5.048 -7.458 1135 H HIS 134 H HIS 134 -16.578 1.322 -13.644 1136 HA HIS 134 HA HIS 134 -15.016 3.710 -13.800 1137 HB2 HIS 134 2HB HIS 134 -15.892 1.707 -15.919 1138 HB3 HIS 134 3HB HIS 134 -14.861 3.089 -16.277 1139 HD1 HIS 134 HD1 HIS 134 -14.416 -0.283 -15.973 1140 HD2 HIS 134 HD2 HIS 134 -12.584 2.906 -14.046 1141 HE1 HIS 134 HE1 HIS 134 -12.182 -1.146 -15.233 1142 HE2 HIS 134 HE2 HIS 134 -11.024 0.866 -14.276 1143 H HIS 135 H HIS 135 -16.332 5.439 -13.338 1144 HA HIS 135 HA HIS 135 -18.852 5.946 -14.549 1145 HB2 HIS 135 2HB HIS 135 -18.142 6.982 -12.376 1146 HB3 HIS 135 3HB HIS 135 -16.964 7.962 -13.247 1147 HD1 HIS 135 HD1 HIS 135 -18.108 9.595 -15.164 1148 HD2 HIS 135 HD2 HIS 135 -20.601 8.166 -12.163 1149 HE1 HIS 135 HE1 HIS 135 -20.143 11.053 -15.236 1150 HE2 HIS 135 HE2 HIS 135 -21.717 10.028 -13.567 1151 H HIS 136 H HIS 136 -18.793 5.907 -16.741 1152 HA HIS 136 HA HIS 136 -16.915 7.581 -18.244 1153 HB2 HIS 136 2HB HIS 136 -19.098 5.687 -19.238 1154 HB3 HIS 136 3HB HIS 136 -17.913 6.508 -20.248 1155 HD1 HIS 136 HD1 HIS 136 -18.476 3.279 -19.145 1156 HD2 HIS 136 HD2 HIS 136 -15.117 5.723 -18.990 1157 HE1 HIS 136 HE1 HIS 136 -16.521 1.720 -18.903 1158 HE2 HIS 136 HE2 HIS 136 -14.508 3.217 -19.056 Start of MODEL 3 1 H1 MET 1 1H MET 1 -4.476 -15.803 -1.662 2 H2 MET 1 2H MET 1 -2.812 -16.105 -1.732 3 H3 MET 1 3H MET 1 -3.408 -14.563 -2.078 4 HA MET 1 HA MET 1 -4.151 -14.251 0.124 5 HB2 MET 1 2HB MET 1 -3.569 -15.939 1.911 6 HB3 MET 1 3HB MET 1 -4.799 -16.472 0.781 7 HG2 MET 1 2HG MET 1 -1.897 -17.341 0.748 8 HG3 MET 1 3HG MET 1 -3.246 -18.278 1.388 9 HE1 MET 1 3HE MET 1 -5.289 -19.035 -1.911 10 HE2 MET 1 1HE MET 1 -5.531 -17.660 -0.835 11 HE3 MET 1 2HE MET 1 -5.227 -19.264 -0.163 12 H GLY 2 H GLY 2 -2.787 -12.572 0.248 13 HA2 GLY 2 2HA GLY 2 -0.728 -11.972 1.613 14 HA3 GLY 2 3HA GLY 2 0.151 -13.021 0.506 15 H THR 3 H THR 3 -2.397 -10.555 -0.020 16 HA THR 3 HA THR 3 -0.908 -9.341 -2.194 17 HB THR 3 HB THR 3 -3.572 -8.490 -0.967 18 HG1 THR 3 HG1 THR 3 -4.454 -9.553 -2.795 19 HG21 THR 3 3HG2 THR 3 -2.479 -6.613 -2.173 20 HG22 THR 3 1HG2 THR 3 -3.904 -7.193 -3.048 21 HG23 THR 3 2HG2 THR 3 -2.292 -7.644 -3.593 22 H VAL 4 H VAL 4 0.314 -7.535 -2.045 23 HA VAL 4 HA VAL 4 0.602 -6.170 0.556 24 HB VAL 4 HB VAL 4 2.291 -5.814 -1.983 25 HG11 VAL 4 1HG1 VAL 4 3.969 -4.795 -0.475 26 HG12 VAL 4 2HG1 VAL 4 2.878 -5.010 0.895 27 HG13 VAL 4 3HG1 VAL 4 2.440 -3.912 -0.414 28 HG21 VAL 4 3HG2 VAL 4 2.456 -8.155 -1.222 29 HG22 VAL 4 1HG2 VAL 4 2.886 -7.611 0.401 30 HG23 VAL 4 2HG2 VAL 4 3.978 -7.303 -0.951 31 H VAL 5 H VAL 5 -0.790 -4.506 0.785 32 HA VAL 5 HA VAL 5 -1.560 -2.863 -1.555 33 HB VAL 5 HB VAL 5 -3.639 -2.237 -0.243 34 HG11 VAL 5 1HG1 VAL 5 -4.864 -4.323 -0.769 35 HG12 VAL 5 2HG1 VAL 5 -3.333 -5.194 -0.909 36 HG13 VAL 5 3HG1 VAL 5 -3.723 -3.906 -2.050 37 HG21 VAL 5 3HG2 VAL 5 -4.401 -3.707 1.600 38 HG22 VAL 5 1HG2 VAL 5 -2.918 -2.855 2.037 39 HG23 VAL 5 2HG2 VAL 5 -2.850 -4.554 1.572 40 H ILE 6 H ILE 6 -0.586 -0.928 -1.584 41 HA ILE 6 HA ILE 6 0.561 0.161 0.920 42 HB ILE 6 HB ILE 6 1.326 0.850 -1.953 43 HG12 ILE 6 2HG1 ILE 6 3.580 -0.322 -1.218 44 HG13 ILE 6 3HG1 ILE 6 2.589 -1.108 -0.000 45 HG21 ILE 6 1HG2 ILE 6 3.249 2.043 -0.954 46 HG22 ILE 6 2HG2 ILE 6 2.646 1.665 0.657 47 HG23 ILE 6 3HG2 ILE 6 1.714 2.721 -0.406 48 HD11 ILE 6 3HD1 ILE 6 2.943 -2.518 -1.950 49 HD12 ILE 6 1HD1 ILE 6 2.195 -1.301 -2.985 50 HD13 ILE 6 2HD1 ILE 6 1.234 -2.129 -1.758 51 H VAL 7 H VAL 7 -0.732 1.687 1.803 52 HA VAL 7 HA VAL 7 -2.468 3.345 0.133 53 HB VAL 7 HB VAL 7 -2.252 3.256 3.171 54 HG11 VAL 7 1HG1 VAL 7 -4.336 4.622 1.401 55 HG12 VAL 7 2HG1 VAL 7 -3.124 5.442 2.391 56 HG13 VAL 7 3HG1 VAL 7 -4.403 4.504 3.162 57 HG21 VAL 7 3HG2 VAL 7 -4.334 1.961 3.078 58 HG22 VAL 7 1HG2 VAL 7 -3.037 1.138 2.205 59 HG23 VAL 7 2HG2 VAL 7 -4.292 2.001 1.314 60 H VAL 8 H VAL 8 -1.817 5.198 -0.596 61 HA VAL 8 HA VAL 8 0.156 6.818 0.889 62 HB VAL 8 HB VAL 8 -0.069 6.727 -2.148 63 HG11 VAL 8 1HG1 VAL 8 2.066 7.931 -0.364 64 HG12 VAL 8 2HG1 VAL 8 0.810 8.830 -1.218 65 HG13 VAL 8 3HG1 VAL 8 2.044 7.961 -2.129 66 HG21 VAL 8 3HG2 VAL 8 0.712 4.525 -1.378 67 HG22 VAL 8 1HG2 VAL 8 1.988 5.294 -0.431 68 HG23 VAL 8 2HG2 VAL 8 2.010 5.398 -2.191 69 H SER 9 H SER 9 -0.257 8.979 0.982 70 HA SER 9 HA SER 9 -2.299 10.256 -0.649 71 HB2 SER 9 2HB SER 9 -2.510 10.239 2.404 72 HB3 SER 9 3HB SER 9 -3.538 11.166 1.311 73 HG SER 9 HG SER 9 -3.809 8.779 0.447 74 H ASN 10 H ASN 10 -2.040 12.539 -0.694 75 HA ASN 10 HA ASN 10 0.590 13.543 -0.174 76 HB2 ASN 10 2HB ASN 10 -0.781 14.405 -2.048 77 HB3 ASN 10 3HB ASN 10 -1.964 15.039 -0.912 78 HD21 ASN 10 1HD2 ASN 10 -1.740 17.163 -1.609 79 HD22 ASN 10 2HD2 ASN 10 -0.312 18.102 -1.354 80 H ASP 11 H ASP 11 -2.545 13.828 1.455 81 HA ASP 11 HA ASP 11 -1.401 15.361 3.676 82 HB2 ASP 11 2HB ASP 11 -4.210 14.400 3.041 83 HB3 ASP 11 3HB ASP 11 -3.806 15.026 4.636 84 H GLU 12 H GLU 12 -0.972 14.586 5.639 85 HA GLU 12 HA GLU 12 -0.317 11.781 5.834 86 HB2 GLU 12 2HB GLU 12 1.238 13.578 6.532 87 HB3 GLU 12 3HB GLU 12 0.101 14.083 7.777 88 HG2 GLU 12 2HG GLU 12 0.353 11.864 8.877 89 HG3 GLU 12 3HG GLU 12 1.545 11.412 7.654 90 H ARG 13 H ARG 13 -2.612 14.039 7.343 91 HA ARG 13 HA ARG 13 -3.524 12.356 9.429 92 HB2 ARG 13 2HB ARG 13 -5.060 14.569 8.036 93 HB3 ARG 13 3HB ARG 13 -5.485 13.835 9.582 94 HG2 ARG 13 2HG ARG 13 -3.412 14.714 10.582 95 HG3 ARG 13 3HG ARG 13 -2.962 15.436 9.032 96 HD2 ARG 13 2HD ARG 13 -5.166 16.754 9.164 97 HD3 ARG 13 3HD ARG 13 -5.291 16.202 10.835 98 HE ARG 13 HE ARG 13 -3.670 18.313 9.812 99 HH11 ARG 13 1HH1 ARG 13 -3.652 15.876 12.366 100 HH12 ARG 13 2HH1 ARG 13 -2.596 16.805 13.379 101 HH21 ARG 13 1HH2 ARG 13 -2.361 19.502 11.189 102 HH22 ARG 13 2HH2 ARG 13 -1.868 18.844 12.720 103 H ILE 14 H ILE 14 -4.365 12.559 6.028 104 HA ILE 14 HA ILE 14 -6.691 10.950 6.044 105 HB ILE 14 HB ILE 14 -4.596 11.304 3.843 106 HG12 ILE 14 2HG1 ILE 14 -5.722 13.416 4.441 107 HG13 ILE 14 3HG1 ILE 14 -6.234 12.895 2.844 108 HG21 ILE 14 1HG2 ILE 14 -7.375 10.083 3.596 109 HG22 ILE 14 2HG2 ILE 14 -5.846 9.221 3.430 110 HG23 ILE 14 3HG2 ILE 14 -6.295 10.449 2.246 111 HD11 ILE 14 3HD1 ILE 14 -7.827 12.658 5.401 112 HD12 ILE 14 1HD1 ILE 14 -8.349 12.065 3.819 113 HD13 ILE 14 2HD1 ILE 14 -8.093 13.789 4.076 114 H LEU 15 H LEU 15 -3.216 10.138 5.757 115 HA LEU 15 HA LEU 15 -3.428 7.331 5.566 116 HB2 LEU 15 2HB LEU 15 -1.257 9.030 6.847 117 HB3 LEU 15 3HB LEU 15 -1.077 7.325 6.461 118 HG LEU 15 HG LEU 15 -1.627 9.465 4.370 119 HD11 LEU 15 1HD1 LEU 15 1.043 8.243 5.129 120 HD12 LEU 15 2HD1 LEU 15 0.526 9.901 5.454 121 HD13 LEU 15 3HD1 LEU 15 0.740 9.356 3.793 122 HD21 LEU 15 3HD2 LEU 15 -0.753 6.559 4.098 123 HD22 LEU 15 1HD2 LEU 15 -0.926 7.715 2.773 124 HD23 LEU 15 2HD2 LEU 15 -2.342 7.217 3.698 125 H GLU 16 H GLU 16 -3.366 9.479 8.369 126 HA GLU 16 HA GLU 16 -3.062 7.475 10.385 127 HB2 GLU 16 2HB GLU 16 -4.083 10.346 10.622 128 HB3 GLU 16 3HB GLU 16 -3.591 9.318 11.970 129 HG2 GLU 16 2HG GLU 16 -1.293 9.201 10.985 130 HG3 GLU 16 3HG GLU 16 -1.809 10.335 9.741 131 H GLU 17 H GLU 17 -5.838 9.274 9.130 132 HA GLU 17 HA GLU 17 -7.848 8.156 10.794 133 HB2 GLU 17 2HB GLU 17 -8.098 10.302 9.624 134 HB3 GLU 17 3HB GLU 17 -7.986 9.501 8.058 135 HG2 GLU 17 2HG GLU 17 -10.127 8.470 8.324 136 HG3 GLU 17 3HG GLU 17 -10.195 8.886 10.035 137 H LEU 18 H LEU 18 -6.766 7.418 7.513 138 HA LEU 18 HA LEU 18 -8.532 5.264 6.977 139 HB2 LEU 18 2HB LEU 18 -6.089 6.420 5.655 140 HB3 LEU 18 3HB LEU 18 -6.584 4.811 5.174 141 HG LEU 18 HG LEU 18 -8.783 5.649 4.452 142 HD11 LEU 18 1HD1 LEU 18 -7.856 8.423 5.220 143 HD12 LEU 18 2HD1 LEU 18 -9.106 7.484 6.038 144 HD13 LEU 18 3HD1 LEU 18 -9.353 8.018 4.376 145 HD21 LEU 18 3HD2 LEU 18 -6.492 7.234 3.266 146 HD22 LEU 18 1HD2 LEU 18 -8.055 6.947 2.495 147 HD23 LEU 18 2HD2 LEU 18 -6.972 5.596 2.821 148 H LEU 19 H LEU 19 -5.389 5.433 8.542 149 HA LEU 19 HA LEU 19 -4.578 2.774 8.603 150 HB2 LEU 19 2HB LEU 19 -3.267 4.660 9.571 151 HB3 LEU 19 3HB LEU 19 -4.445 4.804 10.864 152 HG LEU 19 HG LEU 19 -3.806 2.334 11.457 153 HD11 LEU 19 1HD1 LEU 19 -1.390 3.042 9.777 154 HD12 LEU 19 2HD1 LEU 19 -2.582 1.782 9.441 155 HD13 LEU 19 3HD1 LEU 19 -1.536 1.646 10.850 156 HD21 LEU 19 3HD2 LEU 19 -3.276 4.221 12.893 157 HD22 LEU 19 1HD2 LEU 19 -1.813 4.556 11.959 158 HD23 LEU 19 2HD2 LEU 19 -1.957 3.055 12.879 159 H GLU 20 H GLU 20 -6.712 4.512 10.808 160 HA GLU 20 HA GLU 20 -7.299 2.351 12.539 161 HB2 GLU 20 2HB GLU 20 -8.915 4.903 12.126 162 HB3 GLU 20 3HB GLU 20 -8.917 3.861 13.554 163 HG2 GLU 20 2HG GLU 20 -6.500 4.413 13.922 164 HG3 GLU 20 3HG GLU 20 -6.573 5.513 12.542 165 H VAL 21 H VAL 21 -8.772 3.532 9.573 166 HA VAL 21 HA VAL 21 -11.196 2.092 9.647 167 HB VAL 21 HB VAL 21 -9.579 2.971 7.207 168 HG11 VAL 21 1HG1 VAL 21 -11.701 2.781 5.925 169 HG12 VAL 21 2HG1 VAL 21 -12.495 2.093 7.344 170 HG13 VAL 21 3HG1 VAL 21 -11.184 1.214 6.557 171 HG21 VAL 21 3HG2 VAL 21 -11.116 4.912 7.155 172 HG22 VAL 21 1HG2 VAL 21 -10.227 4.845 8.678 173 HG23 VAL 21 2HG2 VAL 21 -11.913 4.329 8.617 174 H VAL 22 H VAL 22 -7.948 1.167 8.446 175 HA VAL 22 HA VAL 22 -8.667 -1.445 7.546 176 HB VAL 22 HB VAL 22 -5.925 -0.433 8.432 177 HG11 VAL 22 1HG1 VAL 22 -5.002 -2.335 7.139 178 HG12 VAL 22 2HG1 VAL 22 -6.635 -2.908 6.803 179 HG13 VAL 22 3HG1 VAL 22 -6.028 -2.902 8.459 180 HG21 VAL 22 3HG2 VAL 22 -6.832 0.886 6.565 181 HG22 VAL 22 1HG2 VAL 22 -7.134 -0.591 5.647 182 HG23 VAL 22 2HG2 VAL 22 -5.477 -0.105 6.018 183 H LEU 23 H LEU 23 -7.167 -0.225 10.562 184 HA LEU 23 HA LEU 23 -6.772 -2.611 11.923 185 HB2 LEU 23 2HB LEU 23 -7.105 0.249 12.782 186 HB3 LEU 23 3HB LEU 23 -7.203 -0.973 14.032 187 HG LEU 23 HG LEU 23 -4.924 -1.775 13.434 188 HD11 LEU 23 1HD1 LEU 23 -3.471 -0.496 11.956 189 HD12 LEU 23 2HD1 LEU 23 -4.826 0.544 11.512 190 HD13 LEU 23 3HD1 LEU 23 -4.850 -1.166 11.083 191 HD21 LEU 23 3HD2 LEU 23 -5.074 1.181 14.077 192 HD22 LEU 23 1HD2 LEU 23 -3.685 0.132 14.374 193 HD23 LEU 23 2HD2 LEU 23 -5.199 -0.147 15.231 194 H LYS 24 H LYS 24 -9.700 -0.579 11.894 195 HA LYS 24 HA LYS 24 -11.075 -2.167 13.878 196 HB2 LYS 24 2HB LYS 24 -12.938 -0.663 13.579 197 HB3 LYS 24 3HB LYS 24 -11.469 0.303 13.546 198 HG2 LYS 24 2HG LYS 24 -11.587 0.371 11.068 199 HG3 LYS 24 3HG LYS 24 -13.089 -0.553 11.127 200 HD2 LYS 24 2HD LYS 24 -14.137 1.312 12.433 201 HD3 LYS 24 3HD LYS 24 -12.642 2.240 12.261 202 HE2 LYS 24 2HE LYS 24 -12.911 2.234 9.817 203 HE3 LYS 24 3HE LYS 24 -14.371 1.255 9.969 204 HZ1 LYS 24 3HZ LYS 24 -14.032 3.952 11.121 205 HZ2 LYS 24 1HZ LYS 24 -15.439 3.029 11.121 206 HZ3 LYS 24 2HZ LYS 24 -14.819 3.623 9.667 207 H SER 25 H SER 25 -10.878 -2.129 10.368 208 HA SER 25 HA SER 25 -13.236 -3.663 9.821 209 HB2 SER 25 2HB SER 25 -12.150 -2.200 8.117 210 HB3 SER 25 3HB SER 25 -10.746 -3.269 8.092 211 HG SER 25 HG SER 25 -11.930 -4.809 7.096 212 H ASP 26 H ASP 26 -9.758 -4.472 9.930 213 HA ASP 26 HA ASP 26 -10.251 -6.950 11.270 214 HB2 ASP 26 2HB ASP 26 -10.632 -7.669 8.900 215 HB3 ASP 26 3HB ASP 26 -9.008 -7.127 8.492 216 HA PRO 27 HA PRO 27 -6.289 -5.118 12.653 217 HB2 PRO 27 2HB PRO 27 -6.510 -7.043 14.906 218 HB3 PRO 27 3HB PRO 27 -6.471 -5.272 14.942 219 HG2 PRO 27 2HG PRO 27 -8.717 -6.656 15.512 220 HG3 PRO 27 3HG PRO 27 -8.761 -5.065 14.716 221 HD2 PRO 27 2HD PRO 27 -9.043 -7.802 13.479 222 HD3 PRO 27 3HD PRO 27 -9.965 -6.315 13.154 223 H ASN 28 H ASN 28 -7.044 -8.486 12.024 224 HA ASN 28 HA ASN 28 -4.517 -9.688 12.446 225 HB2 ASN 28 2HB ASN 28 -6.692 -10.447 10.446 226 HB3 ASN 28 3HB ASN 28 -5.307 -11.462 10.834 227 HD21 ASN 28 1HD2 ASN 28 -8.247 -11.851 11.157 228 HD22 ASN 28 2HD2 ASN 28 -8.448 -12.287 12.818 229 H VAL 29 H VAL 29 -5.949 -8.139 9.580 230 HA VAL 29 HA VAL 29 -3.755 -8.301 7.816 231 HB VAL 29 HB VAL 29 -5.887 -6.118 8.044 232 HG11 VAL 29 1HG1 VAL 29 -5.328 -5.502 5.723 233 HG12 VAL 29 2HG1 VAL 29 -4.024 -6.690 5.711 234 HG13 VAL 29 3HG1 VAL 29 -3.930 -5.292 6.782 235 HG21 VAL 29 3HG2 VAL 29 -6.855 -8.334 7.615 236 HG22 VAL 29 1HG2 VAL 29 -5.780 -8.560 6.234 237 HG23 VAL 29 2HG2 VAL 29 -7.024 -7.307 6.193 238 H LYS 30 H LYS 30 -1.767 -7.456 8.063 239 HA LYS 30 HA LYS 30 -1.074 -5.821 10.311 240 HB2 LYS 30 2HB LYS 30 0.600 -6.828 7.976 241 HB3 LYS 30 3HB LYS 30 1.265 -5.962 9.363 242 HG2 LYS 30 2HG LYS 30 0.425 -7.759 10.863 243 HG3 LYS 30 3HG LYS 30 -0.153 -8.645 9.447 244 HD2 LYS 30 2HD LYS 30 2.129 -8.899 8.614 245 HD3 LYS 30 3HD LYS 30 2.755 -7.865 9.903 246 HE2 LYS 30 2HE LYS 30 1.432 -10.574 10.299 247 HE3 LYS 30 3HE LYS 30 3.162 -10.249 10.379 248 HZ1 LYS 30 3HZ LYS 30 1.091 -9.156 12.207 249 HZ2 LYS 30 1HZ LYS 30 2.728 -8.744 12.244 250 HZ3 LYS 30 2HZ LYS 30 2.253 -10.329 12.581 251 H THR 31 H THR 31 -0.111 -3.777 10.296 252 HA THR 31 HA THR 31 -0.313 -2.088 7.884 253 HB THR 31 HB THR 31 -1.245 -0.220 9.352 254 HG1 THR 31 HG1 THR 31 -1.729 -2.394 11.141 255 HG21 THR 31 3HG2 THR 31 -3.586 -0.980 9.283 256 HG22 THR 31 1HG2 THR 31 -3.044 -2.639 9.039 257 HG23 THR 31 2HG2 THR 31 -2.733 -1.420 7.800 258 H VAL 32 H VAL 32 1.590 -1.127 7.586 259 HA VAL 32 HA VAL 32 3.344 -0.499 9.895 260 HB VAL 32 HB VAL 32 4.274 -1.369 7.109 261 HG11 VAL 32 1HG1 VAL 32 5.861 -0.906 9.658 262 HG12 VAL 32 2HG1 VAL 32 5.871 0.123 8.225 263 HG13 VAL 32 3HG1 VAL 32 6.522 -1.514 8.138 264 HG21 VAL 32 3HG2 VAL 32 3.212 -3.268 8.274 265 HG22 VAL 32 1HG2 VAL 32 4.259 -3.007 9.671 266 HG23 VAL 32 2HG2 VAL 32 4.952 -3.512 8.129 267 H ARG 33 H ARG 33 3.387 1.667 10.082 268 HA ARG 33 HA ARG 33 3.294 3.395 7.677 269 HB2 ARG 33 2HB ARG 33 1.428 3.800 9.262 270 HB3 ARG 33 3HB ARG 33 2.574 4.034 10.578 271 HG2 ARG 33 2HG ARG 33 3.479 6.039 9.417 272 HG3 ARG 33 3HG ARG 33 2.295 5.815 8.131 273 HD2 ARG 33 2HD ARG 33 0.468 6.342 9.602 274 HD3 ARG 33 3HD ARG 33 1.507 6.244 11.032 275 HE ARG 33 HE ARG 33 2.229 8.251 9.041 276 HH11 ARG 33 1HH1 ARG 33 0.595 7.662 12.093 277 HH12 ARG 33 2HH1 ARG 33 0.655 9.325 12.580 278 HH21 ARG 33 1HH2 ARG 33 2.376 10.401 9.738 279 HH22 ARG 33 2HH2 ARG 33 1.663 10.868 11.248 280 H THR 34 H THR 34 5.423 3.475 7.143 281 HA THR 34 HA THR 34 7.248 5.064 8.707 282 HB THR 34 HB THR 34 7.575 2.775 9.749 283 HG1 THR 34 HG1 THR 34 9.297 4.338 9.601 284 HG21 THR 34 3HG2 THR 34 7.158 1.381 7.737 285 HG22 THR 34 1HG2 THR 34 8.721 1.012 8.462 286 HG23 THR 34 2HG2 THR 34 8.640 1.997 7.002 287 H ASP 35 H ASP 35 9.170 5.600 7.495 288 HA ASP 35 HA ASP 35 8.920 5.555 4.609 289 HB2 ASP 35 2HB ASP 35 9.794 7.589 5.616 290 HB3 ASP 35 3HB ASP 35 11.045 6.698 6.484 291 H ASP 36 H ASP 36 10.450 3.526 7.017 292 HA ASP 36 HA ASP 36 12.944 3.100 5.711 293 HB2 ASP 36 2HB ASP 36 12.662 2.928 8.183 294 HB3 ASP 36 3HB ASP 36 11.647 1.507 7.968 295 H LYS 37 H LYS 37 13.252 1.914 3.960 296 HA LYS 37 HA LYS 37 11.134 0.417 2.779 297 HB2 LYS 37 2HB LYS 37 12.643 0.076 0.887 298 HB3 LYS 37 3HB LYS 37 12.671 1.749 1.424 299 HG2 LYS 37 2HG LYS 37 14.822 1.336 2.583 300 HG3 LYS 37 3HG LYS 37 14.798 -0.328 1.996 301 HD2 LYS 37 2HD LYS 37 16.233 0.916 0.526 302 HD3 LYS 37 3HD LYS 37 14.738 0.592 -0.358 303 HE2 LYS 37 2HE LYS 37 15.591 2.906 -0.687 304 HE3 LYS 37 3HE LYS 37 13.972 2.856 -0.002 305 HZ1 LYS 37 3HZ LYS 37 16.487 3.378 1.486 306 HZ2 LYS 37 1HZ LYS 37 14.949 3.271 2.186 307 HZ3 LYS 37 2HZ LYS 37 15.296 4.507 1.091 308 H GLU 38 H GLU 38 14.134 -0.487 4.454 309 HA GLU 38 HA GLU 38 13.986 -3.268 3.792 310 HB2 GLU 38 2HB GLU 38 15.739 -3.606 5.480 311 HB3 GLU 38 3HB GLU 38 16.138 -2.277 4.403 312 HG2 GLU 38 2HG GLU 38 15.501 -0.658 6.125 313 HG3 GLU 38 3HG GLU 38 15.022 -1.966 7.202 314 H LYS 39 H LYS 39 12.674 -1.259 6.392 315 HA LYS 39 HA LYS 39 11.606 -3.232 8.076 316 HB2 LYS 39 2HB LYS 39 11.598 -0.850 8.680 317 HB3 LYS 39 3HB LYS 39 10.505 -0.486 7.357 318 HG2 LYS 39 2HG LYS 39 8.876 -0.584 8.938 319 HG3 LYS 39 3HG LYS 39 9.003 -2.326 8.754 320 HD2 LYS 39 2HD LYS 39 10.506 -0.700 10.830 321 HD3 LYS 39 3HD LYS 39 8.970 -1.512 11.122 322 HE2 LYS 39 2HE LYS 39 10.497 -3.059 11.983 323 HE3 LYS 39 3HE LYS 39 10.258 -3.681 10.351 324 HZ1 LYS 39 3HZ LYS 39 12.584 -3.669 10.868 325 HZ2 LYS 39 1HZ LYS 39 12.541 -2.041 11.323 326 HZ3 LYS 39 2HZ LYS 39 12.312 -2.478 9.708 327 H VAL 40 H VAL 40 10.128 -1.558 5.273 328 HA VAL 40 HA VAL 40 7.699 -2.948 5.165 329 HB VAL 40 HB VAL 40 9.272 -1.790 2.816 330 HG11 VAL 40 1HG1 VAL 40 6.305 -2.456 2.992 331 HG12 VAL 40 2HG1 VAL 40 7.503 -3.303 2.014 332 HG13 VAL 40 3HG1 VAL 40 7.090 -1.629 1.645 333 HG21 VAL 40 3HG2 VAL 40 8.869 -0.107 4.571 334 HG22 VAL 40 1HG2 VAL 40 7.142 -0.475 4.552 335 HG23 VAL 40 2HG2 VAL 40 7.907 0.252 3.137 336 H LYS 41 H LYS 41 10.848 -3.756 3.678 337 HA LYS 41 HA LYS 41 10.046 -6.003 2.154 338 HB2 LYS 41 2HB LYS 41 12.768 -5.298 3.322 339 HB3 LYS 41 3HB LYS 41 12.498 -6.624 2.190 340 HG2 LYS 41 2HG LYS 41 11.750 -5.060 0.473 341 HG3 LYS 41 3HG LYS 41 11.928 -3.705 1.597 342 HD2 LYS 41 2HD LYS 41 14.362 -4.184 1.765 343 HD3 LYS 41 3HD LYS 41 14.173 -5.515 0.621 344 HE2 LYS 41 2HE LYS 41 13.417 -3.896 -1.099 345 HE3 LYS 41 3HE LYS 41 13.676 -2.579 0.052 346 HZ1 LYS 41 3HZ LYS 41 15.533 -2.918 -1.503 347 HZ2 LYS 41 1HZ LYS 41 15.791 -4.454 -0.858 348 HZ3 LYS 41 2HZ LYS 41 16.000 -3.084 0.109 349 H GLU 42 H GLU 42 11.298 -5.727 5.481 350 HA GLU 42 HA GLU 42 11.409 -8.438 6.191 351 HB2 GLU 42 2HB GLU 42 10.764 -5.989 7.892 352 HB3 GLU 42 3HB GLU 42 10.967 -7.601 8.577 353 HG2 GLU 42 2HG GLU 42 13.277 -7.684 7.891 354 HG3 GLU 42 3HG GLU 42 13.111 -6.197 6.963 355 H GLU 43 H GLU 43 8.760 -6.095 6.460 356 HA GLU 43 HA GLU 43 6.949 -7.933 7.640 357 HB2 GLU 43 2HB GLU 43 6.409 -5.198 6.430 358 HB3 GLU 43 3HB GLU 43 5.316 -6.098 7.476 359 HG2 GLU 43 2HG GLU 43 7.982 -4.883 8.210 360 HG3 GLU 43 3HG GLU 43 6.395 -4.462 8.842 361 H ILE 44 H ILE 44 7.571 -7.110 4.279 362 HA ILE 44 HA ILE 44 5.347 -8.229 3.000 363 HB ILE 44 HB ILE 44 8.275 -8.105 2.166 364 HG12 ILE 44 2HG1 ILE 44 5.826 -6.593 1.142 365 HG13 ILE 44 3HG1 ILE 44 7.034 -5.947 2.246 366 HG21 ILE 44 1HG2 ILE 44 7.663 -8.788 -0.131 367 HG22 ILE 44 2HG2 ILE 44 6.011 -9.105 0.403 368 HG23 ILE 44 3HG2 ILE 44 7.337 -10.083 1.028 369 HD11 ILE 44 3HD1 ILE 44 7.389 -5.122 0.014 370 HD12 ILE 44 1HD1 ILE 44 7.504 -6.765 -0.618 371 HD13 ILE 44 2HD1 ILE 44 8.733 -6.155 0.494 372 H GLU 45 H GLU 45 8.192 -9.798 4.445 373 HA GLU 45 HA GLU 45 7.684 -12.486 3.767 374 HB2 GLU 45 2HB GLU 45 9.845 -11.923 4.694 375 HB3 GLU 45 3HB GLU 45 9.108 -11.287 6.159 376 HG2 GLU 45 2HG GLU 45 8.359 -13.550 6.790 377 HG3 GLU 45 3HG GLU 45 9.070 -14.203 5.311 378 H LYS 46 H LYS 46 6.722 -10.554 6.575 379 HA LYS 46 HA LYS 46 5.390 -12.659 7.949 380 HB2 LYS 46 2HB LYS 46 5.236 -9.635 8.288 381 HB3 LYS 46 3HB LYS 46 4.385 -10.770 9.331 382 HG2 LYS 46 2HG LYS 46 6.334 -10.277 10.548 383 HG3 LYS 46 3HG LYS 46 6.698 -11.831 9.787 384 HD2 LYS 46 2HD LYS 46 8.020 -10.723 8.067 385 HD3 LYS 46 3HD LYS 46 7.578 -9.140 8.704 386 HE2 LYS 46 2HE LYS 46 9.229 -11.216 10.177 387 HE3 LYS 46 3HE LYS 46 9.870 -9.806 9.333 388 HZ1 LYS 46 3HZ LYS 46 8.081 -9.774 11.694 389 HZ2 LYS 46 1HZ LYS 46 8.571 -8.401 10.838 390 HZ3 LYS 46 2HZ LYS 46 9.717 -9.341 11.649 391 H ALA 47 H ALA 47 4.335 -10.368 5.531 392 HA ALA 47 HA ALA 47 1.533 -10.615 5.713 393 HB1 ALA 47 3HB ALA 47 1.499 -9.769 3.403 394 HB2 ALA 47 1HB ALA 47 3.233 -10.088 3.250 395 HB3 ALA 47 2HB ALA 47 2.656 -8.869 4.385 396 H ARG 48 H ARG 48 3.856 -12.342 3.584 397 HA ARG 48 HA ARG 48 1.886 -14.160 2.533 398 HB2 ARG 48 2HB ARG 48 3.699 -15.196 1.321 399 HB3 ARG 48 3HB ARG 48 3.895 -13.451 1.244 400 HG2 ARG 48 2HG ARG 48 5.655 -13.585 2.994 401 HG3 ARG 48 3HG ARG 48 5.467 -15.340 3.030 402 HD2 ARG 48 2HD ARG 48 6.454 -13.649 0.713 403 HD3 ARG 48 3HD ARG 48 7.386 -14.804 1.673 404 HE ARG 48 HE ARG 48 5.190 -16.128 0.483 405 HH11 ARG 48 1HH1 ARG 48 8.294 -14.756 -0.403 406 HH12 ARG 48 2HH1 ARG 48 8.484 -15.796 -1.778 407 HH21 ARG 48 1HH2 ARG 48 5.410 -17.416 -1.363 408 HH22 ARG 48 2HH2 ARG 48 6.855 -17.305 -2.328 409 H LYS 49 H LYS 49 4.075 -14.176 5.206 410 HA LYS 49 HA LYS 49 4.260 -16.931 5.812 411 HB2 LYS 49 2HB LYS 49 5.735 -15.122 6.702 412 HB3 LYS 49 3HB LYS 49 4.396 -14.510 7.663 413 HG2 LYS 49 2HG LYS 49 4.398 -16.553 9.012 414 HG3 LYS 49 3HG LYS 49 5.665 -17.247 7.989 415 HD2 LYS 49 2HD LYS 49 7.161 -15.313 8.647 416 HD3 LYS 49 3HD LYS 49 5.908 -14.798 9.782 417 HE2 LYS 49 2HE LYS 49 7.690 -16.075 10.909 418 HE3 LYS 49 3HE LYS 49 6.141 -16.921 11.010 419 HZ1 LYS 49 3HZ LYS 49 8.021 -18.376 10.444 420 HZ2 LYS 49 1HZ LYS 49 8.261 -17.516 9.010 421 HZ3 LYS 49 2HZ LYS 49 6.828 -18.384 9.252 422 H GLN 50 H GLN 50 2.009 -14.388 6.785 423 HA GLN 50 HA GLN 50 0.242 -16.273 8.194 424 HB2 GLN 50 2HB GLN 50 0.095 -13.246 7.856 425 HB3 GLN 50 3HB GLN 50 -0.991 -14.213 8.848 426 HG2 GLN 50 2HG GLN 50 1.991 -13.936 9.284 427 HG3 GLN 50 3HG GLN 50 0.743 -13.079 10.186 428 HE21 GLN 50 1HE2 GLN 50 2.829 -14.963 11.126 429 HE22 GLN 50 2HE2 GLN 50 1.979 -16.224 11.950 430 H GLY 51 H GLY 51 0.673 -15.046 5.071 431 HA2 GLY 51 2HA GLY 51 -0.513 -15.217 3.128 432 HA3 GLY 51 3HA GLY 51 -1.675 -16.227 3.972 433 H ARG 52 H ARG 52 -1.042 -13.053 5.205 434 HA ARG 52 HA ARG 52 -3.815 -12.241 4.601 435 HB2 ARG 52 2HB ARG 52 -1.818 -11.053 6.581 436 HB3 ARG 52 3HB ARG 52 -3.527 -10.641 6.448 437 HG2 ARG 52 2HG ARG 52 -4.166 -12.870 7.199 438 HG3 ARG 52 3HG ARG 52 -2.472 -13.371 7.232 439 HD2 ARG 52 2HD ARG 52 -2.096 -11.487 8.924 440 HD3 ARG 52 3HD ARG 52 -3.858 -11.367 9.029 441 HE ARG 52 HE ARG 52 -3.326 -14.017 9.443 442 HH11 ARG 52 1HH1 ARG 52 -2.305 -11.036 11.021 443 HH12 ARG 52 2HH1 ARG 52 -2.088 -11.791 12.568 444 HH21 ARG 52 1HH2 ARG 52 -2.963 -14.997 11.442 445 HH22 ARG 52 2HH2 ARG 52 -2.464 -14.047 12.808 446 HA PRO 53 HA PRO 53 -2.330 -8.625 2.199 447 HB2 PRO 53 2HB PRO 53 -4.471 -7.044 3.584 448 HB3 PRO 53 3HB PRO 53 -4.201 -7.288 1.843 449 HG2 PRO 53 2HG PRO 53 -6.243 -8.491 3.101 450 HG3 PRO 53 3HG PRO 53 -5.351 -9.309 1.795 451 HD2 PRO 53 2HD PRO 53 -5.106 -9.700 4.778 452 HD3 PRO 53 3HD PRO 53 -5.110 -10.912 3.473 453 H ILE 54 H ILE 54 -1.089 -6.762 2.647 454 HA ILE 54 HA ILE 54 -0.748 -5.928 5.465 455 HB ILE 54 HB ILE 54 1.192 -7.323 4.930 456 HG12 ILE 54 2HG1 ILE 54 1.848 -4.345 5.010 457 HG13 ILE 54 3HG1 ILE 54 1.596 -5.403 6.394 458 HG21 ILE 54 1HG2 ILE 54 2.771 -6.805 3.116 459 HG22 ILE 54 2HG2 ILE 54 1.733 -5.487 2.572 460 HG23 ILE 54 3HG2 ILE 54 1.165 -7.155 2.468 461 HD11 ILE 54 3HD1 ILE 54 3.875 -5.531 4.435 462 HD12 ILE 54 1HD1 ILE 54 3.618 -6.639 5.787 463 HD13 ILE 54 2HD1 ILE 54 3.921 -4.930 6.090 464 H VAL 55 H VAL 55 -0.599 -3.724 5.735 465 HA VAL 55 HA VAL 55 -1.201 -2.129 3.332 466 HB VAL 55 HB VAL 55 -2.358 -1.505 6.071 467 HG11 VAL 55 1HG1 VAL 55 -3.276 -0.857 3.247 468 HG12 VAL 55 2HG1 VAL 55 -2.456 0.256 4.351 469 HG13 VAL 55 3HG1 VAL 55 -4.072 -0.340 4.738 470 HG21 VAL 55 3HG2 VAL 55 -3.056 -3.810 5.581 471 HG22 VAL 55 1HG2 VAL 55 -3.621 -3.322 3.982 472 HG23 VAL 55 2HG2 VAL 55 -4.427 -2.712 5.427 473 H ILE 56 H ILE 56 0.477 -0.854 2.917 474 HA ILE 56 HA ILE 56 2.250 0.088 5.080 475 HB ILE 56 HB ILE 56 2.683 0.142 2.049 476 HG12 ILE 56 2HG1 ILE 56 2.586 -2.194 2.886 477 HG13 ILE 56 3HG1 ILE 56 4.222 -1.784 2.384 478 HG21 ILE 56 1HG2 ILE 56 4.004 1.883 3.162 479 HG22 ILE 56 2HG2 ILE 56 5.070 0.595 2.598 480 HG23 ILE 56 3HG2 ILE 56 4.648 0.701 4.308 481 HD11 ILE 56 3HD1 ILE 56 4.251 -3.090 4.406 482 HD12 ILE 56 1HD1 ILE 56 3.206 -1.929 5.222 483 HD13 ILE 56 2HD1 ILE 56 4.845 -1.465 4.750 484 H PHE 57 H PHE 57 1.759 2.067 5.863 485 HA PHE 57 HA PHE 57 0.382 4.064 4.188 486 HB2 PHE 57 2HB PHE 57 0.770 3.802 7.189 487 HB3 PHE 57 3HB PHE 57 0.146 5.277 6.456 488 HD1 PHE 57 HD2 PHE 57 -0.578 1.676 7.053 489 HD2 PHE 57 HD1 PHE 57 -2.093 5.404 5.605 490 HE1 PHE 57 HE2 PHE 57 -2.860 0.753 7.003 491 HE2 PHE 57 HE1 PHE 57 -4.355 4.467 5.571 492 HZ PHE 57 HZ PHE 57 -4.731 2.149 6.235 493 H ILE 58 H ILE 58 1.655 5.343 3.086 494 HA ILE 58 HA ILE 58 3.851 6.833 4.373 495 HB ILE 58 HB ILE 58 5.168 6.645 2.169 496 HG12 ILE 58 2HG1 ILE 58 3.251 4.322 1.690 497 HG13 ILE 58 3HG1 ILE 58 3.366 5.796 0.734 498 HG21 ILE 58 1HG2 ILE 58 4.880 4.077 3.769 499 HG22 ILE 58 2HG2 ILE 58 5.891 5.455 4.208 500 HG23 ILE 58 3HG2 ILE 58 6.257 4.521 2.757 501 HD11 ILE 58 3HD1 ILE 58 4.440 4.045 -0.429 502 HD12 ILE 58 1HD1 ILE 58 5.426 3.624 0.970 503 HD13 ILE 58 2HD1 ILE 58 5.681 5.160 0.137 504 H ARG 59 H ARG 59 4.327 8.838 3.269 505 HA ARG 59 HA ARG 59 1.974 10.087 2.055 506 HB2 ARG 59 2HB ARG 59 3.309 11.128 3.957 507 HB3 ARG 59 3HB ARG 59 4.641 11.352 2.832 508 HG2 ARG 59 2HG ARG 59 3.159 12.823 1.443 509 HG3 ARG 59 3HG ARG 59 1.894 12.639 2.660 510 HD2 ARG 59 2HD ARG 59 3.344 13.687 4.357 511 HD3 ARG 59 3HD ARG 59 4.643 13.841 3.167 512 HE ARG 59 HE ARG 59 2.335 15.119 2.183 513 HH11 ARG 59 1HH1 ARG 59 4.774 15.597 4.686 514 HH12 ARG 59 2HH1 ARG 59 4.606 17.325 4.680 515 HH21 ARG 59 1HH2 ARG 59 2.101 17.360 2.217 516 HH22 ARG 59 2HH2 ARG 59 3.086 18.323 3.275 517 H GLY 60 H GLY 60 2.288 11.542 0.123 518 HA2 GLY 60 2HA GLY 60 3.041 10.189 -2.157 519 HA3 GLY 60 3HA GLY 60 2.827 11.925 -2.073 520 H ALA 61 H ALA 61 5.166 12.115 -0.156 521 HA ALA 61 HA ALA 61 7.331 12.393 -2.017 522 HB1 ALA 61 3HB ALA 61 7.340 12.499 1.023 523 HB2 ALA 61 1HB ALA 61 7.101 13.868 -0.061 524 HB3 ALA 61 2HB ALA 61 8.657 13.036 -0.027 525 H TYR 62 H TYR 62 6.719 10.245 0.739 526 HA TYR 62 HA TYR 62 9.026 8.613 0.517 527 HB2 TYR 62 2HB TYR 62 6.380 7.947 1.882 528 HB3 TYR 62 3HB TYR 62 7.936 7.180 2.192 529 HD1 TYR 62 HD2 TYR 62 9.881 9.102 2.697 530 HD2 TYR 62 HD1 TYR 62 5.712 9.438 3.562 531 HE1 TYR 62 HE2 TYR 62 10.372 10.771 4.422 532 HE2 TYR 62 HE1 TYR 62 6.206 11.115 5.289 533 HH TYR 62 HH TYR 62 9.279 12.566 5.602 534 H GLU 63 H GLU 63 5.978 8.563 -1.106 535 HA GLU 63 HA GLU 63 5.419 5.924 -1.593 536 HB2 GLU 63 2HB GLU 63 3.923 7.789 -2.111 537 HB3 GLU 63 3HB GLU 63 4.965 8.287 -3.445 538 HG2 GLU 63 2HG GLU 63 4.511 6.038 -4.518 539 HG3 GLU 63 3HG GLU 63 3.350 5.726 -3.234 540 H GLU 64 H GLU 64 7.746 7.947 -3.354 541 HA GLU 64 HA GLU 64 8.049 6.414 -5.658 542 HB2 GLU 64 2HB GLU 64 10.003 7.695 -6.160 543 HB3 GLU 64 3HB GLU 64 8.892 8.758 -5.315 544 HG2 GLU 64 2HG GLU 64 10.856 9.382 -4.286 545 HG3 GLU 64 3HG GLU 64 10.374 8.087 -3.191 546 H VAL 65 H VAL 65 9.345 5.863 -2.481 547 HA VAL 65 HA VAL 65 11.509 4.172 -3.001 548 HB VAL 65 HB VAL 65 9.668 4.125 -0.569 549 HG11 VAL 65 1HG1 VAL 65 11.569 3.153 0.644 550 HG12 VAL 65 2HG1 VAL 65 12.474 3.076 -0.870 551 HG13 VAL 65 3HG1 VAL 65 11.012 2.111 -0.670 552 HG21 VAL 65 3HG2 VAL 65 12.237 5.692 -0.986 553 HG22 VAL 65 1HG2 VAL 65 11.296 5.641 0.510 554 HG23 VAL 65 2HG2 VAL 65 10.614 6.381 -0.943 555 H VAL 66 H VAL 66 8.029 3.448 -2.770 556 HA VAL 66 HA VAL 66 8.129 0.668 -2.462 557 HB VAL 66 HB VAL 66 5.935 2.301 -3.811 558 HG11 VAL 66 1HG1 VAL 66 5.776 -0.579 -2.799 559 HG12 VAL 66 2HG1 VAL 66 5.712 -0.075 -4.488 560 HG13 VAL 66 3HG1 VAL 66 4.412 0.379 -3.386 561 HG21 VAL 66 3HG2 VAL 66 4.813 2.140 -1.623 562 HG22 VAL 66 1HG2 VAL 66 6.382 2.932 -1.488 563 HG23 VAL 66 2HG2 VAL 66 6.198 1.254 -0.976 564 H ARG 67 H ARG 67 8.526 2.601 -5.348 565 HA ARG 67 HA ARG 67 8.197 0.848 -7.469 566 HB2 ARG 67 2HB ARG 67 8.774 3.161 -7.839 567 HB3 ARG 67 3HB ARG 67 10.237 3.022 -6.877 568 HG2 ARG 67 2HG ARG 67 11.091 1.433 -8.760 569 HG3 ARG 67 3HG ARG 67 9.762 2.096 -9.720 570 HD2 ARG 67 2HD ARG 67 11.845 3.343 -10.145 571 HD3 ARG 67 3HD ARG 67 10.657 4.388 -9.354 572 HE ARG 67 HE ARG 67 12.811 3.023 -7.833 573 HH11 ARG 67 1HH1 ARG 67 11.126 6.015 -8.619 574 HH12 ARG 67 2HH1 ARG 67 11.981 6.942 -7.422 575 HH21 ARG 67 1HH2 ARG 67 13.859 4.241 -6.229 576 HH22 ARG 67 2HH2 ARG 67 13.520 5.942 -6.076 577 H ASP 68 H ASP 68 11.017 1.212 -5.329 578 HA ASP 68 HA ASP 68 12.619 -0.842 -6.562 579 HB2 ASP 68 2HB ASP 68 12.992 0.518 -3.858 580 HB3 ASP 68 3HB ASP 68 14.220 -0.373 -4.759 581 H ILE 69 H ILE 69 10.598 -0.566 -3.694 582 HA ILE 69 HA ILE 69 11.116 -3.056 -2.470 583 HB ILE 69 HB ILE 69 8.592 -1.343 -2.287 584 HG12 ILE 69 2HG1 ILE 69 11.077 -1.324 -0.502 585 HG13 ILE 69 3HG1 ILE 69 10.675 -0.091 -1.693 586 HG21 ILE 69 1HG2 ILE 69 8.187 -2.440 -0.109 587 HG22 ILE 69 2HG2 ILE 69 9.599 -3.466 -0.356 588 HG23 ILE 69 3HG2 ILE 69 8.203 -3.624 -1.420 589 HD11 ILE 69 3HD1 ILE 69 9.092 -0.742 0.792 590 HD12 ILE 69 1HD1 ILE 69 8.661 0.471 -0.418 591 HD13 ILE 69 2HD1 ILE 69 10.132 0.658 0.532 592 H VAL 70 H VAL 70 8.999 -2.148 -5.119 593 HA VAL 70 HA VAL 70 7.239 -4.285 -5.371 594 HB VAL 70 HB VAL 70 8.556 -2.559 -7.529 595 HG11 VAL 70 1HG1 VAL 70 6.862 -3.416 -9.137 596 HG12 VAL 70 2HG1 VAL 70 6.322 -4.582 -7.927 597 HG13 VAL 70 3HG1 VAL 70 7.953 -4.694 -8.589 598 HG21 VAL 70 3HG2 VAL 70 5.741 -2.533 -6.393 599 HG22 VAL 70 1HG2 VAL 70 6.325 -1.471 -7.675 600 HG23 VAL 70 2HG2 VAL 70 6.997 -1.358 -6.052 601 H GLU 71 H GLU 71 10.561 -3.885 -6.600 602 HA GLU 71 HA GLU 71 10.902 -6.214 -8.059 603 HB2 GLU 71 2HB GLU 71 12.555 -4.394 -8.079 604 HB3 GLU 71 3HB GLU 71 12.965 -4.705 -6.392 605 HG2 GLU 71 2HG GLU 71 13.749 -7.013 -7.099 606 HG3 GLU 71 3HG GLU 71 13.505 -6.522 -8.772 607 H TYR 72 H TYR 72 11.524 -5.663 -4.585 608 HA TYR 72 HA TYR 72 12.458 -8.192 -3.846 609 HB2 TYR 72 2HB TYR 72 12.596 -6.213 -2.349 610 HB3 TYR 72 3HB TYR 72 10.846 -6.201 -2.173 611 HD1 TYR 72 HD2 TYR 72 9.714 -7.921 -0.748 612 HD2 TYR 72 HD1 TYR 72 13.970 -7.876 -1.143 613 HE1 TYR 72 HE2 TYR 72 9.898 -9.474 1.143 614 HE2 TYR 72 HE1 TYR 72 14.154 -9.421 0.752 615 HH TYR 72 HH TYR 72 11.514 -11.133 1.999 616 H ALA 73 H ALA 73 9.132 -6.895 -3.771 617 HA ALA 73 HA ALA 73 7.844 -9.194 -2.772 618 HB1 ALA 73 3HB ALA 73 6.854 -6.959 -2.640 619 HB2 ALA 73 1HB ALA 73 5.759 -8.083 -3.448 620 HB3 ALA 73 2HB ALA 73 6.686 -6.916 -4.398 621 H GLN 74 H GLN 74 8.692 -8.237 -6.071 622 HA GLN 74 HA GLN 74 7.159 -10.287 -7.390 623 HB2 GLN 74 2HB GLN 74 9.505 -8.631 -8.425 624 HB3 GLN 74 3HB GLN 74 8.516 -9.705 -9.415 625 HG2 GLN 74 2HG GLN 74 6.509 -8.315 -8.826 626 HG3 GLN 74 3HG GLN 74 7.581 -7.196 -7.988 627 HE21 GLN 74 1HE2 GLN 74 5.858 -6.613 -10.243 628 HE22 GLN 74 2HE2 GLN 74 6.896 -6.069 -11.511 629 H LYS 75 H LYS 75 10.433 -10.070 -6.040 630 HA LYS 75 HA LYS 75 11.359 -12.613 -6.992 631 HB2 LYS 75 2HB LYS 75 12.254 -11.167 -4.453 632 HB3 LYS 75 3HB LYS 75 13.119 -12.465 -5.269 633 HG2 LYS 75 2HG LYS 75 12.701 -9.629 -6.223 634 HG3 LYS 75 3HG LYS 75 14.225 -10.411 -5.810 635 HD2 LYS 75 2HD LYS 75 14.004 -11.892 -7.785 636 HD3 LYS 75 3HD LYS 75 12.453 -11.144 -8.178 637 HE2 LYS 75 2HE LYS 75 13.582 -8.987 -8.548 638 HE3 LYS 75 3HE LYS 75 15.137 -9.720 -8.145 639 HZ1 LYS 75 3HZ LYS 75 14.954 -9.690 -10.486 640 HZ2 LYS 75 1HZ LYS 75 13.397 -10.346 -10.450 641 HZ3 LYS 75 2HZ LYS 75 14.721 -11.294 -10.014 642 H GLU 76 H GLU 76 9.495 -11.524 -4.236 643 HA GLU 76 HA GLU 76 9.229 -14.036 -2.903 644 HB2 GLU 76 2HB GLU 76 7.508 -11.522 -2.777 645 HB3 GLU 76 3HB GLU 76 7.377 -12.884 -1.673 646 HG2 GLU 76 2HG GLU 76 9.793 -11.085 -1.973 647 HG3 GLU 76 3HG GLU 76 8.599 -11.006 -0.679 648 H GLY 77 H GLY 77 7.752 -12.624 -5.696 649 HA2 GLY 77 2HA GLY 77 6.285 -13.491 -7.242 650 HA3 GLY 77 3HA GLY 77 6.177 -14.963 -6.286 651 H LEU 78 H LEU 78 5.572 -11.974 -4.691 652 HA LEU 78 HA LEU 78 2.802 -12.724 -4.163 653 HB2 LEU 78 2HB LEU 78 4.481 -10.456 -3.007 654 HB3 LEU 78 3HB LEU 78 2.885 -10.938 -2.448 655 HG LEU 78 HG LEU 78 5.429 -12.583 -2.236 656 HD11 LEU 78 1HD1 LEU 78 5.364 -10.714 -0.676 657 HD12 LEU 78 2HD1 LEU 78 5.207 -12.250 0.171 658 HD13 LEU 78 3HD1 LEU 78 3.782 -11.236 -0.081 659 HD21 LEU 78 3HD2 LEU 78 3.543 -14.087 -2.623 660 HD22 LEU 78 1HD2 LEU 78 2.622 -13.316 -1.327 661 HD23 LEU 78 2HD2 LEU 78 4.093 -14.219 -0.956 662 H ARG 79 H ARG 79 1.246 -10.904 -3.955 663 HA ARG 79 HA ARG 79 0.931 -9.541 -6.485 664 HB2 ARG 79 2HB ARG 79 -0.834 -10.790 -4.847 665 HB3 ARG 79 3HB ARG 79 -0.966 -9.191 -4.145 666 HG2 ARG 79 2HG ARG 79 -1.513 -9.913 -7.028 667 HG3 ARG 79 3HG ARG 79 -2.734 -9.657 -5.786 668 HD2 ARG 79 2HD ARG 79 -2.097 -7.282 -5.626 669 HD3 ARG 79 3HD ARG 79 -0.809 -7.533 -6.815 670 HE ARG 79 HE ARG 79 -3.651 -8.035 -7.455 671 HH11 ARG 79 1HH1 ARG 79 -0.630 -6.385 -8.255 672 HH12 ARG 79 2HH1 ARG 79 -1.243 -5.808 -9.771 673 HH21 ARG 79 1HH2 ARG 79 -4.355 -7.340 -9.449 674 HH22 ARG 79 2HH2 ARG 79 -3.339 -6.348 -10.442 675 H VAL 80 H VAL 80 1.618 -7.425 -6.775 676 HA VAL 80 HA VAL 80 1.998 -5.680 -4.410 677 HB VAL 80 HB VAL 80 3.089 -5.110 -7.199 678 HG11 VAL 80 1HG1 VAL 80 3.857 -4.031 -4.460 679 HG12 VAL 80 2HG1 VAL 80 2.927 -3.175 -5.690 680 HG13 VAL 80 3HG1 VAL 80 4.618 -3.581 -5.989 681 HG21 VAL 80 3HG2 VAL 80 5.289 -5.987 -6.475 682 HG22 VAL 80 1HG2 VAL 80 4.060 -7.257 -6.502 683 HG23 VAL 80 2HG2 VAL 80 4.564 -6.552 -4.967 684 H LEU 81 H LEU 81 0.486 -4.189 -4.120 685 HA LEU 81 HA LEU 81 -1.074 -3.038 -6.341 686 HB2 LEU 81 2HB LEU 81 -2.273 -5.029 -5.298 687 HB3 LEU 81 3HB LEU 81 -2.283 -4.159 -3.774 688 HG LEU 81 HG LEU 81 -3.710 -2.391 -4.797 689 HD11 LEU 81 1HD1 LEU 81 -3.658 -4.162 -7.247 690 HD12 LEU 81 2HD1 LEU 81 -2.975 -2.539 -7.098 691 HD13 LEU 81 3HD1 LEU 81 -4.720 -2.771 -7.013 692 HD21 LEU 81 3HD2 LEU 81 -5.782 -3.712 -4.947 693 HD22 LEU 81 1HD2 LEU 81 -4.774 -4.249 -3.602 694 HD23 LEU 81 2HD2 LEU 81 -4.834 -5.195 -5.090 695 H VAL 82 H VAL 82 -0.694 -0.818 -6.095 696 HA VAL 82 HA VAL 82 -0.424 0.249 -3.326 697 HB VAL 82 HB VAL 82 0.257 1.661 -5.944 698 HG11 VAL 82 1HG1 VAL 82 0.931 2.429 -3.084 699 HG12 VAL 82 2HG1 VAL 82 -0.232 3.240 -4.132 700 HG13 VAL 82 3HG1 VAL 82 1.487 3.279 -4.529 701 HG21 VAL 82 3HG2 VAL 82 2.629 1.200 -5.458 702 HG22 VAL 82 1HG2 VAL 82 1.719 -0.301 -5.653 703 HG23 VAL 82 2HG2 VAL 82 2.166 0.260 -4.039 704 H ILE 83 H ILE 83 -2.333 0.948 -2.516 705 HA ILE 83 HA ILE 83 -4.431 2.036 -4.304 706 HB ILE 83 HB ILE 83 -4.629 1.219 -1.358 707 HG12 ILE 83 2HG1 ILE 83 -5.583 -0.378 -3.781 708 HG13 ILE 83 3HG1 ILE 83 -4.096 -0.720 -2.902 709 HG21 ILE 83 1HG2 ILE 83 -6.350 2.861 -2.020 710 HG22 ILE 83 2HG2 ILE 83 -7.082 1.286 -1.702 711 HG23 ILE 83 3HG2 ILE 83 -6.835 1.825 -3.365 712 HD11 ILE 83 3HD1 ILE 83 -5.378 -1.219 -0.897 713 HD12 ILE 83 1HD1 ILE 83 -5.884 -2.217 -2.258 714 HD13 ILE 83 2HD1 ILE 83 -6.884 -0.855 -1.749 715 H LYS 84 H LYS 84 -4.193 4.233 -4.494 716 HA LYS 84 HA LYS 84 -3.400 5.839 -2.162 717 HB2 LYS 84 2HB LYS 84 -1.659 7.013 -3.607 718 HB3 LYS 84 3HB LYS 84 -1.289 5.391 -3.061 719 HG2 LYS 84 2HG LYS 84 -0.512 5.293 -5.213 720 HG3 LYS 84 3HG LYS 84 -2.149 4.678 -5.446 721 HD2 LYS 84 2HD LYS 84 -2.879 6.648 -6.505 722 HD3 LYS 84 3HD LYS 84 -1.606 7.634 -5.776 723 HE2 LYS 84 2HE LYS 84 -1.162 5.534 -7.924 724 HE3 LYS 84 3HE LYS 84 -1.259 7.274 -8.199 725 HZ1 LYS 84 3HZ LYS 84 0.690 7.557 -6.742 726 HZ2 LYS 84 1HZ LYS 84 1.046 6.571 -8.070 727 HZ3 LYS 84 2HZ LYS 84 0.797 5.888 -6.544 728 H VAL 85 H VAL 85 -4.005 7.890 -2.125 729 HA VAL 85 HA VAL 85 -6.248 8.714 -3.740 730 HB VAL 85 HB VAL 85 -4.761 10.196 -1.504 731 HG11 VAL 85 1HG1 VAL 85 -7.506 10.775 -2.670 732 HG12 VAL 85 2HG1 VAL 85 -6.053 11.749 -2.902 733 HG13 VAL 85 3HG1 VAL 85 -6.775 11.613 -1.297 734 HG21 VAL 85 3HG2 VAL 85 -6.548 9.475 0.021 735 HG22 VAL 85 1HG2 VAL 85 -5.693 8.088 -0.665 736 HG23 VAL 85 2HG2 VAL 85 -7.287 8.536 -1.277 737 H ALA 86 H ALA 86 -5.746 9.474 -5.729 738 HA ALA 86 HA ALA 86 -3.262 10.313 -6.607 739 HB1 ALA 86 3HB ALA 86 -5.929 10.957 -7.881 740 HB2 ALA 86 1HB ALA 86 -4.996 9.479 -8.126 741 HB3 ALA 86 2HB ALA 86 -4.347 11.026 -8.669 742 H GLN 87 H GLN 87 -6.137 12.355 -6.077 743 HA GLN 87 HA GLN 87 -6.445 14.422 -5.228 744 HB2 GLN 87 2HB GLN 87 -5.087 13.203 -3.397 745 HB3 GLN 87 3HB GLN 87 -3.687 14.095 -3.969 746 HG2 GLN 87 2HG GLN 87 -4.850 16.222 -3.408 747 HG3 GLN 87 3HG GLN 87 -6.211 15.284 -2.789 748 HE21 GLN 87 1HE2 GLN 87 -4.376 17.168 -1.448 749 HE22 GLN 87 2HE2 GLN 87 -3.703 16.307 -0.118 750 H ASP 88 H ASP 88 -4.873 14.035 -7.796 751 HA ASP 88 HA ASP 88 -3.621 15.027 -9.372 752 HB2 ASP 88 2HB ASP 88 -5.589 16.569 -9.272 753 HB3 ASP 88 3HB ASP 88 -4.719 17.589 -8.131 754 H GLN 89 H GLN 89 -1.628 14.262 -8.454 755 HA GLN 89 HA GLN 89 0.185 16.338 -7.359 756 HB2 GLN 89 2HB GLN 89 -0.090 13.497 -6.244 757 HB3 GLN 89 3HB GLN 89 1.121 14.668 -5.744 758 HG2 GLN 89 2HG GLN 89 -1.870 14.950 -5.346 759 HG3 GLN 89 3HG GLN 89 -0.715 14.458 -4.107 760 HE21 GLN 89 1HE2 GLN 89 -2.571 16.770 -4.264 761 HE22 GLN 89 2HE2 GLN 89 -1.583 18.167 -4.018 762 H GLU 90 H GLU 90 1.927 16.429 -8.676 763 HA GLU 90 HA GLU 90 2.195 14.833 -10.973 764 HB2 GLU 90 2HB GLU 90 2.917 17.166 -10.913 765 HB3 GLU 90 3HB GLU 90 4.153 16.797 -9.711 766 HG2 GLU 90 2HG GLU 90 5.301 15.336 -11.396 767 HG3 GLU 90 3HG GLU 90 4.103 15.824 -12.596 768 H LEU 91 H LEU 91 4.143 14.867 -7.986 769 HA LEU 91 HA LEU 91 6.148 13.019 -8.768 770 HB2 LEU 91 2HB LEU 91 5.137 13.892 -6.033 771 HB3 LEU 91 3HB LEU 91 6.434 12.724 -6.204 772 HG LEU 91 HG LEU 91 7.358 14.930 -5.734 773 HD11 LEU 91 1HD1 LEU 91 8.984 15.128 -7.540 774 HD12 LEU 91 2HD1 LEU 91 7.984 14.121 -8.588 775 HD13 LEU 91 3HD1 LEU 91 8.700 13.438 -7.125 776 HD21 LEU 91 3HD2 LEU 91 5.588 16.378 -6.620 777 HD22 LEU 91 1HD2 LEU 91 6.022 15.939 -8.274 778 HD23 LEU 91 2HD2 LEU 91 7.158 16.846 -7.270 779 H LEU 92 H LEU 92 3.021 12.683 -7.310 780 HA LEU 92 HA LEU 92 3.092 9.899 -6.757 781 HB2 LEU 92 2HB LEU 92 1.664 11.276 -5.463 782 HB3 LEU 92 3HB LEU 92 0.939 12.015 -6.870 783 HG LEU 92 HG LEU 92 0.435 9.066 -6.393 784 HD11 LEU 92 1HD1 LEU 92 -1.034 11.267 -4.898 785 HD12 LEU 92 2HD1 LEU 92 0.034 10.057 -4.183 786 HD13 LEU 92 3HD1 LEU 92 -1.479 9.556 -4.932 787 HD21 LEU 92 3HD2 LEU 92 -0.427 10.094 -8.474 788 HD22 LEU 92 1HD2 LEU 92 -1.312 11.297 -7.530 789 HD23 LEU 92 2HD2 LEU 92 -1.758 9.591 -7.434 790 H GLU 93 H GLU 93 2.023 11.876 -9.464 791 HA GLU 93 HA GLU 93 0.798 9.800 -11.007 792 HB2 GLU 93 2HB GLU 93 1.764 12.606 -11.681 793 HB3 GLU 93 3HB GLU 93 0.984 11.566 -12.872 794 HG2 GLU 93 2HG GLU 93 -1.073 11.521 -11.574 795 HG3 GLU 93 3HG GLU 93 -0.305 12.381 -10.246 796 H ARG 94 H ARG 94 4.059 11.011 -10.667 797 HA ARG 94 HA ARG 94 5.222 9.786 -12.960 798 HB2 ARG 94 2HB ARG 94 6.387 11.600 -11.833 799 HB3 ARG 94 3HB ARG 94 6.416 10.715 -10.312 800 HG2 ARG 94 2HG ARG 94 8.631 10.711 -11.395 801 HG3 ARG 94 3HG ARG 94 7.984 9.074 -11.273 802 HD2 ARG 94 2HD ARG 94 7.328 9.138 -13.645 803 HD3 ARG 94 3HD ARG 94 7.901 10.806 -13.772 804 HE ARG 94 HE ARG 94 9.960 9.078 -12.848 805 HH11 ARG 94 1HH1 ARG 94 8.256 9.954 -15.797 806 HH12 ARG 94 2HH1 ARG 94 9.582 9.526 -16.830 807 HH21 ARG 94 1HH2 ARG 94 11.697 8.541 -14.201 808 HH22 ARG 94 2HH2 ARG 94 11.538 8.722 -15.921 809 H PHE 95 H PHE 95 5.023 8.836 -9.526 810 HA PHE 95 HA PHE 95 6.157 6.267 -9.706 811 HB2 PHE 95 2HB PHE 95 5.857 7.379 -7.548 812 HB3 PHE 95 3HB PHE 95 4.111 7.438 -7.768 813 HD1 PHE 95 HD2 PHE 95 6.975 5.257 -6.938 814 HD2 PHE 95 HD1 PHE 95 2.716 5.445 -7.363 815 HE1 PHE 95 HE2 PHE 95 6.742 3.111 -5.771 816 HE2 PHE 95 HE1 PHE 95 2.506 3.298 -6.200 817 HZ PHE 95 HZ PHE 95 4.513 2.135 -5.404 818 H TYR 96 H TYR 96 2.852 7.429 -10.055 819 HA TYR 96 HA TYR 96 1.379 5.079 -10.216 820 HB2 TYR 96 2HB TYR 96 0.270 7.216 -10.037 821 HB3 TYR 96 3HB TYR 96 1.043 7.817 -11.498 822 HD1 TYR 96 HD1 TYR 96 -1.348 5.148 -10.374 823 HD2 TYR 96 HD2 TYR 96 -0.223 7.837 -13.501 824 HE1 TYR 96 HE1 TYR 96 -3.364 4.526 -11.640 825 HE2 TYR 96 HE2 TYR 96 -2.233 7.203 -14.769 826 HH TYR 96 HH TYR 96 -4.816 5.501 -13.412 827 H GLU 97 H GLU 97 2.889 6.960 -12.828 828 HA GLU 97 HA GLU 97 2.204 5.223 -14.974 829 HB2 GLU 97 2HB GLU 97 2.663 7.653 -15.201 830 HB3 GLU 97 3HB GLU 97 4.351 7.376 -14.777 831 HG2 GLU 97 2HG GLU 97 4.637 6.009 -16.819 832 HG3 GLU 97 3HG GLU 97 2.944 6.282 -17.241 833 H GLN 98 H GLN 98 4.954 5.452 -12.811 834 HA GLN 98 HA GLN 98 6.962 4.113 -14.215 835 HB2 GLN 98 2HB GLN 98 7.422 5.451 -12.215 836 HB3 GLN 98 3HB GLN 98 6.454 4.371 -11.222 837 HG2 GLN 98 2HG GLN 98 8.795 3.961 -10.791 838 HG3 GLN 98 3HG GLN 98 8.115 2.559 -11.612 839 HE21 GLN 98 1HE2 GLN 98 8.774 2.093 -13.738 840 HE22 GLN 98 2HE2 GLN 98 10.174 2.833 -14.439 841 H LEU 99 H LEU 99 4.676 2.821 -11.785 842 HA LEU 99 HA LEU 99 5.615 0.122 -11.944 843 HB2 LEU 99 2HB LEU 99 3.236 1.431 -10.611 844 HB3 LEU 99 3HB LEU 99 3.367 -0.322 -10.663 845 HG LEU 99 HG LEU 99 5.572 -0.173 -9.475 846 HD11 LEU 99 1HD1 LEU 99 6.272 2.048 -10.134 847 HD12 LEU 99 2HD1 LEU 99 6.237 1.920 -8.375 848 HD13 LEU 99 3HD1 LEU 99 4.940 2.770 -9.230 849 HD21 LEU 99 3HD2 LEU 99 4.656 0.339 -7.257 850 HD22 LEU 99 1HD2 LEU 99 3.531 -0.622 -8.219 851 HD23 LEU 99 2HD2 LEU 99 3.254 1.108 -8.009 852 H LYS 100 H LYS 100 3.113 1.932 -13.561 853 HA LYS 100 HA LYS 100 1.667 -0.239 -14.716 854 HB2 LYS 100 2HB LYS 100 1.935 2.685 -15.545 855 HB3 LYS 100 3HB LYS 100 0.758 1.567 -16.229 856 HG2 LYS 100 2HG LYS 100 0.907 2.185 -13.260 857 HG3 LYS 100 3HG LYS 100 -0.078 3.130 -14.382 858 HD2 LYS 100 2HD LYS 100 -0.401 0.125 -13.993 859 HD3 LYS 100 3HD LYS 100 -1.332 1.338 -13.111 860 HE2 LYS 100 2HE LYS 100 -2.272 2.187 -15.209 861 HE3 LYS 100 3HE LYS 100 -1.305 1.034 -16.131 862 HZ1 LYS 100 3HZ LYS 100 -3.401 0.319 -14.158 863 HZ2 LYS 100 1HZ LYS 100 -2.491 -0.767 -15.080 864 HZ3 LYS 100 2HZ LYS 100 -3.578 0.278 -15.837 865 H LYS 101 H LYS 101 4.565 1.530 -15.631 866 HA LYS 101 HA LYS 101 4.933 0.441 -18.250 867 HB2 LYS 101 2HB LYS 101 6.133 2.466 -17.489 868 HB3 LYS 101 3HB LYS 101 6.962 1.530 -16.251 869 HG2 LYS 101 2HG LYS 101 7.982 0.150 -18.171 870 HG3 LYS 101 3HG LYS 101 7.349 1.384 -19.260 871 HD2 LYS 101 2HD LYS 101 9.398 1.776 -17.047 872 HD3 LYS 101 3HD LYS 101 9.689 1.865 -18.783 873 HE2 LYS 101 2HE LYS 101 8.197 3.853 -18.902 874 HE3 LYS 101 3HE LYS 101 7.986 3.772 -17.151 875 HZ1 LYS 101 3HZ LYS 101 9.646 5.385 -17.711 876 HZ2 LYS 101 1HZ LYS 101 10.532 4.251 -18.596 877 HZ3 LYS 101 2HZ LYS 101 10.391 4.093 -16.921 878 H ASP 102 H ASP 102 6.146 -0.436 -15.011 879 HA ASP 102 HA ASP 102 7.756 -2.630 -15.806 880 HB2 ASP 102 2HB ASP 102 6.577 -1.826 -13.114 881 HB3 ASP 102 3HB ASP 102 7.585 -3.260 -13.285 882 H GLY 103 H GLY 103 4.381 -2.425 -14.824 883 HA2 GLY 103 2HA GLY 103 2.769 -4.025 -15.664 884 HA3 GLY 103 3HA GLY 103 3.973 -5.298 -15.495 885 H VAL 104 H VAL 104 2.624 -2.720 -13.455 886 HA VAL 104 HA VAL 104 1.894 -4.629 -11.327 887 HB VAL 104 HB VAL 104 3.476 -2.046 -10.830 888 HG11 VAL 104 1HG1 VAL 104 1.884 -2.491 -9.006 889 HG12 VAL 104 2HG1 VAL 104 3.543 -2.726 -8.458 890 HG13 VAL 104 3HG1 VAL 104 2.531 -4.124 -8.821 891 HG21 VAL 104 3HG2 VAL 104 5.340 -3.428 -10.088 892 HG22 VAL 104 1HG2 VAL 104 4.916 -3.843 -11.749 893 HG23 VAL 104 2HG2 VAL 104 4.426 -4.901 -10.421 894 H ASP 105 H ASP 105 0.150 -3.835 -10.007 895 HA ASP 105 HA ASP 105 -1.496 -1.821 -11.361 896 HB2 ASP 105 2HB ASP 105 -2.190 -4.001 -9.354 897 HB3 ASP 105 3HB ASP 105 -3.334 -2.738 -9.815 898 H VAL 106 H VAL 106 -1.604 0.109 -10.652 899 HA VAL 106 HA VAL 106 -1.504 0.780 -7.766 900 HB VAL 106 HB VAL 106 -1.075 3.209 -8.693 901 HG11 VAL 106 1HG1 VAL 106 1.141 1.151 -8.962 902 HG12 VAL 106 2HG1 VAL 106 0.660 1.972 -7.478 903 HG13 VAL 106 3HG1 VAL 106 1.363 2.899 -8.804 904 HG21 VAL 106 3HG2 VAL 106 0.078 3.333 -10.872 905 HG22 VAL 106 1HG2 VAL 106 -1.568 2.720 -11.056 906 HG23 VAL 106 2HG2 VAL 106 -0.201 1.606 -11.123 907 H ARG 107 H ARG 107 -3.519 1.065 -7.037 908 HA ARG 107 HA ARG 107 -5.737 1.851 -8.764 909 HB2 ARG 107 2HB ARG 107 -5.659 1.183 -5.780 910 HB3 ARG 107 3HB ARG 107 -7.123 1.494 -6.707 911 HG2 ARG 107 2HG ARG 107 -5.247 -0.868 -6.968 912 HG3 ARG 107 3HG ARG 107 -6.922 -0.876 -6.417 913 HD2 ARG 107 2HD ARG 107 -5.886 -0.424 -9.229 914 HD3 ARG 107 3HD ARG 107 -6.944 -1.715 -8.650 915 HE ARG 107 HE ARG 107 -8.262 0.687 -8.164 916 HH11 ARG 107 1HH1 ARG 107 -7.195 -1.091 -11.007 917 HH12 ARG 107 2HH1 ARG 107 -8.437 -0.432 -12.016 918 HH21 ARG 107 1HH2 ARG 107 -9.790 1.602 -9.496 919 HH22 ARG 107 2HH2 ARG 107 -9.919 1.107 -11.158 920 H VAL 108 H VAL 108 -5.771 4.030 -9.215 921 HA VAL 108 HA VAL 108 -5.396 5.992 -7.085 922 HB VAL 108 HB VAL 108 -6.137 7.698 -8.845 923 HG11 VAL 108 1HG1 VAL 108 -3.776 7.334 -8.323 924 HG12 VAL 108 2HG1 VAL 108 -3.977 7.684 -10.038 925 HG13 VAL 108 3HG1 VAL 108 -3.687 6.026 -9.504 926 HG21 VAL 108 3HG2 VAL 108 -5.931 5.332 -10.761 927 HG22 VAL 108 1HG2 VAL 108 -6.087 7.026 -11.244 928 HG23 VAL 108 2HG2 VAL 108 -7.397 6.230 -10.370 929 H THR 109 H THR 109 -6.920 6.189 -5.657 930 HA THR 109 HA THR 109 -9.750 5.729 -6.211 931 HB THR 109 HB THR 109 -10.020 6.235 -3.774 932 HG1 THR 109 HG1 THR 109 -8.463 7.523 -3.073 933 HG21 THR 109 3HG2 THR 109 -7.803 4.235 -4.380 934 HG22 THR 109 1HG2 THR 109 -9.535 3.910 -4.485 935 HG23 THR 109 2HG2 THR 109 -8.797 4.261 -2.921 936 H ASP 110 H ASP 110 -7.453 8.306 -5.886 937 HA ASP 110 HA ASP 110 -7.385 10.419 -6.601 938 HB2 ASP 110 2HB ASP 110 -10.277 10.164 -7.501 939 HB3 ASP 110 3HB ASP 110 -9.145 11.427 -7.978 940 H ASN 111 H ASN 111 -10.669 10.068 -5.257 941 HA ASN 111 HA ASN 111 -10.259 12.295 -3.417 942 HB2 ASN 111 2HB ASN 111 -12.448 12.061 -4.465 943 HB3 ASN 111 3HB ASN 111 -12.601 10.404 -3.911 944 HD21 ASN 111 1HD2 ASN 111 -12.742 13.768 -2.973 945 HD22 ASN 111 2HD2 ASN 111 -13.554 13.513 -1.467 946 H GLU 112 H GLU 112 -10.716 11.944 -1.137 947 HA GLU 112 HA GLU 112 -8.749 10.086 -0.129 948 HB2 GLU 112 2HB GLU 112 -10.375 12.109 1.479 949 HB3 GLU 112 3HB GLU 112 -8.814 11.400 1.889 950 HG2 GLU 112 2HG GLU 112 -8.219 13.553 1.189 951 HG3 GLU 112 3HG GLU 112 -7.939 12.585 -0.257 952 H ASP 113 H ASP 113 -12.176 10.770 0.375 953 HA ASP 113 HA ASP 113 -12.672 8.695 2.270 954 HB2 ASP 113 2HB ASP 113 -14.602 10.279 0.519 955 HB3 ASP 113 3HB ASP 113 -15.095 9.198 1.824 956 H GLU 114 H GLU 114 -12.718 8.896 -1.246 957 HA GLU 114 HA GLU 114 -13.930 6.416 -1.812 958 HB2 GLU 114 2HB GLU 114 -11.848 7.986 -3.372 959 HB3 GLU 114 3HB GLU 114 -12.545 6.484 -3.968 960 HG2 GLU 114 2HG GLU 114 -14.028 9.053 -3.381 961 HG3 GLU 114 3HG GLU 114 -13.685 8.372 -4.970 962 H ALA 115 H ALA 115 -10.601 7.232 -0.900 963 HA ALA 115 HA ALA 115 -9.545 4.577 -1.220 964 HB1 ALA 115 3HB ALA 115 -8.485 6.878 0.451 965 HB2 ALA 115 1HB ALA 115 -8.076 6.540 -1.231 966 HB3 ALA 115 2HB ALA 115 -7.608 5.403 0.033 967 H LYS 116 H LYS 116 -10.859 6.447 1.486 968 HA LYS 116 HA LYS 116 -10.344 4.792 3.661 969 HB2 LYS 116 2HB LYS 116 -11.122 7.098 3.788 970 HB3 LYS 116 3HB LYS 116 -12.644 6.672 3.015 971 HG2 LYS 116 2HG LYS 116 -13.265 5.341 5.020 972 HG3 LYS 116 3HG LYS 116 -11.752 5.826 5.793 973 HD2 LYS 116 2HD LYS 116 -13.864 7.770 4.802 974 HD3 LYS 116 3HD LYS 116 -13.736 7.229 6.479 975 HE2 LYS 116 2HE LYS 116 -11.559 8.284 6.704 976 HE3 LYS 116 3HE LYS 116 -11.520 8.669 4.982 977 HZ1 LYS 116 3HZ LYS 116 -13.296 10.206 5.272 978 HZ2 LYS 116 1HZ LYS 116 -12.102 10.561 6.413 979 HZ3 LYS 116 2HZ LYS 116 -13.518 9.760 6.888 980 H LYS 117 H LYS 117 -13.283 4.914 1.641 981 HA LYS 117 HA LYS 117 -14.569 2.690 2.860 982 HB2 LYS 117 2HB LYS 117 -16.163 2.811 0.983 983 HB3 LYS 117 3HB LYS 117 -15.855 4.403 1.668 984 HG2 LYS 117 2HG LYS 117 -14.233 4.816 -0.227 985 HG3 LYS 117 3HG LYS 117 -14.775 3.304 -0.950 986 HD2 LYS 117 2HD LYS 117 -16.566 5.693 -0.346 987 HD3 LYS 117 3HD LYS 117 -15.887 5.313 -1.929 988 HE2 LYS 117 2HE LYS 117 -17.152 3.226 -2.013 989 HE3 LYS 117 3HE LYS 117 -17.769 3.501 -0.380 990 HZ1 LYS 117 3HZ LYS 117 -18.856 5.520 -1.205 991 HZ2 LYS 117 1HZ LYS 117 -19.405 4.136 -2.008 992 HZ3 LYS 117 2HZ LYS 117 -18.317 5.181 -2.769 993 H ARG 118 H ARG 118 -12.316 3.024 0.157 994 HA ARG 118 HA ARG 118 -12.696 0.407 -0.925 995 HB2 ARG 118 2HB ARG 118 -11.063 2.740 -1.623 996 HB3 ARG 118 3HB ARG 118 -10.105 1.274 -1.763 997 HG2 ARG 118 2HG ARG 118 -11.140 1.792 -3.895 998 HG3 ARG 118 3HG ARG 118 -11.807 0.293 -3.246 999 HD2 ARG 118 2HD ARG 118 -13.786 1.635 -2.413 1000 HD3 ARG 118 3HD ARG 118 -13.127 3.032 -3.276 1001 HE ARG 118 HE ARG 118 -13.661 0.545 -4.736 1002 HH11 ARG 118 1HH1 ARG 118 -14.527 3.898 -4.166 1003 HH12 ARG 118 2HH1 ARG 118 -15.522 4.002 -5.575 1004 HH21 ARG 118 1HH2 ARG 118 -14.969 0.686 -6.553 1005 HH22 ARG 118 2HH2 ARG 118 -15.772 2.173 -6.934 1006 H LEU 119 H LEU 119 -10.668 1.669 1.653 1007 HA LEU 119 HA LEU 119 -8.764 -0.434 1.678 1008 HB2 LEU 119 2HB LEU 119 -9.712 1.326 3.973 1009 HB3 LEU 119 3HB LEU 119 -8.352 0.211 4.079 1010 HG LEU 119 HG LEU 119 -8.555 2.752 2.444 1011 HD11 LEU 119 1HD1 LEU 119 -6.539 1.846 4.504 1012 HD12 LEU 119 2HD1 LEU 119 -7.833 3.021 4.746 1013 HD13 LEU 119 3HD1 LEU 119 -6.522 3.378 3.626 1014 HD21 LEU 119 3HD2 LEU 119 -6.380 2.217 1.420 1015 HD22 LEU 119 1HD2 LEU 119 -7.630 1.079 0.927 1016 HD23 LEU 119 2HD2 LEU 119 -6.432 0.603 2.137 1017 H LYS 120 H LYS 120 -11.834 0.007 3.358 1018 HA LYS 120 HA LYS 120 -11.855 -2.530 4.673 1019 HB2 LYS 120 2HB LYS 120 -13.136 -0.602 5.502 1020 HB3 LYS 120 3HB LYS 120 -14.073 -0.550 4.010 1021 HG2 LYS 120 2HG LYS 120 -14.973 -2.844 4.569 1022 HG3 LYS 120 3HG LYS 120 -14.146 -2.730 6.129 1023 HD2 LYS 120 2HD LYS 120 -15.494 -0.768 6.733 1024 HD3 LYS 120 3HD LYS 120 -16.243 -0.755 5.135 1025 HE2 LYS 120 2HE LYS 120 -17.254 -2.969 5.620 1026 HE3 LYS 120 3HE LYS 120 -16.546 -2.921 7.237 1027 HZ1 LYS 120 3HZ LYS 120 -18.515 -0.986 6.143 1028 HZ2 LYS 120 1HZ LYS 120 -17.827 -0.920 7.686 1029 HZ3 LYS 120 2HZ LYS 120 -18.836 -2.207 7.268 1030 H GLU 121 H GLU 121 -13.344 -1.259 1.706 1031 HA GLU 121 HA GLU 121 -15.060 -3.393 1.064 1032 HB2 GLU 121 2HB GLU 121 -15.308 -1.107 0.219 1033 HB3 GLU 121 3HB GLU 121 -13.809 -1.223 -0.680 1034 HG2 GLU 121 2HG GLU 121 -15.934 -3.206 -1.379 1035 HG3 GLU 121 3HG GLU 121 -16.269 -1.528 -1.789 1036 H LEU 122 H LEU 122 -11.779 -2.658 -0.065 1037 HA LEU 122 HA LEU 122 -11.503 -5.044 -1.659 1038 HB2 LEU 122 2HB LEU 122 -9.392 -3.037 -0.771 1039 HB3 LEU 122 3HB LEU 122 -9.171 -4.276 -1.998 1040 HG LEU 122 HG LEU 122 -11.107 -1.929 -2.209 1041 HD11 LEU 122 1HD1 LEU 122 -8.798 -1.162 -2.369 1042 HD12 LEU 122 2HD1 LEU 122 -9.615 -1.017 -3.922 1043 HD13 LEU 122 3HD1 LEU 122 -8.468 -2.334 -3.647 1044 HD21 LEU 122 3HD2 LEU 122 -11.442 -2.614 -4.533 1045 HD22 LEU 122 1HD2 LEU 122 -11.956 -3.868 -3.408 1046 HD23 LEU 122 2HD2 LEU 122 -10.428 -4.035 -4.275 1047 H LEU 123 H LEU 123 -10.730 -4.128 1.680 1048 HA LEU 123 HA LEU 123 -8.860 -6.124 2.366 1049 HB2 LEU 123 2HB LEU 123 -10.240 -4.093 3.777 1050 HB3 LEU 123 3HB LEU 123 -10.734 -5.552 4.591 1051 HG LEU 123 HG LEU 123 -8.322 -6.099 5.013 1052 HD11 LEU 123 1HD1 LEU 123 -6.594 -4.367 4.685 1053 HD12 LEU 123 2HD1 LEU 123 -7.760 -3.373 3.811 1054 HD13 LEU 123 3HD1 LEU 123 -7.262 -4.934 3.154 1055 HD21 LEU 123 3HD2 LEU 123 -7.998 -4.397 6.781 1056 HD22 LEU 123 1HD2 LEU 123 -9.661 -4.992 6.729 1057 HD23 LEU 123 2HD2 LEU 123 -9.270 -3.411 6.052 1058 H GLU 124 H GLU 124 -12.378 -6.108 2.447 1059 HA GLU 124 HA GLU 124 -12.879 -8.634 3.583 1060 HB2 GLU 124 2HB GLU 124 -14.567 -7.088 1.567 1061 HB3 GLU 124 3HB GLU 124 -15.144 -8.412 2.573 1062 HG2 GLU 124 2HG GLU 124 -14.852 -7.094 4.589 1063 HG3 GLU 124 3HG GLU 124 -14.074 -5.799 3.681 1064 H LYS 125 H LYS 125 -12.087 -7.661 0.312 1065 HA LYS 125 HA LYS 125 -12.504 -10.348 -0.808 1066 HB2 LYS 125 2HB LYS 125 -11.592 -7.763 -2.142 1067 HB3 LYS 125 3HB LYS 125 -12.036 -9.254 -2.973 1068 HG2 LYS 125 2HG LYS 125 -14.351 -9.024 -2.151 1069 HG3 LYS 125 3HG LYS 125 -13.902 -7.538 -1.308 1070 HD2 LYS 125 2HD LYS 125 -13.316 -6.503 -3.509 1071 HD3 LYS 125 3HD LYS 125 -13.853 -7.978 -4.323 1072 HE2 LYS 125 2HE LYS 125 -15.629 -6.314 -4.411 1073 HE3 LYS 125 3HE LYS 125 -16.132 -7.633 -3.352 1074 HZ1 LYS 125 3HZ LYS 125 -15.067 -5.011 -2.495 1075 HZ2 LYS 125 1HZ LYS 125 -15.464 -6.270 -1.456 1076 HZ3 LYS 125 2HZ LYS 125 -16.665 -5.527 -2.376 1077 H VAL 126 H VAL 126 -10.275 -9.418 1.137 1078 HA VAL 126 HA VAL 126 -8.126 -9.824 1.637 1079 HB VAL 126 HB VAL 126 -8.147 -11.947 -0.557 1080 HG11 VAL 126 1HG1 VAL 126 -6.580 -13.178 0.896 1081 HG12 VAL 126 2HG1 VAL 126 -6.624 -11.866 2.075 1082 HG13 VAL 126 3HG1 VAL 126 -5.937 -11.588 0.473 1083 HG21 VAL 126 3HG2 VAL 126 -9.221 -12.262 2.279 1084 HG22 VAL 126 1HG2 VAL 126 -9.067 -13.553 1.083 1085 HG23 VAL 126 2HG2 VAL 126 -10.194 -12.224 0.809 1086 H GLY 127 H GLY 127 -8.375 -7.627 0.243 1087 HA2 GLY 127 2HA GLY 127 -7.059 -6.001 -0.677 1088 HA3 GLY 127 3HA GLY 127 -5.746 -7.162 -0.786 1089 H SER 128 H SER 128 -8.962 -6.738 -2.306 1090 HA SER 128 HA SER 128 -7.975 -7.635 -4.908 1091 HB2 SER 128 2HB SER 128 -10.197 -8.372 -4.108 1092 HB3 SER 128 3HB SER 128 -10.744 -6.700 -4.024 1093 HG SER 128 HG SER 128 -10.676 -6.565 -6.230 1094 H LEU 129 H LEU 129 -8.847 -6.283 -6.854 1095 HA LEU 129 HA LEU 129 -8.070 -3.455 -6.625 1096 HB2 LEU 129 2HB LEU 129 -8.671 -5.251 -9.008 1097 HB3 LEU 129 3HB LEU 129 -8.426 -3.517 -9.170 1098 HG LEU 129 HG LEU 129 -6.122 -3.803 -8.224 1099 HD11 LEU 129 1HD1 LEU 129 -5.073 -6.016 -8.168 1100 HD12 LEU 129 2HD1 LEU 129 -6.626 -6.774 -8.524 1101 HD13 LEU 129 3HD1 LEU 129 -6.395 -5.905 -7.007 1102 HD21 LEU 129 3HD2 LEU 129 -5.153 -4.705 -10.303 1103 HD22 LEU 129 1HD2 LEU 129 -6.472 -3.577 -10.612 1104 HD23 LEU 129 2HD2 LEU 129 -6.742 -5.314 -10.772 1105 H GLU 130 H GLU 130 -9.424 -1.846 -7.758 1106 HA GLU 130 HA GLU 130 -12.215 -2.042 -7.087 1107 HB2 GLU 130 2HB GLU 130 -10.869 0.160 -8.703 1108 HB3 GLU 130 3HB GLU 130 -12.392 0.263 -7.826 1109 HG2 GLU 130 2HG GLU 130 -11.234 0.190 -5.700 1110 HG3 GLU 130 3HG GLU 130 -9.693 -0.114 -6.509 1111 H HIS 131 H HIS 131 -13.269 -3.523 -8.423 1112 HA HIS 131 HA HIS 131 -12.751 -3.564 -11.308 1113 HB2 HIS 131 2HB HIS 131 -14.124 -5.564 -11.405 1114 HB3 HIS 131 3HB HIS 131 -13.018 -5.707 -10.049 1115 HD1 HIS 131 HD1 HIS 131 -16.656 -5.287 -10.864 1116 HD2 HIS 131 HD2 HIS 131 -14.256 -5.921 -7.536 1117 HE1 HIS 131 HE1 HIS 131 -18.223 -5.881 -8.999 1118 HE2 HIS 131 HE2 HIS 131 -16.763 -6.104 -6.973 1119 H HIS 132 H HIS 132 -14.324 -1.345 -9.755 1120 HA HIS 132 HA HIS 132 -16.463 -1.068 -11.781 1121 HB2 HIS 132 2HB HIS 132 -17.425 -1.761 -9.542 1122 HB3 HIS 132 3HB HIS 132 -16.805 -0.267 -8.853 1123 HD1 HIS 132 HD1 HIS 132 -18.547 1.520 -8.763 1124 HD2 HIS 132 HD2 HIS 132 -19.225 -1.092 -11.914 1125 HE1 HIS 132 HE1 HIS 132 -20.648 2.324 -9.861 1126 HE2 HIS 132 HE2 HIS 132 -20.930 0.846 -11.877 1127 H HIS 133 H HIS 133 -14.458 0.633 -9.323 1128 HA HIS 133 HA HIS 133 -14.821 3.225 -10.502 1129 HB2 HIS 133 2HB HIS 133 -14.237 2.964 -8.097 1130 HB3 HIS 133 3HB HIS 133 -12.676 2.283 -8.543 1131 HD1 HIS 133 HD1 HIS 133 -11.014 4.049 -7.877 1132 HD2 HIS 133 HD2 HIS 133 -14.307 5.675 -9.831 1133 HE1 HIS 133 HE1 HIS 133 -10.533 6.496 -8.126 1134 HE2 HIS 133 HE2 HIS 133 -12.613 7.468 -9.112 1135 H HIS 134 H HIS 134 -14.170 3.442 -12.548 1136 HA HIS 134 HA HIS 134 -11.670 2.219 -13.540 1137 HB2 HIS 134 2HB HIS 134 -13.888 1.696 -14.638 1138 HB3 HIS 134 3HB HIS 134 -14.028 3.388 -15.092 1139 HD1 HIS 134 HD1 HIS 134 -13.562 3.588 -17.513 1140 HD2 HIS 134 HD2 HIS 134 -11.098 0.756 -15.731 1141 HE1 HIS 134 HE1 HIS 134 -12.150 2.659 -19.360 1142 HE2 HIS 134 HE2 HIS 134 -10.553 1.092 -18.231 1143 H HIS 135 H HIS 135 -12.876 5.185 -12.477 1144 HA HIS 135 HA HIS 135 -12.233 7.334 -12.455 1145 HB2 HIS 135 2HB HIS 135 -9.878 6.564 -12.219 1146 HB3 HIS 135 3HB HIS 135 -9.725 6.480 -13.968 1147 HD1 HIS 135 HD1 HIS 135 -8.751 8.589 -11.301 1148 HD2 HIS 135 HD2 HIS 135 -10.321 9.338 -15.080 1149 HE1 HIS 135 HE1 HIS 135 -8.157 10.963 -11.841 1150 HE2 HIS 135 HE2 HIS 135 -9.210 11.419 -14.066 1151 H HIS 136 H HIS 136 -11.096 6.242 -15.662 1152 HA HIS 136 HA HIS 136 -12.289 8.540 -16.994 1153 HB2 HIS 136 2HB HIS 136 -10.035 7.822 -17.659 1154 HB3 HIS 136 3HB HIS 136 -10.611 6.202 -18.038 1155 HD1 HIS 136 HD1 HIS 136 -11.955 5.915 -20.244 1156 HD2 HIS 136 HD2 HIS 136 -10.487 9.757 -19.658 1157 HE1 HIS 136 HE1 HIS 136 -12.150 7.058 -22.468 1158 HE2 HIS 136 HE2 HIS 136 -11.247 9.374 -22.091 Start of MODEL 4 1 H1 MET 1 1H MET 1 -4.531 -15.551 -3.284 2 H2 MET 1 2H MET 1 -5.023 -14.181 -4.137 3 H3 MET 1 3H MET 1 -6.071 -14.910 -3.032 4 HA MET 1 HA MET 1 -5.103 -12.887 -2.142 5 HB2 MET 1 2HB MET 1 -4.090 -15.413 -0.762 6 HB3 MET 1 3HB MET 1 -4.311 -13.848 0.007 7 HG2 MET 1 2HG MET 1 -6.755 -14.020 -0.441 8 HG3 MET 1 3HG MET 1 -6.487 -15.637 -1.099 9 HE1 MET 1 3HE MET 1 -8.535 -14.963 1.342 10 HE2 MET 1 1HE MET 1 -8.190 -16.309 2.425 11 HE3 MET 1 2HE MET 1 -8.324 -16.591 0.687 12 H GLY 2 H GLY 2 -2.898 -12.511 -0.668 13 HA2 GLY 2 2HA GLY 2 -0.573 -12.261 -0.649 14 HA3 GLY 2 3HA GLY 2 -0.467 -13.068 -2.209 15 H THR 3 H THR 3 -2.122 -10.194 -0.924 16 HA THR 3 HA THR 3 -1.177 -8.611 -3.239 17 HB THR 3 HB THR 3 -3.606 -7.948 -1.504 18 HG1 THR 3 HG1 THR 3 -4.656 -9.490 -2.483 19 HG21 THR 3 3HG2 THR 3 -2.710 -6.113 -2.937 20 HG22 THR 3 1HG2 THR 3 -4.318 -6.630 -3.456 21 HG23 THR 3 2HG2 THR 3 -2.891 -7.147 -4.355 22 H VAL 4 H VAL 4 0.306 -7.105 -2.744 23 HA VAL 4 HA VAL 4 0.621 -6.079 0.002 24 HB VAL 4 HB VAL 4 2.376 -5.569 -2.468 25 HG11 VAL 4 1HG1 VAL 4 4.070 -4.751 -0.866 26 HG12 VAL 4 2HG1 VAL 4 2.950 -5.011 0.471 27 HG13 VAL 4 3HG1 VAL 4 2.586 -3.800 -0.758 28 HG21 VAL 4 3HG2 VAL 4 3.972 -7.195 -1.527 29 HG22 VAL 4 1HG2 VAL 4 2.420 -7.959 -1.877 30 HG23 VAL 4 2HG2 VAL 4 2.849 -7.556 -0.213 31 H VAL 5 H VAL 5 -0.575 -4.305 0.423 32 HA VAL 5 HA VAL 5 -1.367 -2.500 -1.797 33 HB VAL 5 HB VAL 5 -3.432 -1.981 -0.391 34 HG11 VAL 5 1HG1 VAL 5 -3.171 -4.853 -1.350 35 HG12 VAL 5 2HG1 VAL 5 -3.531 -3.455 -2.363 36 HG13 VAL 5 3HG1 VAL 5 -4.686 -3.966 -1.133 37 HG21 VAL 5 3HG2 VAL 5 -4.184 -3.635 1.293 38 HG22 VAL 5 1HG2 VAL 5 -2.693 -2.839 1.801 39 HG23 VAL 5 2HG2 VAL 5 -2.637 -4.480 1.160 40 H ILE 6 H ILE 6 -0.336 -0.632 -1.688 41 HA ILE 6 HA ILE 6 0.691 0.372 0.897 42 HB ILE 6 HB ILE 6 1.595 1.202 -1.898 43 HG12 ILE 6 2HG1 ILE 6 3.806 -0.059 -1.143 44 HG13 ILE 6 3HG1 ILE 6 2.738 -0.937 -0.061 45 HG21 ILE 6 1HG2 ILE 6 2.777 1.798 0.838 46 HG22 ILE 6 2HG2 ILE 6 1.954 2.945 -0.223 47 HG23 ILE 6 3HG2 ILE 6 3.504 2.256 -0.700 48 HD11 ILE 6 3HD1 ILE 6 1.471 -1.761 -1.992 49 HD12 ILE 6 1HD1 ILE 6 3.182 -2.176 -2.108 50 HD13 ILE 6 2HD1 ILE 6 2.529 -0.853 -3.074 51 H VAL 7 H VAL 7 -0.679 1.846 1.725 52 HA VAL 7 HA VAL 7 -2.335 3.565 0.054 53 HB VAL 7 HB VAL 7 -2.064 3.414 3.091 54 HG11 VAL 7 1HG1 VAL 7 -4.137 4.897 1.420 55 HG12 VAL 7 2HG1 VAL 7 -2.874 5.634 2.409 56 HG13 VAL 7 3HG1 VAL 7 -4.168 4.717 3.177 57 HG21 VAL 7 3HG2 VAL 7 -2.939 1.343 2.104 58 HG22 VAL 7 1HG2 VAL 7 -4.194 2.258 1.264 59 HG23 VAL 7 2HG2 VAL 7 -4.185 2.184 3.030 60 H VAL 8 H VAL 8 -1.223 5.129 -0.851 61 HA VAL 8 HA VAL 8 0.596 6.853 0.673 62 HB VAL 8 HB VAL 8 0.131 6.767 -2.348 63 HG11 VAL 8 1HG1 VAL 8 0.947 8.962 -1.551 64 HG12 VAL 8 2HG1 VAL 8 2.174 8.137 -2.509 65 HG13 VAL 8 3HG1 VAL 8 2.310 8.176 -0.750 66 HG21 VAL 8 3HG2 VAL 8 2.277 5.569 -2.516 67 HG22 VAL 8 1HG2 VAL 8 1.120 4.648 -1.552 68 HG23 VAL 8 2HG2 VAL 8 2.420 5.540 -0.757 69 H SER 9 H SER 9 0.145 9.009 0.926 70 HA SER 9 HA SER 9 -2.053 10.289 -0.480 71 HB2 SER 9 2HB SER 9 -3.306 10.945 1.474 72 HB3 SER 9 3HB SER 9 -3.077 9.209 1.607 73 HG SER 9 HG SER 9 -1.209 9.760 2.965 74 H ASN 10 H ASN 10 -2.214 12.653 0.540 75 HA ASN 10 HA ASN 10 0.493 13.801 0.422 76 HB2 ASN 10 2HB ASN 10 -0.650 15.900 -0.169 77 HB3 ASN 10 3HB ASN 10 -1.157 14.595 -1.230 78 HD21 ASN 10 1HD2 ASN 10 -2.530 17.082 -0.724 79 HD22 ASN 10 2HD2 ASN 10 -4.077 16.680 -0.070 80 H ASP 11 H ASP 11 -1.312 12.733 2.875 81 HA ASP 11 HA ASP 11 -0.689 14.962 4.720 82 HB2 ASP 11 2HB ASP 11 -3.064 15.159 3.902 83 HB3 ASP 11 3HB ASP 11 -3.399 13.563 4.551 84 H GLU 12 H GLU 12 -0.821 14.319 6.996 85 HA GLU 12 HA GLU 12 0.371 11.710 7.481 86 HB2 GLU 12 2HB GLU 12 1.321 13.786 8.468 87 HB3 GLU 12 3HB GLU 12 -0.188 14.068 9.329 88 HG2 GLU 12 2HG GLU 12 0.213 11.845 10.516 89 HG3 GLU 12 3HG GLU 12 1.823 11.850 9.801 90 H ARG 13 H ARG 13 -2.407 13.586 8.791 91 HA ARG 13 HA ARG 13 -3.238 11.514 10.583 92 HB2 ARG 13 2HB ARG 13 -4.709 14.039 9.763 93 HB3 ARG 13 3HB ARG 13 -5.204 12.958 11.065 94 HG2 ARG 13 2HG ARG 13 -2.923 13.462 12.143 95 HG3 ARG 13 3HG ARG 13 -2.763 14.754 10.950 96 HD2 ARG 13 2HD ARG 13 -4.895 14.484 13.100 97 HD3 ARG 13 3HD ARG 13 -3.633 15.713 12.990 98 HE ARG 13 HE ARG 13 -5.286 15.784 10.687 99 HH11 ARG 13 1HH1 ARG 13 -5.342 16.718 14.087 100 HH12 ARG 13 2HH1 ARG 13 -6.500 17.985 13.845 101 HH21 ARG 13 1HH2 ARG 13 -6.793 17.429 10.373 102 HH22 ARG 13 2HH2 ARG 13 -7.328 18.390 11.717 103 H ILE 14 H ILE 14 -4.187 12.372 7.303 104 HA ILE 14 HA ILE 14 -6.574 10.897 7.083 105 HB ILE 14 HB ILE 14 -4.428 11.504 4.997 106 HG12 ILE 14 2HG1 ILE 14 -7.195 12.724 5.467 107 HG13 ILE 14 3HG1 ILE 14 -5.656 13.480 5.866 108 HG21 ILE 14 1HG2 ILE 14 -6.057 10.839 3.238 109 HG22 ILE 14 2HG2 ILE 14 -7.152 10.252 4.491 110 HG23 ILE 14 3HG2 ILE 14 -5.588 9.474 4.255 111 HD11 ILE 14 3HD1 ILE 14 -6.577 14.429 3.850 112 HD12 ILE 14 1HD1 ILE 14 -6.656 12.839 3.090 113 HD13 ILE 14 2HD1 ILE 14 -5.091 13.559 3.476 114 H LEU 15 H LEU 15 -3.161 9.900 6.716 115 HA LEU 15 HA LEU 15 -3.580 7.165 6.126 116 HB2 LEU 15 2HB LEU 15 -1.250 8.562 7.495 117 HB3 LEU 15 3HB LEU 15 -1.212 6.878 6.990 118 HG LEU 15 HG LEU 15 -1.574 9.236 5.097 119 HD11 LEU 15 1HD1 LEU 15 0.742 8.864 4.404 120 HD12 LEU 15 2HD1 LEU 15 0.926 7.599 5.623 121 HD13 LEU 15 3HD1 LEU 15 0.652 9.272 6.117 122 HD21 LEU 15 3HD2 LEU 15 -1.125 6.281 4.516 123 HD22 LEU 15 1HD2 LEU 15 -1.149 7.575 3.310 124 HD23 LEU 15 2HD2 LEU 15 -2.605 7.197 4.230 125 H GLU 16 H GLU 16 -3.531 8.953 9.152 126 HA GLU 16 HA GLU 16 -3.373 6.677 10.889 127 HB2 GLU 16 2HB GLU 16 -4.259 9.524 11.505 128 HB3 GLU 16 3HB GLU 16 -3.873 8.289 12.699 129 HG2 GLU 16 2HG GLU 16 -1.968 9.594 10.740 130 HG3 GLU 16 3HG GLU 16 -2.000 9.795 12.491 131 H GLU 17 H GLU 17 -6.080 8.731 9.770 132 HA GLU 17 HA GLU 17 -8.188 7.476 11.183 133 HB2 GLU 17 2HB GLU 17 -8.470 9.655 10.044 134 HB3 GLU 17 3HB GLU 17 -8.170 8.904 8.478 135 HG2 GLU 17 2HG GLU 17 -10.248 7.519 8.831 136 HG3 GLU 17 3HG GLU 17 -10.560 8.454 10.291 137 H LEU 18 H LEU 18 -6.903 7.052 7.943 138 HA LEU 18 HA LEU 18 -8.440 4.892 7.036 139 HB2 LEU 18 2HB LEU 18 -5.862 6.216 6.226 140 HB3 LEU 18 3HB LEU 18 -6.215 4.652 5.524 141 HG LEU 18 HG LEU 18 -8.173 5.481 4.387 142 HD11 LEU 18 1HD1 LEU 18 -9.121 6.956 6.086 143 HD12 LEU 18 2HD1 LEU 18 -9.013 7.766 4.525 144 HD13 LEU 18 3HD1 LEU 18 -7.842 8.139 5.795 145 HD21 LEU 18 3HD2 LEU 18 -5.871 7.437 4.109 146 HD22 LEU 18 1HD2 LEU 18 -7.159 7.202 2.928 147 HD23 LEU 18 2HD2 LEU 18 -6.046 5.887 3.283 148 H LEU 19 H LEU 19 -5.433 5.010 8.908 149 HA LEU 19 HA LEU 19 -4.553 2.354 8.784 150 HB2 LEU 19 2HB LEU 19 -3.313 4.258 9.856 151 HB3 LEU 19 3HB LEU 19 -4.468 4.237 11.172 152 HG LEU 19 HG LEU 19 -3.620 1.688 11.414 153 HD11 LEU 19 1HD1 LEU 19 -2.154 1.698 9.475 154 HD12 LEU 19 2HD1 LEU 19 -1.230 1.451 10.954 155 HD13 LEU 19 3HD1 LEU 19 -1.212 3.026 10.157 156 HD21 LEU 19 3HD2 LEU 19 -2.071 4.065 12.482 157 HD22 LEU 19 1HD2 LEU 19 -2.021 2.418 13.124 158 HD23 LEU 19 2HD2 LEU 19 -3.519 3.342 13.193 159 H GLU 20 H GLU 20 -6.807 3.964 10.917 160 HA GLU 20 HA GLU 20 -7.437 1.751 12.593 161 HB2 GLU 20 2HB GLU 20 -8.838 4.417 12.159 162 HB3 GLU 20 3HB GLU 20 -9.155 3.305 13.492 163 HG2 GLU 20 2HG GLU 20 -6.828 3.570 14.282 164 HG3 GLU 20 3HG GLU 20 -6.497 4.658 12.927 165 H VAL 21 H VAL 21 -8.858 3.081 9.642 166 HA VAL 21 HA VAL 21 -11.298 1.643 9.638 167 HB VAL 21 HB VAL 21 -9.663 2.593 7.231 168 HG11 VAL 21 1HG1 VAL 21 -11.811 2.500 5.971 169 HG12 VAL 21 2HG1 VAL 21 -12.583 1.739 7.365 170 HG13 VAL 21 3HG1 VAL 21 -11.282 0.904 6.511 171 HG21 VAL 21 3HG2 VAL 21 -11.960 3.948 8.690 172 HG22 VAL 21 1HG2 VAL 21 -11.181 4.547 7.220 173 HG23 VAL 21 2HG2 VAL 21 -10.270 4.445 8.725 174 H VAL 22 H VAL 22 -8.029 0.818 8.576 175 HA VAL 22 HA VAL 22 -8.686 -1.743 7.439 176 HB VAL 22 HB VAL 22 -5.971 -0.694 8.377 177 HG11 VAL 22 1HG1 VAL 22 -6.613 -2.973 6.470 178 HG12 VAL 22 2HG1 VAL 22 -6.003 -3.150 8.117 179 HG13 VAL 22 3HG1 VAL 22 -4.999 -2.389 6.884 180 HG21 VAL 22 3HG2 VAL 22 -5.573 -0.102 6.018 181 HG22 VAL 22 1HG2 VAL 22 -6.957 0.773 6.675 182 HG23 VAL 22 2HG2 VAL 22 -7.216 -0.609 5.608 183 H LEU 23 H LEU 23 -7.386 -0.592 10.556 184 HA LEU 23 HA LEU 23 -6.834 -3.069 11.762 185 HB2 LEU 23 2HB LEU 23 -7.416 -0.316 12.903 186 HB3 LEU 23 3HB LEU 23 -7.032 -1.674 13.944 187 HG LEU 23 HG LEU 23 -5.184 -0.623 11.765 188 HD11 LEU 23 1HD1 LEU 23 -5.021 -0.155 14.761 189 HD12 LEU 23 2HD1 LEU 23 -5.429 1.049 13.534 190 HD13 LEU 23 3HD1 LEU 23 -3.820 0.334 13.559 191 HD21 LEU 23 3HD2 LEU 23 -4.825 -3.000 12.224 192 HD22 LEU 23 1HD2 LEU 23 -4.682 -2.673 13.955 193 HD23 LEU 23 2HD2 LEU 23 -3.477 -2.045 12.828 194 H LYS 24 H LYS 24 -9.862 -1.160 11.764 195 HA LYS 24 HA LYS 24 -11.192 -2.918 13.633 196 HB2 LYS 24 2HB LYS 24 -13.226 -1.576 13.240 197 HB3 LYS 24 3HB LYS 24 -11.842 -0.557 13.581 198 HG2 LYS 24 2HG LYS 24 -12.956 0.621 11.905 199 HG3 LYS 24 3HG LYS 24 -11.691 -0.222 11.012 200 HD2 LYS 24 2HD LYS 24 -13.365 -1.943 10.328 201 HD3 LYS 24 3HD LYS 24 -14.617 -1.059 11.198 202 HE2 LYS 24 2HE LYS 24 -13.016 0.064 8.870 203 HE3 LYS 24 3HE LYS 24 -14.623 -0.649 8.729 204 HZ1 LYS 24 3HZ LYS 24 -15.450 1.071 10.251 205 HZ2 LYS 24 1HZ LYS 24 -14.783 1.729 8.847 206 HZ3 LYS 24 2HZ LYS 24 -13.912 1.775 10.289 207 H SER 25 H SER 25 -10.912 -2.682 10.150 208 HA SER 25 HA SER 25 -13.056 -4.509 9.513 209 HB2 SER 25 2HB SER 25 -12.401 -2.761 7.925 210 HB3 SER 25 3HB SER 25 -10.763 -3.407 7.831 211 HG SER 25 HG SER 25 -13.173 -4.534 6.850 212 H ASP 26 H ASP 26 -9.639 -4.734 10.196 213 HA ASP 26 HA ASP 26 -9.728 -7.547 10.646 214 HB2 ASP 26 2HB ASP 26 -9.426 -7.372 8.074 215 HB3 ASP 26 3HB ASP 26 -7.834 -6.705 8.404 216 HA PRO 27 HA PRO 27 -6.521 -5.468 13.232 217 HB2 PRO 27 2HB PRO 27 -6.692 -7.053 15.404 218 HB3 PRO 27 3HB PRO 27 -8.037 -5.969 14.974 219 HG2 PRO 27 2HG PRO 27 -7.749 -8.914 14.372 220 HG3 PRO 27 3HG PRO 27 -9.129 -8.055 15.101 221 HD2 PRO 27 2HD PRO 27 -9.030 -8.667 12.439 222 HD3 PRO 27 3HD PRO 27 -9.867 -7.224 13.057 223 H ASN 28 H ASN 28 -6.383 -8.401 11.619 224 HA ASN 28 HA ASN 28 -3.993 -9.490 12.943 225 HB2 ASN 28 2HB ASN 28 -5.892 -10.994 12.561 226 HB3 ASN 28 3HB ASN 28 -5.893 -10.613 10.843 227 HD21 ASN 28 1HD2 ASN 28 -5.595 -12.637 10.130 228 HD22 ASN 28 2HD2 ASN 28 -4.154 -13.556 10.363 229 H VAL 29 H VAL 29 -5.012 -8.001 9.887 230 HA VAL 29 HA VAL 29 -2.648 -8.624 8.397 231 HB VAL 29 HB VAL 29 -3.339 -6.841 6.799 232 HG11 VAL 29 1HG1 VAL 29 -4.243 -9.096 6.563 233 HG12 VAL 29 2HG1 VAL 29 -5.434 -7.897 6.062 234 HG13 VAL 29 3HG1 VAL 29 -5.593 -8.694 7.630 235 HG21 VAL 29 3HG2 VAL 29 -5.466 -5.625 7.092 236 HG22 VAL 29 1HG2 VAL 29 -4.304 -5.197 8.353 237 HG23 VAL 29 2HG2 VAL 29 -5.636 -6.297 8.720 238 H LYS 30 H LYS 30 -0.938 -7.158 7.746 239 HA LYS 30 HA LYS 30 0.053 -5.757 10.111 240 HB2 LYS 30 2HB LYS 30 1.569 -6.567 7.594 241 HB3 LYS 30 3HB LYS 30 2.283 -5.925 9.071 242 HG2 LYS 30 2HG LYS 30 0.961 -8.621 8.664 243 HG3 LYS 30 3HG LYS 30 2.638 -8.296 9.097 244 HD2 LYS 30 2HD LYS 30 0.185 -7.884 10.858 245 HD3 LYS 30 3HD LYS 30 1.407 -9.140 11.037 246 HE2 LYS 30 2HE LYS 30 1.842 -6.156 11.435 247 HE3 LYS 30 3HE LYS 30 1.738 -7.375 12.704 248 HZ1 LYS 30 3HZ LYS 30 4.002 -6.882 12.314 249 HZ2 LYS 30 1HZ LYS 30 3.854 -7.115 10.649 250 HZ3 LYS 30 2HZ LYS 30 3.717 -8.430 11.705 251 H THR 31 H THR 31 -0.782 -3.812 10.165 252 HA THR 31 HA THR 31 -0.702 -1.943 7.904 253 HB THR 31 HB THR 31 -2.074 -0.478 9.335 254 HG1 THR 31 HG1 THR 31 -1.220 -2.222 11.323 255 HG21 THR 31 3HG2 THR 31 -3.279 -2.201 8.066 256 HG22 THR 31 1HG2 THR 31 -4.078 -1.898 9.610 257 HG23 THR 31 2HG2 THR 31 -3.083 -3.343 9.399 258 H VAL 32 H VAL 32 1.197 -0.822 7.681 259 HA VAL 32 HA VAL 32 2.677 0.045 10.101 260 HB VAL 32 HB VAL 32 4.023 -1.112 7.616 261 HG11 VAL 32 1HG1 VAL 32 6.077 -1.128 9.000 262 HG12 VAL 32 2HG1 VAL 32 5.189 -0.374 10.325 263 HG13 VAL 32 3HG1 VAL 32 5.429 0.504 8.814 264 HG21 VAL 32 3HG2 VAL 32 2.819 -2.918 8.759 265 HG22 VAL 32 1HG2 VAL 32 3.593 -2.494 10.287 266 HG23 VAL 32 2HG2 VAL 32 4.560 -3.119 8.950 267 H ARG 33 H ARG 33 2.585 2.238 10.022 268 HA ARG 33 HA ARG 33 3.409 3.552 7.512 269 HB2 ARG 33 2HB ARG 33 2.702 5.729 8.902 270 HB3 ARG 33 3HB ARG 33 1.557 4.800 7.973 271 HG2 ARG 33 2HG ARG 33 0.441 5.316 9.956 272 HG3 ARG 33 3HG ARG 33 0.916 3.631 10.150 273 HD2 ARG 33 2HD ARG 33 2.628 4.199 11.721 274 HD3 ARG 33 3HD ARG 33 2.556 5.913 11.293 275 HE ARG 33 HE ARG 33 0.471 6.095 12.408 276 HH11 ARG 33 1HH1 ARG 33 2.007 2.981 12.981 277 HH12 ARG 33 2HH1 ARG 33 1.073 2.652 14.406 278 HH21 ARG 33 1HH2 ARG 33 -0.759 5.646 14.242 279 HH22 ARG 33 2HH2 ARG 33 -0.495 4.166 15.118 280 H THR 34 H THR 34 5.506 3.734 7.373 281 HA THR 34 HA THR 34 7.048 5.338 9.112 282 HB THR 34 HB THR 34 6.983 3.206 10.501 283 HG1 THR 34 HG1 THR 34 9.649 3.681 9.687 284 HG21 THR 34 3HG2 THR 34 7.110 1.539 8.648 285 HG22 THR 34 1HG2 THR 34 8.381 1.296 9.852 286 HG23 THR 34 2HG2 THR 34 8.761 2.065 8.311 287 H ASP 35 H ASP 35 9.384 5.359 8.434 288 HA ASP 35 HA ASP 35 9.767 4.571 5.603 289 HB2 ASP 35 2HB ASP 35 9.544 7.041 5.913 290 HB3 ASP 35 3HB ASP 35 10.888 7.015 7.047 291 H ASP 36 H ASP 36 10.601 2.571 6.352 292 HA ASP 36 HA ASP 36 13.440 2.704 7.225 293 HB2 ASP 36 2HB ASP 36 11.359 0.633 8.040 294 HB3 ASP 36 3HB ASP 36 13.085 0.343 8.208 295 H LYS 37 H LYS 37 11.011 1.237 5.161 296 HA LYS 37 HA LYS 37 11.088 0.334 3.097 297 HB2 LYS 37 2HB LYS 37 12.982 1.886 2.665 298 HB3 LYS 37 3HB LYS 37 14.107 0.662 3.234 299 HG2 LYS 37 2HG LYS 37 13.504 -0.796 1.342 300 HG3 LYS 37 3HG LYS 37 12.317 0.392 0.791 301 HD2 LYS 37 2HD LYS 37 15.332 0.770 0.922 302 HD3 LYS 37 3HD LYS 37 14.352 0.599 -0.533 303 HE2 LYS 37 2HE LYS 37 13.287 2.743 -0.134 304 HE3 LYS 37 3HE LYS 37 14.104 2.905 1.423 305 HZ1 LYS 37 3HZ LYS 37 15.379 2.902 -1.255 306 HZ2 LYS 37 1HZ LYS 37 16.227 2.917 0.208 307 HZ3 LYS 37 2HZ LYS 37 15.228 4.215 -0.205 308 H GLU 38 H GLU 38 14.050 -0.948 4.621 309 HA GLU 38 HA GLU 38 13.790 -3.643 4.012 310 HB2 GLU 38 2HB GLU 38 15.335 -4.025 5.949 311 HB3 GLU 38 3HB GLU 38 15.868 -2.741 4.871 312 HG2 GLU 38 2HG GLU 38 15.010 -1.047 6.464 313 HG3 GLU 38 3HG GLU 38 14.499 -2.338 7.550 314 H LYS 39 H LYS 39 12.370 -1.813 6.712 315 HA LYS 39 HA LYS 39 11.411 -3.987 8.224 316 HB2 LYS 39 2HB LYS 39 11.570 -1.748 9.206 317 HB3 LYS 39 3HB LYS 39 10.343 -1.137 8.099 318 HG2 LYS 39 2HG LYS 39 8.637 -2.551 9.135 319 HG3 LYS 39 3HG LYS 39 9.852 -3.323 10.155 320 HD2 LYS 39 2HD LYS 39 10.248 -1.145 11.298 321 HD3 LYS 39 3HD LYS 39 8.999 -0.404 10.292 322 HE2 LYS 39 2HE LYS 39 7.297 -1.864 11.268 323 HE3 LYS 39 3HE LYS 39 8.527 -2.717 12.207 324 HZ1 LYS 39 3HZ LYS 39 7.903 0.171 12.490 325 HZ2 LYS 39 1HZ LYS 39 8.967 -0.728 13.444 326 HZ3 LYS 39 2HZ LYS 39 7.309 -1.046 13.501 327 H VAL 40 H VAL 40 9.931 -2.112 5.596 328 HA VAL 40 HA VAL 40 7.336 -3.182 5.640 329 HB VAL 40 HB VAL 40 8.973 -2.215 3.239 330 HG11 VAL 40 1HG1 VAL 40 6.784 -1.935 2.068 331 HG12 VAL 40 2HG1 VAL 40 5.983 -2.757 3.409 332 HG13 VAL 40 3HG1 VAL 40 7.157 -3.625 2.421 333 HG21 VAL 40 3HG2 VAL 40 8.649 -0.473 4.958 334 HG22 VAL 40 1HG2 VAL 40 6.904 -0.736 4.918 335 HG23 VAL 40 2HG2 VAL 40 7.733 -0.088 3.499 336 H LYS 41 H LYS 41 10.316 -4.289 4.099 337 HA LYS 41 HA LYS 41 9.270 -6.485 2.651 338 HB2 LYS 41 2HB LYS 41 12.101 -6.024 3.687 339 HB3 LYS 41 3HB LYS 41 11.641 -7.209 2.463 340 HG2 LYS 41 2HG LYS 41 10.934 -5.414 0.950 341 HG3 LYS 41 3HG LYS 41 11.332 -4.202 2.176 342 HD2 LYS 41 2HD LYS 41 13.713 -4.896 2.081 343 HD3 LYS 41 3HD LYS 41 13.312 -6.111 0.861 344 HE2 LYS 41 2HE LYS 41 12.592 -4.315 -0.678 345 HE3 LYS 41 3HE LYS 41 13.003 -3.106 0.545 346 HZ1 LYS 41 3HZ LYS 41 14.758 -3.356 -1.091 347 HZ2 LYS 41 1HZ LYS 41 14.917 -4.998 -0.723 348 HZ3 LYS 41 2HZ LYS 41 15.305 -3.827 0.437 349 H GLU 42 H GLU 42 10.593 -6.178 5.932 350 HA GLU 42 HA GLU 42 10.595 -8.922 6.676 351 HB2 GLU 42 2HB GLU 42 10.245 -6.466 8.460 352 HB3 GLU 42 3HB GLU 42 10.646 -8.086 9.024 353 HG2 GLU 42 2HG GLU 42 12.789 -7.975 7.774 354 HG3 GLU 42 3HG GLU 42 12.382 -6.343 7.251 355 H GLU 43 H GLU 43 8.180 -6.347 6.939 356 HA GLU 43 HA GLU 43 6.197 -7.837 8.329 357 HB2 GLU 43 2HB GLU 43 5.929 -5.302 6.652 358 HB3 GLU 43 3HB GLU 43 4.693 -5.932 7.735 359 HG2 GLU 43 2HG GLU 43 7.447 -5.036 8.622 360 HG3 GLU 43 3HG GLU 43 6.007 -4.025 8.672 361 H ILE 44 H ILE 44 6.942 -7.336 4.920 362 HA ILE 44 HA ILE 44 4.694 -8.479 3.683 363 HB ILE 44 HB ILE 44 7.618 -8.277 2.832 364 HG12 ILE 44 2HG1 ILE 44 5.088 -7.011 1.679 365 HG13 ILE 44 3HG1 ILE 44 6.258 -6.203 2.713 366 HG21 ILE 44 1HG2 ILE 44 7.075 -9.166 0.587 367 HG22 ILE 44 2HG2 ILE 44 5.460 -9.589 1.153 368 HG23 ILE 44 3HG2 ILE 44 6.870 -10.390 1.845 369 HD11 ILE 44 3HD1 ILE 44 6.555 -5.536 0.416 370 HD12 ILE 44 1HD1 ILE 44 6.749 -7.215 -0.091 371 HD13 ILE 44 2HD1 ILE 44 7.959 -6.458 0.949 372 H GLU 45 H GLU 45 7.758 -9.927 4.815 373 HA GLU 45 HA GLU 45 7.360 -12.588 4.076 374 HB2 GLU 45 2HB GLU 45 8.879 -11.556 6.509 375 HB3 GLU 45 3HB GLU 45 9.036 -13.170 5.815 376 HG2 GLU 45 2HG GLU 45 9.866 -12.158 3.711 377 HG3 GLU 45 3HG GLU 45 9.763 -10.568 4.462 378 H LYS 46 H LYS 46 6.586 -10.950 7.096 379 HA LYS 46 HA LYS 46 5.592 -13.170 8.531 380 HB2 LYS 46 2HB LYS 46 5.045 -10.188 8.890 381 HB3 LYS 46 3HB LYS 46 4.707 -11.433 10.096 382 HG2 LYS 46 2HG LYS 46 7.028 -11.891 10.436 383 HG3 LYS 46 3HG LYS 46 7.493 -10.988 8.991 384 HD2 LYS 46 2HD LYS 46 6.634 -8.889 10.153 385 HD3 LYS 46 3HD LYS 46 6.469 -9.857 11.623 386 HE2 LYS 46 2HE LYS 46 8.872 -10.337 11.601 387 HE3 LYS 46 3HE LYS 46 9.056 -9.461 10.080 388 HZ1 LYS 46 3HZ LYS 46 8.402 -7.426 11.216 389 HZ2 LYS 46 1HZ LYS 46 9.749 -8.127 11.957 390 HZ3 LYS 46 2HZ LYS 46 8.226 -8.267 12.675 391 H ALA 47 H ALA 47 4.005 -10.762 6.452 392 HA ALA 47 HA ALA 47 1.321 -11.531 7.033 393 HB1 ALA 47 3HB ALA 47 1.864 -9.312 6.159 394 HB2 ALA 47 1HB ALA 47 0.702 -10.131 5.114 395 HB3 ALA 47 2HB ALA 47 2.401 -10.021 4.634 396 H ARG 48 H ARG 48 3.447 -12.284 4.187 397 HA ARG 48 HA ARG 48 1.470 -13.907 2.923 398 HB2 ARG 48 2HB ARG 48 3.265 -14.548 1.277 399 HB3 ARG 48 3HB ARG 48 2.985 -12.830 1.443 400 HG2 ARG 48 2HG ARG 48 5.328 -13.158 1.147 401 HG3 ARG 48 3HG ARG 48 5.081 -12.663 2.813 402 HD2 ARG 48 2HD ARG 48 5.503 -14.896 3.614 403 HD3 ARG 48 3HD ARG 48 5.464 -15.552 1.981 404 HE ARG 48 HE ARG 48 7.519 -13.923 1.716 405 HH11 ARG 48 1HH1 ARG 48 6.825 -16.013 4.465 406 HH12 ARG 48 2HH1 ARG 48 8.493 -16.214 4.892 407 HH21 ARG 48 1HH2 ARG 48 9.694 -14.176 2.301 408 HH22 ARG 48 2HH2 ARG 48 10.128 -15.170 3.660 409 H LYS 49 H LYS 49 4.028 -14.646 5.183 410 HA LYS 49 HA LYS 49 4.015 -17.487 4.954 411 HB2 LYS 49 2HB LYS 49 5.745 -16.017 6.159 412 HB3 LYS 49 3HB LYS 49 4.602 -15.841 7.472 413 HG2 LYS 49 2HG LYS 49 5.745 -18.519 6.583 414 HG3 LYS 49 3HG LYS 49 6.484 -17.515 7.825 415 HD2 LYS 49 2HD LYS 49 3.743 -18.827 7.954 416 HD3 LYS 49 3HD LYS 49 5.181 -19.298 8.856 417 HE2 LYS 49 2HE LYS 49 5.139 -17.151 10.065 418 HE3 LYS 49 3HE LYS 49 3.711 -16.657 9.150 419 HZ1 LYS 49 3HZ LYS 49 2.475 -18.460 10.130 420 HZ2 LYS 49 1HZ LYS 49 3.165 -17.529 11.359 421 HZ3 LYS 49 2HZ LYS 49 3.840 -19.022 10.946 422 H GLN 50 H GLN 50 2.084 -15.146 6.758 423 HA GLN 50 HA GLN 50 0.423 -17.231 8.004 424 HB2 GLN 50 2HB GLN 50 1.492 -15.317 9.316 425 HB3 GLN 50 3HB GLN 50 0.387 -14.222 8.496 426 HG2 GLN 50 2HG GLN 50 -0.475 -14.716 10.701 427 HG3 GLN 50 3HG GLN 50 -1.527 -15.461 9.499 428 HE21 GLN 50 1HE2 GLN 50 -2.341 -17.016 10.923 429 HE22 GLN 50 2HE2 GLN 50 -1.393 -18.329 11.526 430 H GLY 51 H GLY 51 0.368 -15.906 5.072 431 HA2 GLY 51 2HA GLY 51 -1.197 -15.774 3.409 432 HA3 GLY 51 3HA GLY 51 -2.287 -16.641 4.475 433 H ARG 52 H ARG 52 -0.851 -13.362 4.416 434 HA ARG 52 HA ARG 52 -3.534 -12.157 4.783 435 HB2 ARG 52 2HB ARG 52 -1.003 -11.414 6.324 436 HB3 ARG 52 3HB ARG 52 -2.532 -10.540 6.410 437 HG2 ARG 52 2HG ARG 52 -3.622 -12.449 7.445 438 HG3 ARG 52 3HG ARG 52 -2.167 -13.433 7.248 439 HD2 ARG 52 2HD ARG 52 -2.355 -10.917 8.941 440 HD3 ARG 52 3HD ARG 52 -2.443 -12.571 9.558 441 HE ARG 52 HE ARG 52 -0.066 -12.212 8.062 442 HH11 ARG 52 1HH1 ARG 52 -1.448 -11.372 11.197 443 HH12 ARG 52 2HH1 ARG 52 0.100 -11.262 11.977 444 HH21 ARG 52 1HH2 ARG 52 1.929 -12.130 9.113 445 HH22 ARG 52 2HH2 ARG 52 2.021 -11.697 10.787 446 HA PRO 53 HA PRO 53 -1.791 -8.959 1.972 447 HB2 PRO 53 2HB PRO 53 -3.713 -7.014 2.395 448 HB3 PRO 53 3HB PRO 53 -3.952 -8.391 1.292 449 HG2 PRO 53 2HG PRO 53 -4.981 -7.995 4.069 450 HG3 PRO 53 3HG PRO 53 -5.773 -8.752 2.670 451 HD2 PRO 53 2HD PRO 53 -4.598 -10.185 4.719 452 HD3 PRO 53 3HD PRO 53 -4.802 -10.810 3.070 453 H ILE 54 H ILE 54 -0.600 -7.066 2.348 454 HA ILE 54 HA ILE 54 -0.281 -6.169 5.161 455 HB ILE 54 HB ILE 54 1.741 -7.310 4.615 456 HG12 ILE 54 2HG1 ILE 54 2.127 -4.306 4.266 457 HG13 ILE 54 3HG1 ILE 54 2.201 -5.228 5.762 458 HG21 ILE 54 1HG2 ILE 54 1.447 -7.515 2.183 459 HG22 ILE 54 2HG2 ILE 54 3.082 -6.996 2.591 460 HG23 ILE 54 3HG2 ILE 54 1.915 -5.823 1.978 461 HD11 ILE 54 3HD1 ILE 54 4.392 -4.594 5.118 462 HD12 ILE 54 1HD1 ILE 54 4.186 -5.269 3.502 463 HD13 ILE 54 2HD1 ILE 54 4.241 -6.336 4.907 464 H VAL 55 H VAL 55 -0.778 -4.074 5.495 465 HA VAL 55 HA VAL 55 -1.191 -2.319 3.149 466 HB VAL 55 HB VAL 55 -2.481 -1.811 5.860 467 HG11 VAL 55 1HG1 VAL 55 -2.527 0.013 4.191 468 HG12 VAL 55 2HG1 VAL 55 -4.152 -0.605 4.489 469 HG13 VAL 55 3HG1 VAL 55 -3.291 -1.064 3.018 470 HG21 VAL 55 3HG2 VAL 55 -3.122 -4.117 5.302 471 HG22 VAL 55 1HG2 VAL 55 -3.621 -3.617 3.684 472 HG23 VAL 55 2HG2 VAL 55 -4.507 -3.045 5.095 473 H ILE 56 H ILE 56 0.466 -0.930 2.881 474 HA ILE 56 HA ILE 56 1.990 0.083 5.212 475 HB ILE 56 HB ILE 56 2.767 -0.088 2.260 476 HG12 ILE 56 2HG1 ILE 56 2.765 -2.275 3.424 477 HG13 ILE 56 3HG1 ILE 56 4.402 -1.784 3.013 478 HG21 ILE 56 1HG2 ILE 56 3.824 1.904 3.218 479 HG22 ILE 56 2HG2 ILE 56 5.040 0.653 2.959 480 HG23 ILE 56 3HG2 ILE 56 4.432 0.965 4.587 481 HD11 ILE 56 3HD1 ILE 56 4.757 -1.079 5.352 482 HD12 ILE 56 1HD1 ILE 56 4.330 -2.783 5.206 483 HD13 ILE 56 2HD1 ILE 56 3.121 -1.620 5.741 484 H PHE 57 H PHE 57 1.410 2.046 5.854 485 HA PHE 57 HA PHE 57 0.188 3.987 4.013 486 HB2 PHE 57 2HB PHE 57 0.493 3.980 7.050 487 HB3 PHE 57 3HB PHE 57 -0.289 5.262 6.137 488 HD1 PHE 57 HD2 PHE 57 -0.535 1.645 7.044 489 HD2 PHE 57 HD1 PHE 57 -2.559 5.075 5.481 490 HE1 PHE 57 HE2 PHE 57 -2.691 0.455 7.173 491 HE2 PHE 57 HE1 PHE 57 -4.683 3.875 5.627 492 HZ PHE 57 HZ PHE 57 -4.743 1.586 6.433 493 H ILE 58 H ILE 58 1.512 5.447 3.072 494 HA ILE 58 HA ILE 58 3.597 6.795 4.616 495 HB ILE 58 HB ILE 58 5.163 6.667 2.531 496 HG12 ILE 58 2HG1 ILE 58 3.417 4.234 1.964 497 HG13 ILE 58 3HG1 ILE 58 3.647 5.640 0.927 498 HG21 ILE 58 1HG2 ILE 58 5.730 5.644 4.701 499 HG22 ILE 58 2HG2 ILE 58 6.319 4.668 3.357 500 HG23 ILE 58 3HG2 ILE 58 4.871 4.172 4.238 501 HD11 ILE 58 3HD1 ILE 58 6.033 5.014 0.678 502 HD12 ILE 58 1HD1 ILE 58 4.906 3.804 0.072 503 HD13 ILE 58 2HD1 ILE 58 5.712 3.552 1.615 504 H ARG 59 H ARG 59 4.303 8.781 3.605 505 HA ARG 59 HA ARG 59 2.118 10.141 2.211 506 HB2 ARG 59 2HB ARG 59 3.557 10.937 4.346 507 HB3 ARG 59 3HB ARG 59 4.654 11.540 3.113 508 HG2 ARG 59 2HG ARG 59 2.878 12.964 2.199 509 HG3 ARG 59 3HG ARG 59 1.723 12.301 3.359 510 HD2 ARG 59 2HD ARG 59 3.082 13.230 5.219 511 HD3 ARG 59 3HD ARG 59 4.207 13.918 4.044 512 HE ARG 59 HE ARG 59 1.940 15.040 3.241 513 HH11 ARG 59 1HH1 ARG 59 3.179 14.700 6.524 514 HH12 ARG 59 2HH1 ARG 59 2.407 16.147 7.092 515 HH21 ARG 59 1HH2 ARG 59 0.919 16.919 3.989 516 HH22 ARG 59 2HH2 ARG 59 1.116 17.410 5.641 517 H GLY 60 H GLY 60 2.982 11.878 0.499 518 HA2 GLY 60 2HA GLY 60 3.625 10.385 -1.773 519 HA3 GLY 60 3HA GLY 60 3.629 12.130 -1.682 520 H ALA 61 H ALA 61 5.826 12.246 0.275 521 HA ALA 61 HA ALA 61 8.107 12.122 -1.446 522 HB1 ALA 61 3HB ALA 61 9.398 12.761 0.568 523 HB2 ALA 61 1HB ALA 61 7.977 12.450 1.576 524 HB3 ALA 61 2HB ALA 61 7.950 13.754 0.388 525 H TYR 62 H TYR 62 7.023 10.219 1.328 526 HA TYR 62 HA TYR 62 9.133 8.346 1.440 527 HB2 TYR 62 2HB TYR 62 6.285 8.087 2.484 528 HB3 TYR 62 3HB TYR 62 7.647 7.074 2.958 529 HD1 TYR 62 HD2 TYR 62 9.824 8.738 3.611 530 HD2 TYR 62 HD1 TYR 62 5.677 9.591 4.189 531 HE1 TYR 62 HE2 TYR 62 10.396 10.279 5.429 532 HE2 TYR 62 HE1 TYR 62 6.252 11.142 6.015 533 HH TYR 62 HH TYR 62 9.447 12.192 6.598 534 H GLU 63 H GLU 63 6.243 8.473 -0.492 535 HA GLU 63 HA GLU 63 5.792 5.862 -1.269 536 HB2 GLU 63 2HB GLU 63 4.333 7.737 -1.826 537 HB3 GLU 63 3HB GLU 63 5.545 8.387 -2.930 538 HG2 GLU 63 2HG GLU 63 5.328 6.234 -4.276 539 HG3 GLU 63 3HG GLU 63 3.964 5.813 -3.241 540 H GLU 64 H GLU 64 8.440 7.951 -2.289 541 HA GLU 64 HA GLU 64 9.341 6.702 -4.608 542 HB2 GLU 64 2HB GLU 64 10.270 8.808 -3.669 543 HB3 GLU 64 3HB GLU 64 11.024 7.892 -2.367 544 HG2 GLU 64 2HG GLU 64 12.689 8.430 -4.051 545 HG3 GLU 64 3HG GLU 64 12.408 6.686 -4.027 546 H VAL 65 H VAL 65 9.641 5.695 -1.292 547 HA VAL 65 HA VAL 65 11.583 3.678 -1.424 548 HB VAL 65 HB VAL 65 9.234 4.137 0.445 549 HG11 VAL 65 1HG1 VAL 65 11.509 2.219 0.871 550 HG12 VAL 65 2HG1 VAL 65 9.818 1.793 0.630 551 HG13 VAL 65 3HG1 VAL 65 10.308 2.668 2.080 552 HG21 VAL 65 3HG2 VAL 65 10.906 5.085 1.976 553 HG22 VAL 65 1HG2 VAL 65 10.928 5.931 0.426 554 HG23 VAL 65 2HG2 VAL 65 12.184 4.747 0.804 555 H VAL 66 H VAL 66 8.096 3.599 -2.170 556 HA VAL 66 HA VAL 66 7.523 0.874 -2.098 557 HB VAL 66 HB VAL 66 6.430 2.837 -4.175 558 HG11 VAL 66 1HG1 VAL 66 4.458 1.322 -4.281 559 HG12 VAL 66 2HG1 VAL 66 5.272 0.188 -3.203 560 HG13 VAL 66 3HG1 VAL 66 5.935 0.512 -4.804 561 HG21 VAL 66 3HG2 VAL 66 6.085 3.661 -1.890 562 HG22 VAL 66 1HG2 VAL 66 5.323 2.137 -1.438 563 HG23 VAL 66 2HG2 VAL 66 4.551 3.191 -2.627 564 H ARG 67 H ARG 67 9.126 2.753 -4.599 565 HA ARG 67 HA ARG 67 9.047 1.084 -6.815 566 HB2 ARG 67 2HB ARG 67 9.862 3.455 -6.731 567 HB3 ARG 67 3HB ARG 67 11.312 2.912 -5.900 568 HG2 ARG 67 2HG ARG 67 11.678 1.436 -8.055 569 HG3 ARG 67 3HG ARG 67 10.534 2.556 -8.801 570 HD2 ARG 67 2HD ARG 67 12.751 3.386 -9.256 571 HD3 ARG 67 3HD ARG 67 12.051 4.455 -8.034 572 HE ARG 67 HE ARG 67 13.895 2.231 -7.335 573 HH11 ARG 67 1HH1 ARG 67 13.036 5.639 -7.012 574 HH12 ARG 67 2HH1 ARG 67 14.285 5.950 -5.851 575 HH21 ARG 67 1HH2 ARG 67 15.490 2.680 -5.798 576 HH22 ARG 67 2HH2 ARG 67 15.663 4.289 -5.168 577 H ASP 68 H ASP 68 11.335 1.120 -4.116 578 HA ASP 68 HA ASP 68 13.039 -1.000 -5.054 579 HB2 ASP 68 2HB ASP 68 13.819 0.902 -3.636 580 HB3 ASP 68 3HB ASP 68 12.828 0.310 -2.307 581 H ILE 69 H ILE 69 10.366 -0.719 -2.736 582 HA ILE 69 HA ILE 69 10.396 -3.281 -1.535 583 HB ILE 69 HB ILE 69 8.019 -1.425 -2.051 584 HG12 ILE 69 2HG1 ILE 69 9.688 -1.673 0.499 585 HG13 ILE 69 3HG1 ILE 69 9.908 -0.410 -0.707 586 HG21 ILE 69 1HG2 ILE 69 8.203 -3.727 -0.073 587 HG22 ILE 69 2HG2 ILE 69 7.218 -3.692 -1.535 588 HG23 ILE 69 3HG2 ILE 69 6.858 -2.593 -0.203 589 HD11 ILE 69 3HD1 ILE 69 7.662 0.417 -0.282 590 HD12 ILE 69 1HD1 ILE 69 8.616 0.373 1.198 591 HD13 ILE 69 2HD1 ILE 69 7.396 -0.865 0.902 592 H VAL 70 H VAL 70 8.999 -2.090 -4.542 593 HA VAL 70 HA VAL 70 7.220 -4.047 -5.344 594 HB VAL 70 HB VAL 70 9.070 -2.201 -6.921 595 HG11 VAL 70 1HG1 VAL 70 7.851 -2.760 -9.006 596 HG12 VAL 70 2HG1 VAL 70 7.015 -4.063 -8.161 597 HG13 VAL 70 3HG1 VAL 70 8.763 -4.139 -8.387 598 HG21 VAL 70 3HG2 VAL 70 6.976 -1.004 -7.476 599 HG22 VAL 70 1HG2 VAL 70 7.182 -1.149 -5.730 600 HG23 VAL 70 2HG2 VAL 70 6.049 -2.202 -6.571 601 H GLU 71 H GLU 71 10.721 -3.905 -5.794 602 HA GLU 71 HA GLU 71 11.099 -6.137 -7.459 603 HB2 GLU 71 2HB GLU 71 13.040 -4.937 -5.436 604 HB3 GLU 71 3HB GLU 71 13.474 -5.976 -6.796 605 HG2 GLU 71 2HG GLU 71 12.727 -4.268 -8.384 606 HG3 GLU 71 3HG GLU 71 12.182 -3.241 -7.057 607 H TYR 72 H TYR 72 11.116 -5.811 -3.920 608 HA TYR 72 HA TYR 72 11.924 -8.484 -3.349 609 HB2 TYR 72 2HB TYR 72 12.215 -6.633 -1.693 610 HB3 TYR 72 3HB TYR 72 10.465 -6.521 -1.513 611 HD1 TYR 72 HD1 TYR 72 13.379 -8.791 -1.034 612 HD2 TYR 72 HD2 TYR 72 9.291 -8.047 -0.024 613 HE1 TYR 72 HE1 TYR 72 13.441 -10.629 0.582 614 HE2 TYR 72 HE2 TYR 72 9.349 -9.896 1.594 615 HH TYR 72 HH TYR 72 12.194 -11.300 2.660 616 H ALA 73 H ALA 73 8.764 -6.849 -3.382 617 HA ALA 73 HA ALA 73 7.221 -8.989 -2.390 618 HB1 ALA 73 3HB ALA 73 6.451 -6.669 -2.358 619 HB2 ALA 73 1HB ALA 73 5.285 -7.696 -3.196 620 HB3 ALA 73 2HB ALA 73 6.370 -6.652 -4.121 621 H GLN 74 H GLN 74 8.256 -8.128 -5.654 622 HA GLN 74 HA GLN 74 6.753 -10.106 -7.070 623 HB2 GLN 74 2HB GLN 74 9.218 -8.494 -7.792 624 HB3 GLN 74 3HB GLN 74 8.527 -9.680 -8.897 625 HG2 GLN 74 2HG GLN 74 6.369 -8.413 -8.838 626 HG3 GLN 74 3HG GLN 74 7.158 -7.196 -7.830 627 HE21 GLN 74 1HE2 GLN 74 6.802 -5.602 -9.403 628 HE22 GLN 74 2HE2 GLN 74 7.736 -5.530 -10.851 629 H LYS 75 H LYS 75 9.897 -10.173 -5.433 630 HA LYS 75 HA LYS 75 10.792 -12.693 -6.393 631 HB2 LYS 75 2HB LYS 75 11.367 -11.290 -3.744 632 HB3 LYS 75 3HB LYS 75 12.162 -12.778 -4.243 633 HG2 LYS 75 2HG LYS 75 12.334 -10.105 -5.664 634 HG3 LYS 75 3HG LYS 75 13.584 -10.826 -4.653 635 HD2 LYS 75 2HD LYS 75 12.568 -11.900 -7.316 636 HD3 LYS 75 3HD LYS 75 14.129 -11.135 -7.015 637 HE2 LYS 75 2HE LYS 75 14.769 -13.004 -5.532 638 HE3 LYS 75 3HE LYS 75 13.204 -13.771 -5.814 639 HZ1 LYS 75 3HZ LYS 75 14.901 -14.744 -7.217 640 HZ2 LYS 75 1HZ LYS 75 15.274 -13.232 -7.879 641 HZ3 LYS 75 2HZ LYS 75 13.764 -13.933 -8.167 642 H GLU 76 H GLU 76 8.637 -11.748 -3.783 643 HA GLU 76 HA GLU 76 8.212 -14.415 -2.753 644 HB2 GLU 76 2HB GLU 76 6.523 -11.932 -2.236 645 HB3 GLU 76 3HB GLU 76 6.650 -13.367 -1.224 646 HG2 GLU 76 2HG GLU 76 8.751 -11.233 -1.673 647 HG3 GLU 76 3HG GLU 76 7.866 -11.565 -0.185 648 H GLY 77 H GLY 77 7.110 -12.796 -5.494 649 HA2 GLY 77 2HA GLY 77 5.685 -13.515 -7.161 650 HA3 GLY 77 3HA GLY 77 5.169 -14.843 -6.138 651 H LEU 78 H LEU 78 5.017 -11.781 -4.672 652 HA LEU 78 HA LEU 78 2.122 -11.883 -4.496 653 HB2 LEU 78 2HB LEU 78 4.028 -9.814 -3.309 654 HB3 LEU 78 3HB LEU 78 2.355 -10.094 -2.844 655 HG LEU 78 HG LEU 78 4.699 -11.967 -2.355 656 HD11 LEU 78 1HD1 LEU 78 3.060 -10.328 -0.406 657 HD12 LEU 78 2HD1 LEU 78 4.748 -10.063 -0.861 658 HD13 LEU 78 3HD1 LEU 78 4.297 -11.514 0.029 659 HD21 LEU 78 3HD2 LEU 78 3.143 -13.389 -1.101 660 HD22 LEU 78 1HD2 LEU 78 2.704 -13.287 -2.803 661 HD23 LEU 78 2HD2 LEU 78 1.793 -12.368 -1.604 662 H ARG 79 H ARG 79 0.717 -10.384 -5.334 663 HA ARG 79 HA ARG 79 1.524 -8.690 -7.517 664 HB2 ARG 79 2HB ARG 79 -0.812 -9.951 -6.988 665 HB3 ARG 79 3HB ARG 79 -1.201 -8.437 -6.197 666 HG2 ARG 79 2HG ARG 79 -0.480 -8.799 -9.128 667 HG3 ARG 79 3HG ARG 79 -2.096 -8.530 -8.483 668 HD2 ARG 79 2HD ARG 79 -1.412 -6.272 -7.731 669 HD3 ARG 79 3HD ARG 79 0.213 -6.550 -8.364 670 HE ARG 79 HE ARG 79 -2.248 -6.172 -9.932 671 HH11 ARG 79 1HH1 ARG 79 1.278 -6.392 -9.931 672 HH12 ARG 79 2HH1 ARG 79 1.413 -5.829 -11.568 673 HH21 ARG 79 1HH2 ARG 79 -2.023 -5.428 -12.059 674 HH22 ARG 79 2HH2 ARG 79 -0.443 -5.287 -12.761 675 H VAL 80 H VAL 80 1.978 -6.504 -7.384 676 HA VAL 80 HA VAL 80 1.981 -5.222 -4.720 677 HB VAL 80 HB VAL 80 3.527 -4.258 -7.183 678 HG11 VAL 80 1HG1 VAL 80 3.144 -2.561 -5.445 679 HG12 VAL 80 2HG1 VAL 80 4.854 -2.982 -5.532 680 HG13 VAL 80 3HG1 VAL 80 3.854 -3.622 -4.224 681 HG21 VAL 80 3HG2 VAL 80 5.557 -5.312 -6.253 682 HG22 VAL 80 1HG2 VAL 80 4.332 -6.522 -6.651 683 HG23 VAL 80 2HG2 VAL 80 4.594 -6.052 -4.972 684 H LEU 81 H LEU 81 0.707 -3.504 -4.428 685 HA LEU 81 HA LEU 81 -0.810 -2.323 -6.657 686 HB2 LEU 81 2HB LEU 81 -2.081 -4.253 -5.756 687 HB3 LEU 81 3HB LEU 81 -1.969 -3.589 -4.144 688 HG LEU 81 HG LEU 81 -3.425 -1.706 -4.779 689 HD11 LEU 81 1HD1 LEU 81 -2.777 -1.432 -7.081 690 HD12 LEU 81 2HD1 LEU 81 -4.519 -1.659 -6.973 691 HD13 LEU 81 3HD1 LEU 81 -3.489 -2.990 -7.505 692 HD21 LEU 81 3HD2 LEU 81 -5.522 -2.952 -5.095 693 HD22 LEU 81 1HD2 LEU 81 -4.479 -3.751 -3.918 694 HD23 LEU 81 2HD2 LEU 81 -4.607 -4.392 -5.558 695 H VAL 82 H VAL 82 -0.275 -0.224 -6.460 696 HA VAL 82 HA VAL 82 0.167 0.970 -3.791 697 HB VAL 82 HB VAL 82 0.718 2.241 -6.516 698 HG11 VAL 82 1HG1 VAL 82 1.761 2.968 -3.749 699 HG12 VAL 82 2HG1 VAL 82 0.559 3.869 -4.677 700 HG13 VAL 82 3HG1 VAL 82 2.220 3.756 -5.260 701 HG21 VAL 82 3HG2 VAL 82 2.646 0.659 -4.785 702 HG22 VAL 82 1HG2 VAL 82 3.079 1.583 -6.224 703 HG23 VAL 82 2HG2 VAL 82 2.018 0.181 -6.367 704 H ILE 83 H ILE 83 -1.622 1.830 -2.947 705 HA ILE 83 HA ILE 83 -3.748 2.867 -4.681 706 HB ILE 83 HB ILE 83 -4.094 2.773 -1.679 707 HG12 ILE 83 2HG1 ILE 83 -4.507 0.219 -3.302 708 HG13 ILE 83 3HG1 ILE 83 -3.008 0.524 -2.424 709 HG21 ILE 83 1HG2 ILE 83 -6.398 2.180 -2.361 710 HG22 ILE 83 2HG2 ILE 83 -5.901 2.180 -4.045 711 HG23 ILE 83 3HG2 ILE 83 -5.854 3.676 -3.113 712 HD11 ILE 83 3HD1 ILE 83 -4.594 -0.859 -1.169 713 HD12 ILE 83 1HD1 ILE 83 -5.744 0.477 -1.152 714 HD13 ILE 83 2HD1 ILE 83 -4.186 0.636 -0.331 715 H LYS 84 H LYS 84 -4.092 5.084 -4.741 716 HA LYS 84 HA LYS 84 -2.115 6.738 -3.293 717 HB2 LYS 84 2HB LYS 84 -1.119 5.745 -5.329 718 HB3 LYS 84 3HB LYS 84 -2.453 6.350 -6.305 719 HG2 LYS 84 2HG LYS 84 -1.736 8.644 -5.928 720 HG3 LYS 84 3HG LYS 84 -0.446 8.091 -4.848 721 HD2 LYS 84 2HD LYS 84 0.617 6.876 -6.709 722 HD3 LYS 84 3HD LYS 84 -0.684 7.379 -7.801 723 HE2 LYS 84 2HE LYS 84 1.332 8.770 -8.069 724 HE3 LYS 84 3HE LYS 84 -0.054 9.709 -7.504 725 HZ1 LYS 84 3HZ LYS 84 2.147 8.693 -5.797 726 HZ2 LYS 84 1HZ LYS 84 0.827 9.600 -5.263 727 HZ3 LYS 84 2HZ LYS 84 1.961 10.289 -6.307 728 H VAL 85 H VAL 85 -2.992 8.578 -2.626 729 HA VAL 85 HA VAL 85 -5.449 9.676 -3.746 730 HB VAL 85 HB VAL 85 -3.636 10.803 -1.544 731 HG11 VAL 85 1HG1 VAL 85 -5.531 12.254 -0.925 732 HG12 VAL 85 2HG1 VAL 85 -6.473 11.619 -2.276 733 HG13 VAL 85 3HG1 VAL 85 -5.016 12.567 -2.585 734 HG21 VAL 85 3HG2 VAL 85 -4.591 8.638 -0.868 735 HG22 VAL 85 1HG2 VAL 85 -6.215 9.215 -1.248 736 HG23 VAL 85 2HG2 VAL 85 -5.303 9.949 0.074 737 H ALA 86 H ALA 86 -5.494 11.227 -5.277 738 HA ALA 86 HA ALA 86 -3.094 12.645 -6.139 739 HB1 ALA 86 3HB ALA 86 -3.117 11.595 -8.382 740 HB2 ALA 86 1HB ALA 86 -4.391 10.489 -7.852 741 HB3 ALA 86 2HB ALA 86 -2.787 10.407 -7.121 742 H GLN 87 H GLN 87 -3.637 14.504 -7.139 743 HA GLN 87 HA GLN 87 -6.332 14.860 -8.343 744 HB2 GLN 87 2HB GLN 87 -4.726 16.893 -6.716 745 HB3 GLN 87 3HB GLN 87 -6.216 17.266 -7.574 746 HG2 GLN 87 2HG GLN 87 -5.931 15.361 -5.225 747 HG3 GLN 87 3HG GLN 87 -6.615 16.985 -5.168 748 HE21 GLN 87 1HE2 GLN 87 -7.827 14.375 -4.487 749 HE22 GLN 87 2HE2 GLN 87 -9.245 14.249 -5.465 750 H ASP 88 H ASP 88 -3.081 14.681 -8.897 751 HA ASP 88 HA ASP 88 -2.533 17.067 -10.412 752 HB2 ASP 88 2HB ASP 88 -0.871 14.499 -10.311 753 HB3 ASP 88 3HB ASP 88 -0.300 16.124 -10.684 754 H GLN 89 H GLN 89 -2.600 13.602 -11.204 755 HA GLN 89 HA GLN 89 -2.892 12.343 -12.992 756 HB2 GLN 89 2HB GLN 89 -4.329 14.693 -14.283 757 HB3 GLN 89 3HB GLN 89 -4.336 13.036 -14.880 758 HG2 GLN 89 2HG GLN 89 -5.419 12.346 -12.697 759 HG3 GLN 89 3HG GLN 89 -5.567 14.061 -12.304 760 HE21 GLN 89 1HE2 GLN 89 -6.980 15.361 -13.600 761 HE22 GLN 89 2HE2 GLN 89 -8.247 14.652 -14.533 762 H GLU 90 H GLU 90 -2.137 15.576 -14.428 763 HA GLU 90 HA GLU 90 -0.574 14.545 -16.564 764 HB2 GLU 90 2HB GLU 90 -1.657 16.747 -16.672 765 HB3 GLU 90 3HB GLU 90 -0.662 17.335 -15.344 766 HG2 GLU 90 2HG GLU 90 1.364 17.055 -16.780 767 HG3 GLU 90 3HG GLU 90 0.324 16.550 -18.111 768 H LEU 91 H LEU 91 0.505 16.308 -13.614 769 HA LEU 91 HA LEU 91 3.298 15.845 -14.023 770 HB2 LEU 91 2HB LEU 91 2.430 17.782 -12.738 771 HB3 LEU 91 3HB LEU 91 1.809 16.699 -11.505 772 HG LEU 91 HG LEU 91 4.121 16.036 -10.892 773 HD11 LEU 91 1HD1 LEU 91 6.079 17.191 -11.824 774 HD12 LEU 91 2HD1 LEU 91 5.049 18.004 -13.006 775 HD13 LEU 91 3HD1 LEU 91 5.229 16.248 -13.046 776 HD21 LEU 91 3HD2 LEU 91 3.099 17.927 -9.708 777 HD22 LEU 91 1HD2 LEU 91 3.755 19.052 -10.901 778 HD23 LEU 91 2HD2 LEU 91 4.841 18.139 -9.850 779 H LEU 92 H LEU 92 0.746 14.131 -12.520 780 HA LEU 92 HA LEU 92 1.942 12.510 -10.618 781 HB2 LEU 92 2HB LEU 92 -0.568 12.912 -11.359 782 HB3 LEU 92 3HB LEU 92 -0.296 11.555 -12.431 783 HG LEU 92 HG LEU 92 0.354 10.222 -10.312 784 HD11 LEU 92 1HD1 LEU 92 -0.915 12.642 -8.988 785 HD12 LEU 92 2HD1 LEU 92 0.751 12.078 -8.809 786 HD13 LEU 92 3HD1 LEU 92 -0.578 11.101 -8.195 787 HD21 LEU 92 3HD2 LEU 92 -1.767 9.860 -11.504 788 HD22 LEU 92 1HD2 LEU 92 -2.518 11.187 -10.608 789 HD23 LEU 92 2HD2 LEU 92 -1.998 9.728 -9.761 790 H GLU 93 H GLU 93 1.700 12.196 -14.112 791 HA GLU 93 HA GLU 93 1.942 9.477 -14.497 792 HB2 GLU 93 2HB GLU 93 2.851 11.724 -16.345 793 HB3 GLU 93 3HB GLU 93 2.621 10.052 -16.844 794 HG2 GLU 93 2HG GLU 93 0.452 11.875 -15.787 795 HG3 GLU 93 3HG GLU 93 0.749 11.529 -17.485 796 H ARG 94 H ARG 94 4.583 11.711 -13.741 797 HA ARG 94 HA ARG 94 6.608 10.365 -15.190 798 HB2 ARG 94 2HB ARG 94 6.827 12.711 -14.354 799 HB3 ARG 94 3HB ARG 94 7.033 12.087 -12.718 800 HG2 ARG 94 2HG ARG 94 9.092 10.952 -13.349 801 HG3 ARG 94 3HG ARG 94 8.842 11.358 -15.046 802 HD2 ARG 94 2HD ARG 94 9.090 13.776 -14.456 803 HD3 ARG 94 3HD ARG 94 9.474 13.296 -12.796 804 HE ARG 94 HE ARG 94 11.247 11.855 -14.214 805 HH11 ARG 94 1HH1 ARG 94 10.511 15.312 -14.332 806 HH12 ARG 94 2HH1 ARG 94 12.118 15.742 -14.835 807 HH21 ARG 94 1HH2 ARG 94 13.317 12.442 -14.899 808 HH22 ARG 94 2HH2 ARG 94 13.699 14.118 -15.155 809 H PHE 95 H PHE 95 5.866 10.201 -11.665 810 HA PHE 95 HA PHE 95 7.565 7.881 -11.278 811 HB2 PHE 95 2HB PHE 95 7.245 9.515 -9.433 812 HB3 PHE 95 3HB PHE 95 5.520 9.167 -9.404 813 HD1 PHE 95 HD2 PHE 95 8.885 7.642 -8.801 814 HD2 PHE 95 HD1 PHE 95 4.671 7.333 -8.057 815 HE1 PHE 95 HE2 PHE 95 9.294 5.850 -7.165 816 HE2 PHE 95 HE1 PHE 95 5.104 5.538 -6.428 817 HZ PHE 95 HZ PHE 95 7.412 4.796 -5.980 818 H TYR 96 H TYR 96 4.132 8.574 -11.456 819 HA TYR 96 HA TYR 96 2.950 6.242 -10.571 820 HB2 TYR 96 2HB TYR 96 1.798 8.354 -10.865 821 HB3 TYR 96 3HB TYR 96 2.100 8.346 -12.588 822 HD1 TYR 96 HD1 TYR 96 0.027 6.909 -9.877 823 HD2 TYR 96 HD2 TYR 96 0.632 7.159 -14.099 824 HE1 TYR 96 HE1 TYR 96 -2.243 6.069 -10.259 825 HE2 TYR 96 HE2 TYR 96 -1.615 6.288 -14.477 826 HH TYR 96 HH TYR 96 -3.972 6.139 -12.084 827 H GLU 97 H GLU 97 4.213 6.951 -13.808 828 HA GLU 97 HA GLU 97 2.829 4.776 -15.138 829 HB2 GLU 97 2HB GLU 97 3.248 6.853 -16.363 830 HB3 GLU 97 3HB GLU 97 4.989 6.694 -16.114 831 HG2 GLU 97 2HG GLU 97 4.904 4.558 -17.486 832 HG3 GLU 97 3HG GLU 97 3.214 4.909 -17.835 833 H GLN 98 H GLN 98 5.991 5.387 -13.741 834 HA GLN 98 HA GLN 98 7.588 3.512 -15.077 835 HB2 GLN 98 2HB GLN 98 7.796 4.433 -12.185 836 HB3 GLN 98 3HB GLN 98 9.089 3.646 -13.088 837 HG2 GLN 98 2HG GLN 98 7.966 6.423 -13.411 838 HG3 GLN 98 3HG GLN 98 9.617 5.951 -13.032 839 HE21 GLN 98 1HE2 GLN 98 7.285 6.451 -15.541 840 HE22 GLN 98 2HE2 GLN 98 8.367 6.288 -16.875 841 H LEU 99 H LEU 99 5.547 3.187 -12.226 842 HA LEU 99 HA LEU 99 6.283 0.500 -11.576 843 HB2 LEU 99 2HB LEU 99 4.005 2.289 -10.643 844 HB3 LEU 99 3HB LEU 99 4.219 0.647 -10.060 845 HG LEU 99 HG LEU 99 6.515 1.323 -9.191 846 HD11 LEU 99 1HD1 LEU 99 5.597 4.141 -9.808 847 HD12 LEU 99 2HD1 LEU 99 6.941 3.285 -10.566 848 HD13 LEU 99 3HD1 LEU 99 7.020 3.702 -8.855 849 HD21 LEU 99 3HD2 LEU 99 4.153 2.813 -8.019 850 HD22 LEU 99 1HD2 LEU 99 5.670 2.456 -7.184 851 HD23 LEU 99 2HD2 LEU 99 4.607 1.140 -7.684 852 H LYS 100 H LYS 100 3.574 2.010 -13.349 853 HA LYS 100 HA LYS 100 2.080 -0.392 -13.782 854 HB2 LYS 100 2HB LYS 100 1.990 2.185 -15.410 855 HB3 LYS 100 3HB LYS 100 0.773 0.910 -15.411 856 HG2 LYS 100 2HG LYS 100 0.427 1.419 -12.926 857 HG3 LYS 100 3HG LYS 100 1.441 2.842 -13.174 858 HD2 LYS 100 2HD LYS 100 -0.718 3.725 -13.440 859 HD3 LYS 100 3HD LYS 100 -0.243 3.420 -15.107 860 HE2 LYS 100 2HE LYS 100 -2.043 1.669 -13.397 861 HE3 LYS 100 3HE LYS 100 -2.552 2.720 -14.716 862 HZ1 LYS 100 3HZ LYS 100 -1.281 1.315 -16.244 863 HZ2 LYS 100 1HZ LYS 100 -2.461 0.428 -15.424 864 HZ3 LYS 100 2HZ LYS 100 -0.845 0.303 -14.965 865 H LYS 101 H LYS 101 4.700 1.170 -15.445 866 HA LYS 101 HA LYS 101 4.541 -0.029 -18.015 867 HB2 LYS 101 2HB LYS 101 5.773 2.074 -17.503 868 HB3 LYS 101 3HB LYS 101 6.930 1.164 -16.538 869 HG2 LYS 101 2HG LYS 101 7.621 -0.073 -18.599 870 HG3 LYS 101 3HG LYS 101 6.510 0.920 -19.545 871 HD2 LYS 101 2HD LYS 101 8.963 1.858 -18.014 872 HD3 LYS 101 3HD LYS 101 8.757 1.817 -19.766 873 HE2 LYS 101 2HE LYS 101 7.224 3.590 -17.829 874 HE3 LYS 101 3HE LYS 101 8.512 4.101 -18.915 875 HZ1 LYS 101 3HZ LYS 101 6.356 4.636 -19.829 876 HZ2 LYS 101 1HZ LYS 101 5.873 3.019 -19.747 877 HZ3 LYS 101 2HZ LYS 101 7.116 3.478 -20.796 878 H ASP 102 H ASP 102 6.321 -0.738 -15.057 879 HA ASP 102 HA ASP 102 7.549 -3.163 -15.796 880 HB2 ASP 102 2HB ASP 102 8.129 -1.904 -13.744 881 HB3 ASP 102 3HB ASP 102 6.520 -2.169 -13.091 882 H GLY 103 H GLY 103 4.487 -2.496 -14.089 883 HA2 GLY 103 2HA GLY 103 2.618 -3.937 -15.274 884 HA3 GLY 103 3HA GLY 103 3.493 -5.228 -14.456 885 H VAL 104 H VAL 104 4.019 -2.967 -12.320 886 HA VAL 104 HA VAL 104 2.312 -3.879 -10.323 887 HB VAL 104 HB VAL 104 3.756 -1.191 -10.496 888 HG11 VAL 104 1HG1 VAL 104 2.703 -2.592 -8.018 889 HG12 VAL 104 2HG1 VAL 104 2.083 -1.096 -8.713 890 HG13 VAL 104 3HG1 VAL 104 3.708 -1.138 -8.026 891 HG21 VAL 104 3HG2 VAL 104 5.271 -3.100 -10.800 892 HG22 VAL 104 1HG2 VAL 104 4.702 -3.812 -9.287 893 HG23 VAL 104 2HG2 VAL 104 5.588 -2.284 -9.267 894 H ASP 105 H ASP 105 0.182 -3.563 -9.976 895 HA ASP 105 HA ASP 105 -1.335 -1.619 -11.476 896 HB2 ASP 105 2HB ASP 105 -2.161 -3.973 -10.610 897 HB3 ASP 105 3HB ASP 105 -2.460 -3.152 -9.097 898 H VAL 106 H VAL 106 -2.403 0.169 -10.646 899 HA VAL 106 HA VAL 106 -1.808 1.022 -7.881 900 HB VAL 106 HB VAL 106 -1.555 3.391 -8.707 901 HG11 VAL 106 1HG1 VAL 106 0.760 3.251 -9.507 902 HG12 VAL 106 2HG1 VAL 106 0.557 1.527 -9.855 903 HG13 VAL 106 3HG1 VAL 106 0.484 2.105 -8.189 904 HG21 VAL 106 3HG2 VAL 106 -1.454 2.105 -11.454 905 HG22 VAL 106 1HG2 VAL 106 -1.042 3.788 -11.108 906 HG23 VAL 106 2HG2 VAL 106 -2.690 3.214 -10.855 907 H ARG 107 H ARG 107 -3.665 1.582 -6.855 908 HA ARG 107 HA ARG 107 -6.103 2.073 -8.437 909 HB2 ARG 107 2HB ARG 107 -5.751 1.351 -5.509 910 HB3 ARG 107 3HB ARG 107 -7.294 1.842 -6.208 911 HG2 ARG 107 2HG ARG 107 -7.116 -0.071 -7.808 912 HG3 ARG 107 3HG ARG 107 -5.669 -0.601 -6.947 913 HD2 ARG 107 2HD ARG 107 -7.610 -1.836 -6.200 914 HD3 ARG 107 3HD ARG 107 -7.007 -0.839 -4.879 915 HE ARG 107 HE ARG 107 -8.942 0.686 -6.069 916 HH11 ARG 107 1HH1 ARG 107 -9.008 -2.573 -4.718 917 HH12 ARG 107 2HH1 ARG 107 -10.685 -2.468 -4.268 918 HH21 ARG 107 1HH2 ARG 107 -11.135 0.779 -5.463 919 HH22 ARG 107 2HH2 ARG 107 -11.874 -0.590 -4.687 920 H VAL 108 H VAL 108 -6.446 4.091 -8.884 921 HA VAL 108 HA VAL 108 -5.513 6.275 -7.160 922 HB VAL 108 HB VAL 108 -6.600 7.793 -8.946 923 HG11 VAL 108 1HG1 VAL 108 -4.348 5.953 -9.832 924 HG12 VAL 108 2HG1 VAL 108 -4.181 7.394 -8.828 925 HG13 VAL 108 3HG1 VAL 108 -4.705 7.549 -10.505 926 HG21 VAL 108 3HG2 VAL 108 -8.136 6.179 -9.993 927 HG22 VAL 108 1HG2 VAL 108 -6.775 5.191 -10.528 928 HG23 VAL 108 2HG2 VAL 108 -7.009 6.813 -11.194 929 H THR 109 H THR 109 -6.669 6.784 -5.498 930 HA THR 109 HA THR 109 -9.513 6.115 -5.314 931 HB THR 109 HB THR 109 -8.046 5.379 -3.470 932 HG1 THR 109 HG1 THR 109 -9.841 7.433 -2.637 933 HG21 THR 109 3HG2 THR 109 -7.073 6.980 -1.885 934 HG22 THR 109 1HG2 THR 109 -7.592 8.330 -2.894 935 HG23 THR 109 2HG2 THR 109 -6.373 7.199 -3.490 936 H ASP 110 H ASP 110 -7.360 8.863 -5.459 937 HA ASP 110 HA ASP 110 -7.609 11.026 -5.965 938 HB2 ASP 110 2HB ASP 110 -9.295 10.201 -7.622 939 HB3 ASP 110 3HB ASP 110 -10.554 10.421 -6.421 940 H ASN 111 H ASN 111 -10.682 10.338 -4.274 941 HA ASN 111 HA ASN 111 -10.391 12.625 -2.508 942 HB2 ASN 111 2HB ASN 111 -12.615 10.554 -2.781 943 HB3 ASN 111 3HB ASN 111 -12.693 11.973 -1.738 944 HD21 ASN 111 1HD2 ASN 111 -11.461 13.824 -3.555 945 HD22 ASN 111 2HD2 ASN 111 -12.576 14.080 -4.845 946 H GLU 112 H GLU 112 -10.815 12.469 -0.251 947 HA GLU 112 HA GLU 112 -9.102 10.639 1.166 948 HB2 GLU 112 2HB GLU 112 -11.069 12.693 2.267 949 HB3 GLU 112 3HB GLU 112 -9.704 11.985 3.130 950 HG2 GLU 112 2HG GLU 112 -8.118 13.207 1.825 951 HG3 GLU 112 3HG GLU 112 -9.338 13.668 0.638 952 H ASP 113 H ASP 113 -12.571 11.291 1.052 953 HA ASP 113 HA ASP 113 -13.407 9.369 2.969 954 HB2 ASP 113 2HB ASP 113 -14.712 11.423 2.399 955 HB3 ASP 113 3HB ASP 113 -15.041 10.765 0.800 956 H GLU 114 H GLU 114 -12.909 9.279 -0.508 957 HA GLU 114 HA GLU 114 -14.090 6.740 -1.036 958 HB2 GLU 114 2HB GLU 114 -13.437 8.440 -2.783 959 HB3 GLU 114 3HB GLU 114 -11.747 8.075 -2.463 960 HG2 GLU 114 2HG GLU 114 -12.299 6.874 -4.426 961 HG3 GLU 114 3HG GLU 114 -12.254 5.670 -3.140 962 H ALA 115 H ALA 115 -10.957 7.807 0.124 963 HA ALA 115 HA ALA 115 -9.420 5.503 -0.398 964 HB1 ALA 115 3HB ALA 115 -7.737 6.539 1.031 965 HB2 ALA 115 1HB ALA 115 -8.944 7.660 1.676 966 HB3 ALA 115 2HB ALA 115 -8.478 7.743 -0.024 967 H LYS 116 H LYS 116 -11.297 6.433 2.465 968 HA LYS 116 HA LYS 116 -10.429 4.216 4.071 969 HB2 LYS 116 2HB LYS 116 -12.216 4.948 5.629 970 HB3 LYS 116 3HB LYS 116 -11.153 6.259 5.129 971 HG2 LYS 116 2HG LYS 116 -13.015 6.748 3.345 972 HG3 LYS 116 3HG LYS 116 -14.041 5.779 4.403 973 HD2 LYS 116 2HD LYS 116 -12.557 8.327 5.143 974 HD3 LYS 116 3HD LYS 116 -14.295 8.160 4.903 975 HE2 LYS 116 2HE LYS 116 -14.462 6.731 6.875 976 HE3 LYS 116 3HE LYS 116 -12.708 6.773 7.091 977 HZ1 LYS 116 3HZ LYS 116 -14.568 9.082 7.299 978 HZ2 LYS 116 1HZ LYS 116 -12.885 9.200 7.371 979 HZ3 LYS 116 2HZ LYS 116 -13.721 8.345 8.567 980 H LYS 117 H LYS 117 -13.126 4.699 1.812 981 HA LYS 117 HA LYS 117 -14.787 2.517 2.528 982 HB2 LYS 117 2HB LYS 117 -14.367 3.648 -0.278 983 HB3 LYS 117 3HB LYS 117 -15.741 2.683 0.257 984 HG2 LYS 117 2HG LYS 117 -16.411 4.523 1.781 985 HG3 LYS 117 3HG LYS 117 -15.052 5.482 1.181 986 HD2 LYS 117 2HD LYS 117 -16.052 5.217 -1.165 987 HD3 LYS 117 3HD LYS 117 -17.483 4.534 -0.385 988 HE2 LYS 117 2HE LYS 117 -16.366 7.325 0.015 989 HE3 LYS 117 3HE LYS 117 -17.830 6.897 -0.868 990 HZ1 LYS 117 3HZ LYS 117 -18.283 7.733 1.365 991 HZ2 LYS 117 1HZ LYS 117 -17.401 6.452 2.032 992 HZ3 LYS 117 2HZ LYS 117 -18.822 6.140 1.176 993 H ARG 118 H ARG 118 -12.288 2.819 0.040 994 HA ARG 118 HA ARG 118 -12.518 0.251 -1.074 995 HB2 ARG 118 2HB ARG 118 -10.474 0.831 -2.335 996 HB3 ARG 118 3HB ARG 118 -11.622 2.159 -2.312 997 HG2 ARG 118 2HG ARG 118 -9.718 3.369 -1.882 998 HG3 ARG 118 3HG ARG 118 -10.145 2.950 -0.227 999 HD2 ARG 118 2HD ARG 118 -8.590 0.841 -0.701 1000 HD3 ARG 118 3HD ARG 118 -7.919 1.880 -1.949 1001 HE ARG 118 HE ARG 118 -7.435 1.982 0.815 1002 HH11 ARG 118 1HH1 ARG 118 -7.681 4.238 -1.871 1003 HH12 ARG 118 2HH1 ARG 118 -6.696 5.423 -1.085 1004 HH21 ARG 118 1HH2 ARG 118 -6.271 3.597 1.838 1005 HH22 ARG 118 2HH2 ARG 118 -5.909 5.064 0.991 1006 H LEU 119 H LEU 119 -10.675 1.384 1.686 1007 HA LEU 119 HA LEU 119 -8.679 -0.610 1.854 1008 HB2 LEU 119 2HB LEU 119 -10.006 1.175 3.914 1009 HB3 LEU 119 3HB LEU 119 -8.790 0.000 4.402 1010 HG LEU 119 HG LEU 119 -8.299 2.199 2.368 1011 HD11 LEU 119 1HD1 LEU 119 -7.015 3.315 4.123 1012 HD12 LEU 119 2HD1 LEU 119 -7.531 2.098 5.292 1013 HD13 LEU 119 3HD1 LEU 119 -8.718 3.175 4.552 1014 HD21 LEU 119 3HD2 LEU 119 -6.873 0.248 2.032 1015 HD22 LEU 119 1HD2 LEU 119 -6.400 0.263 3.734 1016 HD23 LEU 119 2HD2 LEU 119 -5.937 1.590 2.671 1017 H LYS 120 H LYS 120 -11.804 -0.344 3.517 1018 HA LYS 120 HA LYS 120 -11.762 -2.872 4.780 1019 HB2 LYS 120 2HB LYS 120 -13.250 -1.008 5.474 1020 HB3 LYS 120 3HB LYS 120 -14.130 -1.139 3.951 1021 HG2 LYS 120 2HG LYS 120 -14.659 -3.577 4.669 1022 HG3 LYS 120 3HG LYS 120 -14.074 -3.097 6.265 1023 HD2 LYS 120 2HD LYS 120 -16.517 -2.914 6.174 1024 HD3 LYS 120 3HD LYS 120 -15.807 -1.305 6.344 1025 HE2 LYS 120 2HE LYS 120 -16.088 -0.957 3.887 1026 HE3 LYS 120 3HE LYS 120 -16.855 -2.546 3.772 1027 HZ1 LYS 120 3HZ LYS 120 -18.558 -1.750 5.334 1028 HZ2 LYS 120 1HZ LYS 120 -18.523 -0.853 3.900 1029 HZ3 LYS 120 2HZ LYS 120 -17.855 -0.212 5.312 1030 H GLU 121 H GLU 121 -12.984 -1.718 1.680 1031 HA GLU 121 HA GLU 121 -14.347 -3.969 0.734 1032 HB2 GLU 121 2HB GLU 121 -14.597 -1.743 -0.224 1033 HB3 GLU 121 3HB GLU 121 -12.921 -1.711 -0.732 1034 HG2 GLU 121 2HG GLU 121 -14.680 -3.870 -1.848 1035 HG3 GLU 121 3HG GLU 121 -14.942 -2.230 -2.428 1036 H LEU 122 H LEU 122 -10.911 -3.094 0.492 1037 HA LEU 122 HA LEU 122 -9.989 -5.230 -1.115 1038 HB2 LEU 122 2HB LEU 122 -8.585 -3.646 1.074 1039 HB3 LEU 122 3HB LEU 122 -7.753 -4.808 0.051 1040 HG LEU 122 HG LEU 122 -9.156 -2.342 -1.031 1041 HD11 LEU 122 1HD1 LEU 122 -6.952 -1.312 -1.222 1042 HD12 LEU 122 2HD1 LEU 122 -6.221 -2.687 -0.390 1043 HD13 LEU 122 3HD1 LEU 122 -7.366 -1.643 0.459 1044 HD21 LEU 122 3HD2 LEU 122 -8.886 -4.123 -2.683 1045 HD22 LEU 122 1HD2 LEU 122 -7.158 -4.217 -2.327 1046 HD23 LEU 122 2HD2 LEU 122 -7.837 -2.758 -3.052 1047 H LEU 123 H LEU 123 -10.174 -4.826 2.420 1048 HA LEU 123 HA LEU 123 -8.941 -7.254 3.156 1049 HB2 LEU 123 2HB LEU 123 -10.564 -5.157 4.571 1050 HB3 LEU 123 3HB LEU 123 -10.305 -6.677 5.405 1051 HG LEU 123 HG LEU 123 -7.913 -6.354 5.475 1052 HD11 LEU 123 1HD1 LEU 123 -6.732 -4.429 4.547 1053 HD12 LEU 123 2HD1 LEU 123 -8.224 -3.844 3.807 1054 HD13 LEU 123 3HD1 LEU 123 -7.505 -5.360 3.265 1055 HD21 LEU 123 3HD2 LEU 123 -9.292 -3.754 6.176 1056 HD22 LEU 123 1HD2 LEU 123 -7.772 -4.354 6.846 1057 HD23 LEU 123 2HD2 LEU 123 -9.275 -5.211 7.171 1058 H GLU 124 H GLU 124 -12.339 -6.455 2.622 1059 HA GLU 124 HA GLU 124 -13.484 -8.868 3.590 1060 HB2 GLU 124 2HB GLU 124 -14.511 -6.834 1.565 1061 HB3 GLU 124 3HB GLU 124 -15.483 -8.163 2.196 1062 HG2 GLU 124 2HG GLU 124 -15.351 -7.259 4.459 1063 HG3 GLU 124 3HG GLU 124 -14.240 -6.000 3.930 1064 H LYS 125 H LYS 125 -12.053 -7.957 0.520 1065 HA LYS 125 HA LYS 125 -12.639 -10.596 -0.697 1066 HB2 LYS 125 2HB LYS 125 -11.533 -8.056 -1.991 1067 HB3 LYS 125 3HB LYS 125 -12.051 -9.520 -2.828 1068 HG2 LYS 125 2HG LYS 125 -14.382 -9.122 -2.172 1069 HG3 LYS 125 3HG LYS 125 -13.893 -7.728 -1.202 1070 HD2 LYS 125 2HD LYS 125 -13.030 -6.659 -3.333 1071 HD3 LYS 125 3HD LYS 125 -13.758 -7.992 -4.231 1072 HE2 LYS 125 2HE LYS 125 -15.974 -7.337 -3.514 1073 HE3 LYS 125 3HE LYS 125 -15.310 -6.129 -2.409 1074 HZ1 LYS 125 3HZ LYS 125 -14.353 -4.996 -4.372 1075 HZ2 LYS 125 1HZ LYS 125 -16.045 -5.032 -4.376 1076 HZ3 LYS 125 2HZ LYS 125 -15.176 -6.082 -5.376 1077 H VAL 126 H VAL 126 -10.355 -9.287 1.225 1078 HA VAL 126 HA VAL 126 -8.215 -9.571 1.808 1079 HB VAL 126 HB VAL 126 -8.266 -12.149 0.171 1080 HG11 VAL 126 1HG1 VAL 126 -6.693 -13.024 1.869 1081 HG12 VAL 126 2HG1 VAL 126 -6.675 -11.451 2.667 1082 HG13 VAL 126 3HG1 VAL 126 -6.026 -11.618 1.037 1083 HG21 VAL 126 3HG2 VAL 126 -10.270 -12.068 1.606 1084 HG22 VAL 126 1HG2 VAL 126 -9.273 -11.714 3.018 1085 HG23 VAL 126 2HG2 VAL 126 -9.138 -13.278 2.210 1086 H GLY 127 H GLY 127 -8.900 -8.345 -0.973 1087 HA2 GLY 127 2HA GLY 127 -6.955 -6.831 -1.689 1088 HA3 GLY 127 3HA GLY 127 -6.208 -8.338 -2.205 1089 H SER 128 H SER 128 -7.461 -5.795 -3.574 1090 HA SER 128 HA SER 128 -8.723 -7.167 -5.841 1091 HB2 SER 128 2HB SER 128 -10.102 -4.816 -4.439 1092 HB3 SER 128 3HB SER 128 -10.703 -5.715 -5.833 1093 HG SER 128 HG SER 128 -11.400 -6.190 -3.488 1094 H LEU 129 H LEU 129 -7.584 -6.414 -7.557 1095 HA LEU 129 HA LEU 129 -6.420 -3.698 -7.501 1096 HB2 LEU 129 2HB LEU 129 -5.095 -4.507 -9.513 1097 HB3 LEU 129 3HB LEU 129 -4.708 -5.268 -7.989 1098 HG LEU 129 HG LEU 129 -6.612 -6.686 -9.873 1099 HD11 LEU 129 1HD1 LEU 129 -4.789 -7.801 -11.040 1100 HD12 LEU 129 2HD1 LEU 129 -3.599 -6.817 -10.184 1101 HD13 LEU 129 3HD1 LEU 129 -4.723 -6.060 -11.314 1102 HD21 LEU 129 3HD2 LEU 129 -4.537 -7.739 -7.911 1103 HD22 LEU 129 1HD2 LEU 129 -5.649 -8.718 -8.875 1104 HD23 LEU 129 2HD2 LEU 129 -6.278 -7.641 -7.629 1105 H GLU 130 H GLU 130 -8.036 -2.326 -8.115 1106 HA GLU 130 HA GLU 130 -8.971 -2.378 -10.858 1107 HB2 GLU 130 2HB GLU 130 -10.568 -3.827 -9.202 1108 HB3 GLU 130 3HB GLU 130 -11.244 -2.246 -8.856 1109 HG2 GLU 130 2HG GLU 130 -11.159 -3.676 -11.532 1110 HG3 GLU 130 3HG GLU 130 -12.580 -3.313 -10.556 1111 H HIS 131 H HIS 131 -9.470 -0.294 -11.578 1112 HA HIS 131 HA HIS 131 -9.657 1.952 -9.728 1113 HB2 HIS 131 2HB HIS 131 -7.546 3.027 -10.605 1114 HB3 HIS 131 3HB HIS 131 -7.260 1.567 -9.667 1115 HD1 HIS 131 HD1 HIS 131 -7.013 2.913 -13.162 1116 HD2 HIS 131 HD2 HIS 131 -6.164 -0.594 -11.105 1117 HE1 HIS 131 HE1 HIS 131 -5.561 1.558 -14.700 1118 HE2 HIS 131 HE2 HIS 131 -5.294 -0.646 -13.522 1119 H HIS 132 H HIS 132 -11.529 1.124 -11.648 1120 HA HIS 132 HA HIS 132 -11.413 2.567 -14.078 1121 HB2 HIS 132 2HB HIS 132 -13.762 1.502 -12.480 1122 HB3 HIS 132 3HB HIS 132 -14.048 2.524 -13.882 1123 HD1 HIS 132 HD1 HIS 132 -11.886 1.355 -15.778 1124 HD2 HIS 132 HD2 HIS 132 -14.527 -0.932 -13.523 1125 HE1 HIS 132 HE1 HIS 132 -12.019 -0.869 -16.929 1126 HE2 HIS 132 HE2 HIS 132 -13.450 -2.282 -15.436 1127 H HIS 133 H HIS 133 -10.659 4.571 -13.878 1128 HA HIS 133 HA HIS 133 -12.387 6.706 -12.851 1129 HB2 HIS 133 2HB HIS 133 -10.853 6.038 -10.958 1130 HB3 HIS 133 3HB HIS 133 -9.468 6.396 -11.972 1131 HD1 HIS 133 HD1 HIS 133 -8.645 8.778 -11.986 1132 HD2 HIS 133 HD2 HIS 133 -12.363 8.401 -10.165 1133 HE1 HIS 133 HE1 HIS 133 -9.090 10.999 -10.896 1134 HE2 HIS 133 HE2 HIS 133 -11.417 10.791 -9.973 1135 H HIS 134 H HIS 134 -10.834 5.438 -15.326 1136 HA HIS 134 HA HIS 134 -9.959 5.984 -17.291 1137 HB2 HIS 134 2HB HIS 134 -11.680 7.686 -17.557 1138 HB3 HIS 134 3HB HIS 134 -10.780 8.830 -16.572 1139 HD1 HIS 134 HD1 HIS 134 -10.173 6.903 -19.816 1140 HD2 HIS 134 HD2 HIS 134 -9.422 10.633 -18.130 1141 HE1 HIS 134 HE1 HIS 134 -8.920 8.198 -21.563 1142 HE2 HIS 134 HE2 HIS 134 -8.524 10.459 -20.545 1143 H HIS 135 H HIS 135 -8.043 6.591 -18.258 1144 HA HIS 135 HA HIS 135 -6.016 8.063 -16.750 1145 HB2 HIS 135 2HB HIS 135 -5.722 5.647 -16.104 1146 HB3 HIS 135 3HB HIS 135 -5.541 5.225 -17.807 1147 HD1 HIS 135 HD1 HIS 135 -3.152 4.748 -18.210 1148 HD2 HIS 135 HD2 HIS 135 -3.640 7.977 -15.644 1149 HE1 HIS 135 HE1 HIS 135 -0.835 5.546 -17.677 1150 HE2 HIS 135 HE2 HIS 135 -1.177 7.592 -16.258 1151 H HIS 136 H HIS 136 -6.189 5.943 -19.620 1152 HA HIS 136 HA HIS 136 -6.250 8.098 -21.500 1153 HB2 HIS 136 2HB HIS 136 -3.808 8.092 -21.003 1154 HB3 HIS 136 3HB HIS 136 -3.714 6.377 -21.398 1155 HD1 HIS 136 HD1 HIS 136 -4.035 5.758 -23.950 1156 HD2 HIS 136 HD2 HIS 136 -3.716 9.823 -23.179 1157 HE1 HIS 136 HE1 HIS 136 -3.575 6.825 -26.169 1158 HE2 HIS 136 HE2 HIS 136 -3.615 9.297 -25.706 Start of MODEL 5 1 H1 MET 1 1H MET 1 -3.477 -16.914 1.807 2 H2 MET 1 2H MET 1 -2.573 -15.989 2.889 3 H3 MET 1 3H MET 1 -1.835 -16.635 1.516 4 HA MET 1 HA MET 1 -3.142 -15.279 0.085 5 HB2 MET 1 2HB MET 1 -4.605 -13.479 1.117 6 HB3 MET 1 3HB MET 1 -5.207 -15.118 1.298 7 HG2 MET 1 2HG MET 1 -4.339 -15.159 3.617 8 HG3 MET 1 3HG MET 1 -3.812 -13.488 3.429 9 HE1 MET 1 3HE MET 1 -6.872 -13.356 5.910 10 HE2 MET 1 1HE MET 1 -5.127 -13.175 5.744 11 HE3 MET 1 2HE MET 1 -5.855 -14.784 5.731 12 H GLY 2 H GLY 2 -1.520 -14.104 -0.695 13 HA2 GLY 2 2HA GLY 2 0.029 -12.292 1.086 14 HA3 GLY 2 3HA GLY 2 0.667 -13.089 -0.346 15 H THR 3 H THR 3 -1.814 -10.790 0.698 16 HA THR 3 HA THR 3 -1.594 -9.345 -1.881 17 HB THR 3 HB THR 3 -3.797 -8.233 -0.994 18 HG1 THR 3 HG1 THR 3 -4.678 -9.074 0.747 19 HG21 THR 3 3HG2 THR 3 -3.846 -11.178 -1.771 20 HG22 THR 3 1HG2 THR 3 -3.797 -9.819 -2.896 21 HG23 THR 3 2HG2 THR 3 -5.211 -10.064 -1.870 22 H VAL 4 H VAL 4 -0.466 -7.517 -1.839 23 HA VAL 4 HA VAL 4 0.118 -6.136 0.717 24 HB VAL 4 HB VAL 4 1.716 -5.967 -1.901 25 HG11 VAL 4 1HG1 VAL 4 2.445 -5.056 0.914 26 HG12 VAL 4 2HG1 VAL 4 2.004 -4.012 -0.437 27 HG13 VAL 4 3HG1 VAL 4 3.490 -4.957 -0.507 28 HG21 VAL 4 3HG2 VAL 4 1.834 -8.277 -1.054 29 HG22 VAL 4 1HG2 VAL 4 2.353 -7.695 0.528 30 HG23 VAL 4 2HG2 VAL 4 3.394 -7.473 -0.881 31 H VAL 5 H VAL 5 -1.114 -4.346 0.922 32 HA VAL 5 HA VAL 5 -1.827 -2.768 -1.483 33 HB VAL 5 HB VAL 5 -3.922 -2.054 -0.327 34 HG11 VAL 5 1HG1 VAL 5 -3.694 -5.081 -0.602 35 HG12 VAL 5 2HG1 VAL 5 -3.979 -3.941 -1.916 36 HG13 VAL 5 3HG1 VAL 5 -5.192 -4.141 -0.654 37 HG21 VAL 5 3HG2 VAL 5 -4.781 -3.264 1.650 38 HG22 VAL 5 1HG2 VAL 5 -3.287 -2.406 2.031 39 HG23 VAL 5 2HG2 VAL 5 -3.257 -4.151 1.782 40 H ILE 6 H ILE 6 -0.750 -0.915 -1.528 41 HA ILE 6 HA ILE 6 0.489 0.156 0.919 42 HB ILE 6 HB ILE 6 1.113 0.859 -2.007 43 HG12 ILE 6 2HG1 ILE 6 3.346 -0.422 -1.459 44 HG13 ILE 6 3HG1 ILE 6 2.443 -1.177 -0.156 45 HG21 ILE 6 1HG2 ILE 6 1.688 2.668 -0.444 46 HG22 ILE 6 2HG2 ILE 6 3.147 1.937 -1.105 47 HG23 ILE 6 3HG2 ILE 6 2.638 1.550 0.539 48 HD11 ILE 6 3HD1 ILE 6 2.570 -2.602 -2.116 49 HD12 ILE 6 1HD1 ILE 6 1.800 -1.361 -3.103 50 HD13 ILE 6 2HD1 ILE 6 0.898 -2.141 -1.802 51 H VAL 7 H VAL 7 -0.861 1.623 1.880 52 HA VAL 7 HA VAL 7 -2.617 3.355 0.319 53 HB VAL 7 HB VAL 7 -2.178 3.224 3.346 54 HG11 VAL 7 1HG1 VAL 7 -2.953 5.467 2.688 55 HG12 VAL 7 2HG1 VAL 7 -4.233 4.600 3.534 56 HG13 VAL 7 3HG1 VAL 7 -4.293 4.762 1.776 57 HG21 VAL 7 3HG2 VAL 7 -4.348 2.081 3.414 58 HG22 VAL 7 1HG2 VAL 7 -3.194 1.182 2.428 59 HG23 VAL 7 2HG2 VAL 7 -4.455 2.142 1.652 60 H VAL 8 H VAL 8 -1.729 4.995 -0.583 61 HA VAL 8 HA VAL 8 0.328 6.651 0.712 62 HB VAL 8 HB VAL 8 -0.232 6.334 -2.282 63 HG11 VAL 8 1HG1 VAL 8 2.017 7.823 -0.866 64 HG12 VAL 8 2HG1 VAL 8 0.652 8.558 -1.712 65 HG13 VAL 8 3HG1 VAL 8 1.842 7.623 -2.613 66 HG21 VAL 8 3HG2 VAL 8 1.884 5.085 -2.413 67 HG22 VAL 8 1HG2 VAL 8 0.730 4.266 -1.359 68 HG23 VAL 8 2HG2 VAL 8 2.070 5.180 -0.660 69 H SER 9 H SER 9 0.004 8.833 0.668 70 HA SER 9 HA SER 9 -2.264 10.092 -0.609 71 HB2 SER 9 2HB SER 9 -3.221 10.944 1.548 72 HB3 SER 9 3HB SER 9 -3.365 9.193 1.406 73 HG SER 9 HG SER 9 -1.405 9.091 2.688 74 H ASN 10 H ASN 10 -2.247 12.490 -0.026 75 HA ASN 10 HA ASN 10 0.539 13.423 -0.120 76 HB2 ASN 10 2HB ASN 10 -2.088 14.847 -0.764 77 HB3 ASN 10 3HB ASN 10 -0.481 15.540 -0.982 78 HD21 ASN 10 1HD2 ASN 10 -2.704 14.763 -2.923 79 HD22 ASN 10 2HD2 ASN 10 -1.921 13.783 -4.108 80 H ASP 11 H ASP 11 -0.972 12.596 2.398 81 HA ASP 11 HA ASP 11 0.105 14.650 4.097 82 HB2 ASP 11 2HB ASP 11 -2.213 15.503 3.589 83 HB3 ASP 11 3HB ASP 11 -2.873 14.043 4.310 84 H GLU 12 H GLU 12 -0.029 14.016 6.407 85 HA GLU 12 HA GLU 12 0.652 11.218 6.732 86 HB2 GLU 12 2HB GLU 12 0.611 13.482 8.779 87 HB3 GLU 12 3HB GLU 12 1.430 11.930 8.956 88 HG2 GLU 12 2HG GLU 12 2.980 12.502 7.151 89 HG3 GLU 12 3HG GLU 12 2.117 14.007 6.848 90 H ARG 13 H ARG 13 -1.818 13.471 8.046 91 HA ARG 13 HA ARG 13 -2.953 11.687 9.939 92 HB2 ARG 13 2HB ARG 13 -3.692 14.356 8.812 93 HB3 ARG 13 3HB ARG 13 -5.035 13.424 9.460 94 HG2 ARG 13 2HG ARG 13 -3.828 15.137 10.991 95 HG3 ARG 13 3HG ARG 13 -4.271 13.567 11.649 96 HD2 ARG 13 2HD ARG 13 -2.003 14.365 12.329 97 HD3 ARG 13 3HD ARG 13 -2.001 12.796 11.539 98 HE ARG 13 HE ARG 13 -0.602 13.640 9.995 99 HH11 ARG 13 1HH1 ARG 13 -2.285 16.429 11.321 100 HH12 ARG 13 2HH1 ARG 13 -1.351 17.566 10.409 101 HH21 ARG 13 1HH2 ARG 13 0.655 15.167 8.862 102 HH22 ARG 13 2HH2 ARG 13 0.303 16.853 9.026 103 H ILE 14 H ILE 14 -3.599 12.125 6.515 104 HA ILE 14 HA ILE 14 -6.060 10.765 6.301 105 HB ILE 14 HB ILE 14 -3.763 10.816 4.275 106 HG12 ILE 14 2HG1 ILE 14 -6.185 12.665 4.539 107 HG13 ILE 14 3HG1 ILE 14 -4.516 13.098 4.883 108 HG21 ILE 14 1HG2 ILE 14 -5.465 10.321 2.553 109 HG22 ILE 14 2HG2 ILE 14 -6.702 10.178 3.803 110 HG23 ILE 14 3HG2 ILE 14 -5.370 9.023 3.746 111 HD11 ILE 14 3HD1 ILE 14 -5.219 13.998 2.755 112 HD12 ILE 14 1HD1 ILE 14 -5.635 12.387 2.170 113 HD13 ILE 14 2HD1 ILE 14 -3.951 12.797 2.515 114 H LEU 15 H LEU 15 -2.733 9.587 6.546 115 HA LEU 15 HA LEU 15 -3.199 6.821 6.065 116 HB2 LEU 15 2HB LEU 15 -0.987 8.182 7.650 117 HB3 LEU 15 3HB LEU 15 -0.954 6.510 7.106 118 HG LEU 15 HG LEU 15 -1.042 8.921 5.251 119 HD11 LEU 15 1HD1 LEU 15 1.329 7.172 5.984 120 HD12 LEU 15 2HD1 LEU 15 1.064 8.839 6.507 121 HD13 LEU 15 3HD1 LEU 15 1.315 8.485 4.801 122 HD21 LEU 15 3HD2 LEU 15 -2.068 6.970 4.226 123 HD22 LEU 15 1HD2 LEU 15 -0.690 5.956 4.663 124 HD23 LEU 15 2HD2 LEU 15 -0.498 7.258 3.483 125 H GLU 16 H GLU 16 -2.937 8.706 9.099 126 HA GLU 16 HA GLU 16 -3.327 6.556 10.895 127 HB2 GLU 16 2HB GLU 16 -3.709 9.558 11.183 128 HB3 GLU 16 3HB GLU 16 -4.103 8.465 12.504 129 HG2 GLU 16 2HG GLU 16 -1.922 9.333 12.912 130 HG3 GLU 16 3HG GLU 16 -1.748 7.638 12.478 131 H GLU 17 H GLU 17 -5.599 8.847 9.425 132 HA GLU 17 HA GLU 17 -7.994 8.058 10.674 133 HB2 GLU 17 2HB GLU 17 -7.675 10.135 9.342 134 HB3 GLU 17 3HB GLU 17 -7.532 9.178 7.871 135 HG2 GLU 17 2HG GLU 17 -9.883 8.361 8.274 136 HG3 GLU 17 3HG GLU 17 -9.995 9.505 9.608 137 H LEU 18 H LEU 18 -6.530 7.022 7.623 138 HA LEU 18 HA LEU 18 -8.581 5.154 6.912 139 HB2 LEU 18 2HB LEU 18 -5.968 6.038 5.721 140 HB3 LEU 18 3HB LEU 18 -6.606 4.490 5.202 141 HG LEU 18 HG LEU 18 -8.639 5.535 4.335 142 HD11 LEU 18 1HD1 LEU 18 -7.586 8.213 5.266 143 HD12 LEU 18 2HD1 LEU 18 -8.956 7.337 5.949 144 HD13 LEU 18 3HD1 LEU 18 -9.035 7.933 4.294 145 HD21 LEU 18 3HD2 LEU 18 -6.157 6.986 3.358 146 HD22 LEU 18 1HD2 LEU 18 -7.684 6.841 2.481 147 HD23 LEU 18 2HD2 LEU 18 -6.727 5.404 2.823 148 H LEU 19 H LEU 19 -5.608 4.944 8.730 149 HA LEU 19 HA LEU 19 -5.091 2.190 8.690 150 HB2 LEU 19 2HB LEU 19 -3.526 3.770 9.711 151 HB3 LEU 19 3HB LEU 19 -4.710 4.212 10.929 152 HG LEU 19 HG LEU 19 -4.577 1.812 11.792 153 HD11 LEU 19 1HD1 LEU 19 -3.643 0.704 9.844 154 HD12 LEU 19 2HD1 LEU 19 -2.607 0.470 11.248 155 HD13 LEU 19 3HD1 LEU 19 -2.145 1.628 9.997 156 HD21 LEU 19 3HD2 LEU 19 -2.517 2.173 13.057 157 HD22 LEU 19 1HD2 LEU 19 -3.493 3.637 12.964 158 HD23 LEU 19 2HD2 LEU 19 -2.053 3.473 11.956 159 H GLU 20 H GLU 20 -7.299 4.103 10.619 160 HA GLU 20 HA GLU 20 -8.185 2.067 12.391 161 HB2 GLU 20 2HB GLU 20 -9.593 4.638 11.567 162 HB3 GLU 20 3HB GLU 20 -9.927 3.679 13.012 163 HG2 GLU 20 2HG GLU 20 -7.609 4.133 13.814 164 HG3 GLU 20 3HG GLU 20 -7.342 5.145 12.391 165 H VAL 21 H VAL 21 -9.235 3.150 9.218 166 HA VAL 21 HA VAL 21 -11.706 1.745 9.070 167 HB VAL 21 HB VAL 21 -9.849 2.559 6.779 168 HG11 VAL 21 1HG1 VAL 21 -11.875 2.556 5.353 169 HG12 VAL 21 2HG1 VAL 21 -12.831 1.945 6.706 170 HG13 VAL 21 3HG1 VAL 21 -11.546 0.953 6.016 171 HG21 VAL 21 3HG2 VAL 21 -12.119 4.139 8.043 172 HG22 VAL 21 1HG2 VAL 21 -11.188 4.625 6.623 173 HG23 VAL 21 2HG2 VAL 21 -10.396 4.490 8.193 174 H VAL 22 H VAL 22 -8.347 0.853 8.500 175 HA VAL 22 HA VAL 22 -8.920 -1.717 7.319 176 HB VAL 22 HB VAL 22 -6.287 -0.676 8.463 177 HG11 VAL 22 1HG1 VAL 22 -6.802 -3.041 6.618 178 HG12 VAL 22 2HG1 VAL 22 -6.314 -3.129 8.312 179 HG13 VAL 22 3HG1 VAL 22 -5.215 -2.446 7.115 180 HG21 VAL 22 3HG2 VAL 22 -7.084 0.758 6.624 181 HG22 VAL 22 1HG2 VAL 22 -7.267 -0.653 5.577 182 HG23 VAL 22 2HG2 VAL 22 -5.661 -0.156 6.124 183 H LEU 23 H LEU 23 -7.832 -0.556 10.533 184 HA LEU 23 HA LEU 23 -7.514 -3.093 11.748 185 HB2 LEU 23 2HB LEU 23 -7.941 -0.334 12.948 186 HB3 LEU 23 3HB LEU 23 -7.544 -1.746 13.902 187 HG LEU 23 HG LEU 23 -5.759 -0.505 11.769 188 HD11 LEU 23 1HD1 LEU 23 -5.897 0.895 13.774 189 HD12 LEU 23 2HD1 LEU 23 -4.300 0.175 13.619 190 HD13 LEU 23 3HD1 LEU 23 -5.449 -0.477 14.793 191 HD21 LEU 23 3HD2 LEU 23 -4.023 -2.081 12.530 192 HD22 LEU 23 1HD2 LEU 23 -5.418 -2.927 11.862 193 HD23 LEU 23 2HD2 LEU 23 -5.185 -2.855 13.610 194 H LYS 24 H LYS 24 -10.308 -0.890 11.622 195 HA LYS 24 HA LYS 24 -11.907 -2.174 13.605 196 HB2 LYS 24 2HB LYS 24 -13.781 -0.845 12.786 197 HB3 LYS 24 3HB LYS 24 -12.341 0.164 12.817 198 HG2 LYS 24 2HG LYS 24 -12.086 -0.034 10.402 199 HG3 LYS 24 3HG LYS 24 -13.429 -1.170 10.313 200 HD2 LYS 24 2HD LYS 24 -13.641 1.740 11.176 201 HD3 LYS 24 3HD LYS 24 -14.074 1.105 9.587 202 HE2 LYS 24 2HE LYS 24 -15.798 -0.330 10.651 203 HE3 LYS 24 3HE LYS 24 -15.388 0.366 12.221 204 HZ1 LYS 24 3HZ LYS 24 -16.424 1.881 9.886 205 HZ2 LYS 24 1HZ LYS 24 -16.058 2.532 11.400 206 HZ3 LYS 24 2HZ LYS 24 -17.329 1.433 11.242 207 H SER 25 H SER 25 -11.488 -2.651 10.173 208 HA SER 25 HA SER 25 -13.635 -4.531 9.811 209 HB2 SER 25 2HB SER 25 -12.836 -3.099 7.953 210 HB3 SER 25 3HB SER 25 -11.235 -3.829 8.052 211 HG SER 25 HG SER 25 -11.974 -5.623 7.128 212 H ASP 26 H ASP 26 -10.070 -4.705 9.996 213 HA ASP 26 HA ASP 26 -10.138 -7.469 10.953 214 HB2 ASP 26 2HB ASP 26 -8.747 -6.611 8.378 215 HB3 ASP 26 3HB ASP 26 -8.387 -8.117 9.210 216 HA PRO 27 HA PRO 27 -6.510 -5.509 13.042 217 HB2 PRO 27 2HB PRO 27 -6.610 -6.916 15.340 218 HB3 PRO 27 3HB PRO 27 -7.816 -5.654 15.005 219 HG2 PRO 27 2HG PRO 27 -8.083 -8.630 14.667 220 HG3 PRO 27 3HG PRO 27 -9.212 -7.487 15.430 221 HD2 PRO 27 2HD PRO 27 -9.489 -8.361 12.835 222 HD3 PRO 27 3HD PRO 27 -10.079 -6.781 13.399 223 H ASN 28 H ASN 28 -7.177 -8.678 11.909 224 HA ASN 28 HA ASN 28 -4.769 -10.016 12.688 225 HB2 ASN 28 2HB ASN 28 -5.445 -11.809 11.158 226 HB3 ASN 28 3HB ASN 28 -6.825 -11.290 12.115 227 HD21 ASN 28 1HD2 ASN 28 -8.539 -10.213 11.075 228 HD22 ASN 28 2HD2 ASN 28 -8.714 -10.204 9.356 229 H VAL 29 H VAL 29 -5.650 -7.896 10.106 230 HA VAL 29 HA VAL 29 -3.634 -8.502 8.215 231 HB VAL 29 HB VAL 29 -5.127 -5.880 8.703 232 HG11 VAL 29 1HG1 VAL 29 -4.525 -5.272 6.390 233 HG12 VAL 29 2HG1 VAL 29 -3.560 -6.742 6.240 234 HG13 VAL 29 3HG1 VAL 29 -3.080 -5.485 7.381 235 HG21 VAL 29 3HG2 VAL 29 -6.606 -7.799 8.191 236 HG22 VAL 29 1HG2 VAL 29 -5.699 -8.106 6.708 237 HG23 VAL 29 2HG2 VAL 29 -6.616 -6.606 6.891 238 H LYS 30 H LYS 30 -1.603 -7.639 7.909 239 HA LYS 30 HA LYS 30 -0.009 -7.419 10.159 240 HB2 LYS 30 2HB LYS 30 0.450 -7.882 7.485 241 HB3 LYS 30 3HB LYS 30 1.113 -6.263 7.630 242 HG2 LYS 30 2HG LYS 30 2.904 -7.828 7.933 243 HG3 LYS 30 3HG LYS 30 2.566 -7.106 9.514 244 HD2 LYS 30 2HD LYS 30 1.116 -9.131 10.023 245 HD3 LYS 30 3HD LYS 30 1.701 -9.851 8.520 246 HE2 LYS 30 2HE LYS 30 2.971 -10.705 10.421 247 HE3 LYS 30 3HE LYS 30 4.031 -9.731 9.398 248 HZ1 LYS 30 3HZ LYS 30 4.296 -9.258 11.775 249 HZ2 LYS 30 1HZ LYS 30 2.687 -8.780 11.870 250 HZ3 LYS 30 2HZ LYS 30 3.776 -7.898 10.937 251 H THR 31 H THR 31 -1.032 -4.866 7.944 252 HA THR 31 HA THR 31 -0.993 -2.603 7.943 253 HB THR 31 HB THR 31 -1.959 -1.495 9.971 254 HG1 THR 31 HG1 THR 31 -1.971 -4.116 11.106 255 HG21 THR 31 3HG2 THR 31 -4.130 -2.643 9.915 256 HG22 THR 31 1HG2 THR 31 -3.382 -4.052 9.159 257 HG23 THR 31 2HG2 THR 31 -3.454 -2.515 8.291 258 H VAL 32 H VAL 32 1.099 -2.069 7.533 259 HA VAL 32 HA VAL 32 2.917 -1.446 9.789 260 HB VAL 32 HB VAL 32 3.576 -2.411 6.964 261 HG11 VAL 32 1HG1 VAL 32 5.936 -2.421 7.665 262 HG12 VAL 32 2HG1 VAL 32 5.494 -1.710 9.216 263 HG13 VAL 32 3HG1 VAL 32 5.260 -0.793 7.727 264 HG21 VAL 32 3HG2 VAL 32 3.938 -3.817 9.638 265 HG22 VAL 32 1HG2 VAL 32 4.469 -4.432 8.069 266 HG23 VAL 32 2HG2 VAL 32 2.749 -4.224 8.398 267 H ARG 33 H ARG 33 2.999 0.745 10.018 268 HA ARG 33 HA ARG 33 3.020 2.496 7.640 269 HB2 ARG 33 2HB ARG 33 1.575 3.081 9.639 270 HB3 ARG 33 3HB ARG 33 3.039 3.257 10.602 271 HG2 ARG 33 2HG ARG 33 3.780 5.098 9.075 272 HG3 ARG 33 3HG ARG 33 2.254 4.945 8.196 273 HD2 ARG 33 2HD ARG 33 2.112 6.793 9.771 274 HD3 ARG 33 3HD ARG 33 1.029 5.498 10.297 275 HE ARG 33 HE ARG 33 3.511 5.139 11.558 276 HH11 ARG 33 1HH1 ARG 33 0.844 7.444 11.665 277 HH12 ARG 33 2HH1 ARG 33 1.149 7.879 13.318 278 HH21 ARG 33 1HH2 ARG 33 3.893 5.728 13.699 279 HH22 ARG 33 2HH2 ARG 33 2.881 6.911 14.470 280 H THR 34 H THR 34 5.025 2.124 6.767 281 HA THR 34 HA THR 34 7.405 3.056 8.142 282 HB THR 34 HB THR 34 7.250 0.143 7.201 283 HG1 THR 34 HG1 THR 34 7.128 1.340 9.748 284 HG21 THR 34 3HG2 THR 34 9.552 -0.078 8.077 285 HG22 THR 34 1HG2 THR 34 9.583 1.642 8.461 286 HG23 THR 34 2HG2 THR 34 9.488 1.113 6.778 287 H ASP 35 H ASP 35 8.808 3.907 6.713 288 HA ASP 35 HA ASP 35 8.386 3.554 3.800 289 HB2 ASP 35 2HB ASP 35 9.549 5.765 3.583 290 HB3 ASP 35 3HB ASP 35 8.061 5.853 4.515 291 H ASP 36 H ASP 36 10.559 2.882 6.361 292 HA ASP 36 HA ASP 36 13.062 2.818 5.094 293 HB2 ASP 36 2HB ASP 36 12.066 0.918 7.271 294 HB3 ASP 36 3HB ASP 36 13.748 1.217 6.849 295 H LYS 37 H LYS 37 13.302 1.852 3.144 296 HA LYS 37 HA LYS 37 11.619 -0.016 1.991 297 HB2 LYS 37 2HB LYS 37 13.295 -0.220 0.204 298 HB3 LYS 37 3HB LYS 37 13.092 1.445 0.714 299 HG2 LYS 37 2HG LYS 37 15.183 1.126 2.161 300 HG3 LYS 37 3HG LYS 37 15.414 -0.394 1.294 301 HD2 LYS 37 2HD LYS 37 16.747 1.090 0.063 302 HD3 LYS 37 3HD LYS 37 15.249 1.072 -0.869 303 HE2 LYS 37 2HE LYS 37 14.570 3.188 0.113 304 HE3 LYS 37 3HE LYS 37 15.986 3.198 1.163 305 HZ1 LYS 37 3HZ LYS 37 17.371 3.252 -0.864 306 HZ2 LYS 37 1HZ LYS 37 16.371 4.606 -0.717 307 HZ3 LYS 37 2HZ LYS 37 15.973 3.379 -1.798 308 H GLU 38 H GLU 38 14.682 -0.611 3.660 309 HA GLU 38 HA GLU 38 14.910 -3.382 3.176 310 HB2 GLU 38 2HB GLU 38 16.466 -3.352 5.178 311 HB3 GLU 38 3HB GLU 38 16.857 -2.178 3.925 312 HG2 GLU 38 2HG GLU 38 15.911 -0.367 5.236 313 HG3 GLU 38 3HG GLU 38 15.314 -1.495 6.449 314 H LYS 39 H LYS 39 13.355 -1.559 5.820 315 HA LYS 39 HA LYS 39 12.755 -3.837 7.422 316 HB2 LYS 39 2HB LYS 39 12.909 -1.549 8.401 317 HB3 LYS 39 3HB LYS 39 11.451 -1.078 7.527 318 HG2 LYS 39 2HG LYS 39 10.137 -2.748 8.761 319 HG3 LYS 39 3HG LYS 39 11.588 -3.311 9.588 320 HD2 LYS 39 2HD LYS 39 11.784 -1.143 10.756 321 HD3 LYS 39 3HD LYS 39 10.376 -0.532 9.878 322 HE2 LYS 39 2HE LYS 39 8.954 -2.247 10.929 323 HE3 LYS 39 3HE LYS 39 10.356 -2.904 11.777 324 HZ1 LYS 39 3HZ LYS 39 9.188 -0.201 12.160 325 HZ2 LYS 39 1HZ LYS 39 10.588 -0.767 12.922 326 HZ3 LYS 39 2HZ LYS 39 9.100 -1.500 13.233 327 H VAL 40 H VAL 40 10.887 -1.904 5.085 328 HA VAL 40 HA VAL 40 8.363 -3.055 5.409 329 HB VAL 40 HB VAL 40 9.592 -1.886 2.862 330 HG11 VAL 40 1HG1 VAL 40 7.645 -3.255 2.264 331 HG12 VAL 40 2HG1 VAL 40 7.265 -1.546 2.065 332 HG13 VAL 40 3HG1 VAL 40 6.656 -2.427 3.469 333 HG21 VAL 40 3HG2 VAL 40 7.809 -0.571 4.952 334 HG22 VAL 40 1HG2 VAL 40 8.396 0.187 3.468 335 HG23 VAL 40 2HG2 VAL 40 9.535 -0.278 4.729 336 H LYS 41 H LYS 41 11.144 -4.143 3.541 337 HA LYS 41 HA LYS 41 9.892 -6.307 2.166 338 HB2 LYS 41 2HB LYS 41 12.806 -5.798 2.885 339 HB3 LYS 41 3HB LYS 41 12.261 -7.079 1.799 340 HG2 LYS 41 2HG LYS 41 11.366 -5.442 0.235 341 HG3 LYS 41 3HG LYS 41 11.768 -4.123 1.336 342 HD2 LYS 41 2HD LYS 41 14.179 -4.668 1.097 343 HD3 LYS 41 3HD LYS 41 13.766 -5.978 -0.015 344 HE2 LYS 41 2HE LYS 41 12.789 -4.333 -1.577 345 HE3 LYS 41 3HE LYS 41 13.215 -3.028 -0.466 346 HZ1 LYS 41 3HZ LYS 41 15.572 -3.747 -0.724 347 HZ2 LYS 41 1HZ LYS 41 14.866 -3.144 -2.139 348 HZ3 LYS 41 2HZ LYS 41 15.074 -4.809 -1.941 349 H GLU 42 H GLU 42 11.626 -6.068 5.256 350 HA GLU 42 HA GLU 42 11.501 -8.801 6.031 351 HB2 GLU 42 2HB GLU 42 11.556 -6.272 7.743 352 HB3 GLU 42 3HB GLU 42 11.837 -7.899 8.359 353 HG2 GLU 42 2HG GLU 42 13.885 -8.110 7.132 354 HG3 GLU 42 3HG GLU 42 13.549 -6.660 6.192 355 H GLU 43 H GLU 43 9.272 -6.076 6.378 356 HA GLU 43 HA GLU 43 7.347 -7.353 8.032 357 HB2 GLU 43 2HB GLU 43 6.847 -5.028 6.126 358 HB3 GLU 43 3HB GLU 43 5.895 -5.462 7.538 359 HG2 GLU 43 2HG GLU 43 8.663 -4.263 7.478 360 HG3 GLU 43 3HG GLU 43 7.189 -3.515 8.054 361 H ILE 44 H ILE 44 7.753 -7.000 4.537 362 HA ILE 44 HA ILE 44 5.336 -8.208 3.665 363 HB ILE 44 HB ILE 44 8.045 -7.813 2.308 364 HG12 ILE 44 2HG1 ILE 44 5.308 -6.575 1.737 365 HG13 ILE 44 3HG1 ILE 44 6.635 -5.783 2.579 366 HG21 ILE 44 1HG2 ILE 44 7.141 -9.893 1.360 367 HG22 ILE 44 2HG2 ILE 44 7.100 -8.599 0.166 368 HG23 ILE 44 3HG2 ILE 44 5.617 -9.081 0.989 369 HD11 ILE 44 3HD1 ILE 44 7.983 -5.873 0.534 370 HD12 ILE 44 1HD1 ILE 44 6.465 -5.011 0.289 371 HD13 ILE 44 2HD1 ILE 44 6.646 -6.661 -0.312 372 H GLU 45 H GLU 45 8.590 -9.452 4.346 373 HA GLU 45 HA GLU 45 8.294 -12.117 3.534 374 HB2 GLU 45 2HB GLU 45 10.435 -10.852 4.219 375 HB3 GLU 45 3HB GLU 45 10.004 -11.180 5.886 376 HG2 GLU 45 2HG GLU 45 10.605 -13.267 3.766 377 HG3 GLU 45 3HG GLU 45 11.724 -12.726 5.004 378 H LYS 46 H LYS 46 7.853 -10.612 6.721 379 HA LYS 46 HA LYS 46 7.008 -12.975 8.067 380 HB2 LYS 46 2HB LYS 46 6.790 -10.030 8.824 381 HB3 LYS 46 3HB LYS 46 6.390 -11.358 9.914 382 HG2 LYS 46 2HG LYS 46 8.699 -12.173 9.843 383 HG3 LYS 46 3HG LYS 46 9.129 -10.947 8.653 384 HD2 LYS 46 2HD LYS 46 8.271 -10.399 11.523 385 HD3 LYS 46 3HD LYS 46 9.929 -10.350 10.918 386 HE2 LYS 46 2HE LYS 46 9.298 -8.501 9.388 387 HE3 LYS 46 3HE LYS 46 7.656 -8.537 10.035 388 HZ1 LYS 46 3HZ LYS 46 8.504 -7.909 12.182 389 HZ2 LYS 46 1HZ LYS 46 9.033 -6.806 11.016 390 HZ3 LYS 46 2HZ LYS 46 10.096 -7.967 11.619 391 H ALA 47 H ALA 47 5.294 -10.436 6.313 392 HA ALA 47 HA ALA 47 2.651 -11.023 7.173 393 HB1 ALA 47 3HB ALA 47 3.558 -9.819 4.533 394 HB2 ALA 47 1HB ALA 47 3.215 -8.929 6.019 395 HB3 ALA 47 2HB ALA 47 1.915 -9.778 5.182 396 H ARG 48 H ARG 48 4.453 -12.053 4.247 397 HA ARG 48 HA ARG 48 2.428 -13.868 3.348 398 HB2 ARG 48 2HB ARG 48 4.119 -14.641 1.673 399 HB3 ARG 48 3HB ARG 48 3.885 -12.907 1.684 400 HG2 ARG 48 2HG ARG 48 6.178 -13.085 1.418 401 HG3 ARG 48 3HG ARG 48 6.028 -12.835 3.155 402 HD2 ARG 48 2HD ARG 48 7.675 -14.541 2.781 403 HD3 ARG 48 3HD ARG 48 6.247 -15.331 3.456 404 HE ARG 48 HE ARG 48 7.002 -15.357 0.584 405 HH11 ARG 48 1HH1 ARG 48 5.588 -16.989 3.366 406 HH12 ARG 48 2HH1 ARG 48 5.256 -18.450 2.494 407 HH21 ARG 48 1HH2 ARG 48 6.550 -17.269 -0.554 408 HH22 ARG 48 2HH2 ARG 48 5.805 -18.605 0.267 409 H LYS 49 H LYS 49 5.139 -14.145 5.514 410 HA LYS 49 HA LYS 49 5.410 -16.959 5.626 411 HB2 LYS 49 2HB LYS 49 7.037 -15.250 6.575 412 HB3 LYS 49 3HB LYS 49 5.913 -14.988 7.905 413 HG2 LYS 49 2HG LYS 49 6.184 -17.334 8.609 414 HG3 LYS 49 3HG LYS 49 7.256 -17.629 7.238 415 HD2 LYS 49 2HD LYS 49 8.805 -15.836 8.200 416 HD3 LYS 49 3HD LYS 49 7.781 -15.838 9.641 417 HE2 LYS 49 2HE LYS 49 9.730 -17.263 10.005 418 HE3 LYS 49 3HE LYS 49 8.277 -18.268 9.953 419 HZ1 LYS 49 3HZ LYS 49 10.248 -17.882 7.756 420 HZ2 LYS 49 1HZ LYS 49 8.807 -18.753 7.604 421 HZ3 LYS 49 2HZ LYS 49 10.009 -19.288 8.662 422 H GLN 50 H GLN 50 3.450 -14.663 7.506 423 HA GLN 50 HA GLN 50 1.960 -16.664 8.965 424 HB2 GLN 50 2HB GLN 50 1.317 -13.711 8.502 425 HB3 GLN 50 3HB GLN 50 0.561 -14.753 9.704 426 HG2 GLN 50 2HG GLN 50 3.423 -13.772 9.658 427 HG3 GLN 50 3HG GLN 50 2.166 -13.354 10.815 428 HE21 GLN 50 1HE2 GLN 50 4.868 -14.551 11.148 429 HE22 GLN 50 2HE2 GLN 50 4.619 -15.991 12.066 430 H GLY 51 H GLY 51 1.755 -15.165 5.864 431 HA2 GLY 51 2HA GLY 51 0.383 -15.458 4.054 432 HA3 GLY 51 3HA GLY 51 -0.439 -16.743 4.928 433 H ARG 52 H ARG 52 -0.003 -13.259 5.467 434 HA ARG 52 HA ARG 52 -2.923 -12.824 5.536 435 HB2 ARG 52 2HB ARG 52 -0.871 -11.826 7.576 436 HB3 ARG 52 3HB ARG 52 -2.528 -11.234 7.477 437 HG2 ARG 52 2HG ARG 52 -3.356 -13.524 7.971 438 HG3 ARG 52 3HG ARG 52 -1.689 -14.078 8.127 439 HD2 ARG 52 2HD ARG 52 -1.340 -12.586 10.036 440 HD3 ARG 52 3HD ARG 52 -2.972 -11.923 9.840 441 HE ARG 52 HE ARG 52 -2.974 -14.764 10.166 442 HH11 ARG 52 1HH1 ARG 52 -2.800 -11.769 11.994 443 HH12 ARG 52 2HH1 ARG 52 -3.439 -12.478 13.443 444 HH21 ARG 52 1HH2 ARG 52 -3.860 -15.671 12.020 445 HH22 ARG 52 2HH2 ARG 52 -4.045 -14.710 13.453 446 HA PRO 53 HA PRO 53 -1.962 -9.255 2.940 447 HB2 PRO 53 2HB PRO 53 -4.173 -7.764 4.335 448 HB3 PRO 53 3HB PRO 53 -4.005 -8.191 2.620 449 HG2 PRO 53 2HG PRO 53 -5.784 -9.447 4.166 450 HG3 PRO 53 3HG PRO 53 -4.878 -10.331 2.912 451 HD2 PRO 53 2HD PRO 53 -4.367 -10.231 5.889 452 HD3 PRO 53 3HD PRO 53 -4.372 -11.631 4.789 453 H ILE 54 H ILE 54 -0.967 -7.201 3.059 454 HA ILE 54 HA ILE 54 -0.370 -6.095 5.735 455 HB ILE 54 HB ILE 54 1.595 -7.377 5.186 456 HG12 ILE 54 2HG1 ILE 54 2.144 -4.429 4.622 457 HG13 ILE 54 3HG1 ILE 54 2.021 -5.170 6.213 458 HG21 ILE 54 1HG2 ILE 54 1.277 -7.667 2.773 459 HG22 ILE 54 2HG2 ILE 54 2.917 -7.129 3.133 460 HG23 ILE 54 3HG2 ILE 54 1.733 -5.984 2.498 461 HD11 ILE 54 3HD1 ILE 54 4.317 -4.777 5.646 462 HD12 ILE 54 1HD1 ILE 54 4.158 -5.697 4.151 463 HD13 ILE 54 2HD1 ILE 54 4.025 -6.513 5.711 464 H VAL 55 H VAL 55 -0.585 -3.921 5.854 465 HA VAL 55 HA VAL 55 -1.185 -2.457 3.350 466 HB VAL 55 HB VAL 55 -2.268 -1.686 6.101 467 HG11 VAL 55 1HG1 VAL 55 -3.157 -0.959 3.282 468 HG12 VAL 55 2HG1 VAL 55 -2.280 0.087 4.402 469 HG13 VAL 55 3HG1 VAL 55 -3.925 -0.420 4.780 470 HG21 VAL 55 3HG2 VAL 55 -3.106 -3.936 5.619 471 HG22 VAL 55 1HG2 VAL 55 -3.675 -3.417 4.034 472 HG23 VAL 55 2HG2 VAL 55 -4.406 -2.756 5.495 473 H ILE 56 H ILE 56 0.472 -1.130 2.834 474 HA ILE 56 HA ILE 56 2.298 -0.148 4.921 475 HB ILE 56 HB ILE 56 2.555 -0.065 1.875 476 HG12 ILE 56 2HG1 ILE 56 2.693 -2.365 2.782 477 HG13 ILE 56 3HG1 ILE 56 4.261 -1.847 2.176 478 HG21 ILE 56 1HG2 ILE 56 4.926 0.575 2.254 479 HG22 ILE 56 2HG2 ILE 56 4.616 0.710 3.985 480 HG23 ILE 56 3HG2 ILE 56 3.812 1.802 2.857 481 HD11 ILE 56 3HD1 ILE 56 4.510 -3.070 4.239 482 HD12 ILE 56 1HD1 ILE 56 3.413 -1.972 5.074 483 HD13 ILE 56 2HD1 ILE 56 4.978 -1.392 4.496 484 H PHE 57 H PHE 57 1.745 1.717 5.834 485 HA PHE 57 HA PHE 57 0.295 3.803 4.356 486 HB2 PHE 57 2HB PHE 57 0.880 3.396 7.318 487 HB3 PHE 57 3HB PHE 57 0.164 4.877 6.690 488 HD1 PHE 57 HD2 PHE 57 -0.414 1.285 7.332 489 HD2 PHE 57 HD1 PHE 57 -2.115 4.913 5.850 490 HE1 PHE 57 HE2 PHE 57 -2.661 0.278 7.390 491 HE2 PHE 57 HE1 PHE 57 -4.348 3.902 5.924 492 HZ PHE 57 HZ PHE 57 -4.608 1.592 6.659 493 H ILE 58 H ILE 58 1.498 5.169 3.283 494 HA ILE 58 HA ILE 58 3.709 6.621 4.546 495 HB ILE 58 HB ILE 58 5.066 6.445 2.368 496 HG12 ILE 58 2HG1 ILE 58 3.204 4.076 1.886 497 HG13 ILE 58 3HG1 ILE 58 3.297 5.546 0.918 498 HG21 ILE 58 1HG2 ILE 58 4.821 3.890 3.996 499 HG22 ILE 58 2HG2 ILE 58 5.795 5.298 4.419 500 HG23 ILE 58 3HG2 ILE 58 6.195 4.352 2.986 501 HD11 ILE 58 3HD1 ILE 58 4.421 3.791 -0.207 502 HD12 ILE 58 1HD1 ILE 58 5.411 3.432 1.205 503 HD13 ILE 58 2HD1 ILE 58 5.624 4.958 0.339 504 H ARG 59 H ARG 59 4.279 8.547 3.321 505 HA ARG 59 HA ARG 59 1.939 9.805 2.061 506 HB2 ARG 59 2HB ARG 59 3.271 10.748 4.074 507 HB3 ARG 59 3HB ARG 59 4.546 11.121 2.928 508 HG2 ARG 59 2HG ARG 59 3.007 12.642 1.726 509 HG3 ARG 59 3HG ARG 59 1.728 12.252 2.880 510 HD2 ARG 59 2HD ARG 59 3.145 13.155 4.722 511 HD3 ARG 59 3HD ARG 59 4.382 13.593 3.539 512 HE ARG 59 HE ARG 59 2.104 14.837 2.651 513 HH11 ARG 59 1HH1 ARG 59 3.959 14.941 5.656 514 HH12 ARG 59 2HH1 ARG 59 3.519 16.580 6.009 515 HH21 ARG 59 1HH2 ARG 59 1.565 16.989 3.101 516 HH22 ARG 59 2HH2 ARG 59 2.153 17.751 4.548 517 H GLY 60 H GLY 60 2.488 11.359 0.173 518 HA2 GLY 60 2HA GLY 60 3.162 9.838 -2.047 519 HA3 GLY 60 3HA GLY 60 3.030 11.586 -2.043 520 H ALA 61 H ALA 61 5.289 11.890 -0.156 521 HA ALA 61 HA ALA 61 7.488 12.008 -1.966 522 HB1 ALA 61 3HB ALA 61 7.209 13.595 -0.115 523 HB2 ALA 61 1HB ALA 61 8.765 12.777 0.007 524 HB3 ALA 61 2HB ALA 61 7.428 12.293 1.058 525 H TYR 62 H TYR 62 6.726 9.960 0.810 526 HA TYR 62 HA TYR 62 9.058 8.329 0.726 527 HB2 TYR 62 2HB TYR 62 6.382 7.721 2.056 528 HB3 TYR 62 3HB TYR 62 7.920 6.942 2.410 529 HD1 TYR 62 HD2 TYR 62 9.769 8.317 3.537 530 HD2 TYR 62 HD1 TYR 62 5.790 9.782 3.095 531 HE1 TYR 62 HE2 TYR 62 10.184 10.000 5.279 532 HE2 TYR 62 HE1 TYR 62 6.204 11.460 4.829 533 HH TYR 62 HH TYR 62 7.696 11.783 6.751 534 H GLU 63 H GLU 63 5.963 8.168 -0.862 535 HA GLU 63 HA GLU 63 5.778 5.499 -1.596 536 HB2 GLU 63 2HB GLU 63 4.002 7.176 -1.980 537 HB3 GLU 63 3HB GLU 63 4.965 7.916 -3.261 538 HG2 GLU 63 2HG GLU 63 4.902 5.648 -4.448 539 HG3 GLU 63 3HG GLU 63 3.734 5.146 -3.234 540 H GLU 64 H GLU 64 7.869 8.014 -2.884 541 HA GLU 64 HA GLU 64 8.700 6.960 -5.310 542 HB2 GLU 64 2HB GLU 64 9.346 9.197 -4.445 543 HB3 GLU 64 3HB GLU 64 10.405 8.437 -3.261 544 HG2 GLU 64 2HG GLU 64 11.759 7.495 -5.099 545 HG3 GLU 64 3HG GLU 64 10.720 8.294 -6.275 546 H VAL 65 H VAL 65 9.627 6.068 -2.074 547 HA VAL 65 HA VAL 65 11.913 4.482 -2.645 548 HB VAL 65 HB VAL 65 10.123 4.445 -0.184 549 HG11 VAL 65 1HG1 VAL 65 12.099 3.692 1.050 550 HG12 VAL 65 2HG1 VAL 65 13.000 3.586 -0.464 551 HG13 VAL 65 3HG1 VAL 65 11.608 2.537 -0.190 552 HG21 VAL 65 3HG2 VAL 65 12.564 6.187 -0.687 553 HG22 VAL 65 1HG2 VAL 65 11.603 6.137 0.793 554 HG23 VAL 65 2HG2 VAL 65 10.889 6.746 -0.698 555 H VAL 66 H VAL 66 8.438 3.772 -2.590 556 HA VAL 66 HA VAL 66 8.372 1.007 -2.251 557 HB VAL 66 HB VAL 66 6.557 2.662 -4.072 558 HG11 VAL 66 1HG1 VAL 66 6.046 -0.125 -2.937 559 HG12 VAL 66 2HG1 VAL 66 6.311 0.273 -4.636 560 HG13 VAL 66 3HG1 VAL 66 4.868 0.859 -3.812 561 HG21 VAL 66 3HG2 VAL 66 5.014 2.689 -2.149 562 HG22 VAL 66 1HG2 VAL 66 6.555 3.455 -1.762 563 HG23 VAL 66 2HG2 VAL 66 6.208 1.825 -1.177 564 H ARG 67 H ARG 67 9.302 2.830 -5.112 565 HA ARG 67 HA ARG 67 9.151 0.917 -7.127 566 HB2 ARG 67 2HB ARG 67 10.460 3.501 -6.708 567 HB3 ARG 67 3HB ARG 67 11.526 2.458 -7.627 568 HG2 ARG 67 2HG ARG 67 8.647 3.021 -8.419 569 HG3 ARG 67 3HG ARG 67 10.026 3.960 -8.985 570 HD2 ARG 67 2HD ARG 67 9.545 1.008 -9.474 571 HD3 ARG 67 3HD ARG 67 9.409 2.315 -10.657 572 HE ARG 67 HE ARG 67 11.979 2.451 -9.611 573 HH11 ARG 67 1HH1 ARG 67 10.132 0.159 -11.568 574 HH12 ARG 67 2HH1 ARG 67 11.556 -0.457 -12.351 575 HH21 ARG 67 1HH2 ARG 67 13.818 1.575 -10.620 576 HH22 ARG 67 2HH2 ARG 67 13.625 0.334 -11.820 577 H ASP 68 H ASP 68 11.657 1.317 -4.672 578 HA ASP 68 HA ASP 68 13.424 -0.761 -5.607 579 HB2 ASP 68 2HB ASP 68 14.343 1.016 -4.255 580 HB3 ASP 68 3HB ASP 68 13.152 0.774 -2.985 581 H ILE 69 H ILE 69 10.834 -0.545 -3.225 582 HA ILE 69 HA ILE 69 11.114 -3.109 -2.018 583 HB ILE 69 HB ILE 69 8.632 -1.321 -2.083 584 HG12 ILE 69 2HG1 ILE 69 10.894 -1.287 -0.018 585 HG13 ILE 69 3HG1 ILE 69 10.717 -0.108 -1.309 586 HG21 ILE 69 1HG2 ILE 69 9.458 -3.435 -0.050 587 HG22 ILE 69 2HG2 ILE 69 8.161 -3.591 -1.237 588 HG23 ILE 69 3HG2 ILE 69 8.030 -2.399 0.054 589 HD11 ILE 69 3HD1 ILE 69 9.923 0.761 0.808 590 HD12 ILE 69 1HD1 ILE 69 8.752 -0.552 0.939 591 HD13 ILE 69 2HD1 ILE 69 8.602 0.643 -0.352 592 H VAL 70 H VAL 70 9.468 -1.980 -4.888 593 HA VAL 70 HA VAL 70 7.397 -3.764 -5.316 594 HB VAL 70 HB VAL 70 9.206 -2.250 -7.245 595 HG11 VAL 70 1HG1 VAL 70 6.847 -3.965 -8.111 596 HG12 VAL 70 2HG1 VAL 70 8.542 -4.233 -8.517 597 HG13 VAL 70 3HG1 VAL 70 7.706 -2.810 -9.134 598 HG21 VAL 70 3HG2 VAL 70 7.172 -0.899 -7.674 599 HG22 VAL 70 1HG2 VAL 70 7.605 -0.906 -5.965 600 HG23 VAL 70 2HG2 VAL 70 6.268 -1.901 -6.536 601 H GLU 71 H GLU 71 10.827 -4.103 -6.227 602 HA GLU 71 HA GLU 71 10.753 -6.468 -7.667 603 HB2 GLU 71 2HB GLU 71 12.770 -5.078 -7.543 604 HB3 GLU 71 3HB GLU 71 12.959 -5.447 -5.831 605 HG2 GLU 71 2HG GLU 71 13.234 -7.895 -6.511 606 HG3 GLU 71 3HG GLU 71 13.292 -7.345 -8.180 607 H TYR 72 H TYR 72 11.186 -6.044 -4.158 608 HA TYR 72 HA TYR 72 11.724 -8.705 -3.495 609 HB2 TYR 72 2HB TYR 72 12.102 -6.727 -1.987 610 HB3 TYR 72 3HB TYR 72 10.364 -6.631 -1.712 611 HD1 TYR 72 HD2 TYR 72 9.208 -8.417 -0.372 612 HD2 TYR 72 HD1 TYR 72 13.450 -8.470 -0.907 613 HE1 TYR 72 HE2 TYR 72 9.412 -10.100 1.401 614 HE2 TYR 72 HE1 TYR 72 13.646 -10.159 0.867 615 HH TYR 72 HH TYR 72 10.962 -11.851 2.085 616 H ALA 73 H ALA 73 8.628 -6.935 -3.353 617 HA ALA 73 HA ALA 73 7.052 -9.071 -2.383 618 HB1 ALA 73 3HB ALA 73 5.127 -7.669 -2.979 619 HB2 ALA 73 1HB ALA 73 6.174 -6.629 -3.953 620 HB3 ALA 73 2HB ALA 73 6.390 -6.712 -2.204 621 H GLN 74 H GLN 74 7.887 -8.076 -5.684 622 HA GLN 74 HA GLN 74 6.147 -9.954 -6.999 623 HB2 GLN 74 2HB GLN 74 8.515 -8.344 -8.022 624 HB3 GLN 74 3HB GLN 74 7.501 -9.358 -9.050 625 HG2 GLN 74 2HG GLN 74 5.526 -7.987 -8.446 626 HG3 GLN 74 3HG GLN 74 6.549 -6.957 -7.445 627 HE21 GLN 74 1HE2 GLN 74 4.909 -6.166 -9.680 628 HE22 GLN 74 2HE2 GLN 74 5.962 -5.466 -10.855 629 H LYS 75 H LYS 75 9.506 -10.095 -5.846 630 HA LYS 75 HA LYS 75 10.187 -12.611 -7.042 631 HB2 LYS 75 2HB LYS 75 11.301 -11.255 -4.544 632 HB3 LYS 75 3HB LYS 75 11.971 -12.725 -5.237 633 HG2 LYS 75 2HG LYS 75 11.883 -10.012 -6.593 634 HG3 LYS 75 3HG LYS 75 13.294 -10.738 -5.825 635 HD2 LYS 75 2HD LYS 75 13.223 -12.593 -7.477 636 HD3 LYS 75 3HD LYS 75 11.832 -11.834 -8.258 637 HE2 LYS 75 2HE LYS 75 13.893 -11.341 -9.486 638 HE3 LYS 75 3HE LYS 75 13.220 -9.862 -8.803 639 HZ1 LYS 75 3HZ LYS 75 14.845 -10.010 -7.004 640 HZ2 LYS 75 1HZ LYS 75 15.616 -9.961 -8.509 641 HZ3 LYS 75 2HZ LYS 75 15.487 -11.425 -7.669 642 H GLU 76 H GLU 76 8.543 -11.622 -4.099 643 HA GLU 76 HA GLU 76 8.203 -14.250 -2.973 644 HB2 GLU 76 2HB GLU 76 6.818 -11.594 -2.381 645 HB3 GLU 76 3HB GLU 76 6.598 -13.059 -1.431 646 HG2 GLU 76 2HG GLU 76 9.179 -11.516 -1.771 647 HG3 GLU 76 3HG GLU 76 8.151 -11.525 -0.341 648 H GLY 77 H GLY 77 6.678 -12.523 -5.498 649 HA2 GLY 77 2HA GLY 77 5.122 -13.260 -7.038 650 HA3 GLY 77 3HA GLY 77 4.852 -14.694 -6.059 651 H LEU 78 H LEU 78 4.616 -11.711 -4.405 652 HA LEU 78 HA LEU 78 1.860 -12.232 -3.736 653 HB2 LEU 78 2HB LEU 78 3.582 -9.870 -2.883 654 HB3 LEU 78 3HB LEU 78 2.098 -10.423 -2.123 655 HG LEU 78 HG LEU 78 4.821 -11.748 -2.059 656 HD11 LEU 78 1HD1 LEU 78 3.051 -10.721 0.172 657 HD12 LEU 78 2HD1 LEU 78 4.497 -9.934 -0.463 658 HD13 LEU 78 3HD1 LEU 78 4.633 -11.483 0.363 659 HD21 LEU 78 3HD2 LEU 78 2.226 -12.949 -1.058 660 HD22 LEU 78 1HD2 LEU 78 3.845 -13.584 -0.744 661 HD23 LEU 78 2HD2 LEU 78 3.220 -13.547 -2.388 662 H ARG 79 H ARG 79 0.147 -10.709 -3.899 663 HA ARG 79 HA ARG 79 -0.073 -9.283 -6.371 664 HB2 ARG 79 2HB ARG 79 -1.924 -10.449 -4.852 665 HB3 ARG 79 3HB ARG 79 -1.973 -8.914 -4.006 666 HG2 ARG 79 2HG ARG 79 -2.535 -9.305 -6.966 667 HG3 ARG 79 3HG ARG 79 -3.761 -9.169 -5.713 668 HD2 ARG 79 2HD ARG 79 -3.204 -6.866 -5.306 669 HD3 ARG 79 3HD ARG 79 -1.750 -6.973 -6.296 670 HE ARG 79 HE ARG 79 -4.374 -6.384 -7.192 671 HH11 ARG 79 1HH1 ARG 79 -1.489 -8.117 -8.242 672 HH12 ARG 79 2HH1 ARG 79 -1.838 -7.924 -9.925 673 HH21 ARG 79 1HH2 ARG 79 -4.787 -6.101 -9.435 674 HH22 ARG 79 2HH2 ARG 79 -3.697 -6.791 -10.602 675 H VAL 80 H VAL 80 0.753 -7.270 -6.724 676 HA VAL 80 HA VAL 80 1.291 -5.486 -4.421 677 HB VAL 80 HB VAL 80 2.728 -4.200 -6.170 678 HG11 VAL 80 1HG1 VAL 80 3.617 -6.996 -5.347 679 HG12 VAL 80 2HG1 VAL 80 3.713 -5.539 -4.357 680 HG13 VAL 80 3HG1 VAL 80 4.682 -5.667 -5.823 681 HG21 VAL 80 3HG2 VAL 80 3.588 -5.522 -8.087 682 HG22 VAL 80 1HG2 VAL 80 1.846 -5.265 -8.219 683 HG23 VAL 80 2HG2 VAL 80 2.468 -6.832 -7.697 684 H LEU 81 H LEU 81 -0.052 -3.885 -4.107 685 HA LEU 81 HA LEU 81 -1.738 -2.765 -6.266 686 HB2 LEU 81 2HB LEU 81 -2.843 -4.692 -4.929 687 HB3 LEU 81 3HB LEU 81 -2.785 -3.635 -3.546 688 HG LEU 81 HG LEU 81 -4.312 -2.034 -4.724 689 HD11 LEU 81 1HD1 LEU 81 -5.492 -2.801 -6.737 690 HD12 LEU 81 2HD1 LEU 81 -4.427 -4.208 -6.823 691 HD13 LEU 81 3HD1 LEU 81 -3.767 -2.583 -7.017 692 HD21 LEU 81 3HD2 LEU 81 -6.361 -3.400 -4.524 693 HD22 LEU 81 1HD2 LEU 81 -5.264 -3.678 -3.173 694 HD23 LEU 81 2HD2 LEU 81 -5.383 -4.870 -4.467 695 H VAL 82 H VAL 82 -1.061 -0.619 -6.201 696 HA VAL 82 HA VAL 82 -0.525 0.634 -3.560 697 HB VAL 82 HB VAL 82 0.274 1.596 -6.360 698 HG11 VAL 82 1HG1 VAL 82 -0.140 3.521 -4.889 699 HG12 VAL 82 2HG1 VAL 82 1.586 3.353 -5.205 700 HG13 VAL 82 3HG1 VAL 82 0.922 2.838 -3.652 701 HG21 VAL 82 3HG2 VAL 82 1.574 -0.368 -5.598 702 HG22 VAL 82 1HG2 VAL 82 2.017 0.486 -4.117 703 HG23 VAL 82 2HG2 VAL 82 2.585 1.073 -5.683 704 H ILE 83 H ILE 83 -2.173 1.711 -2.748 705 HA ILE 83 HA ILE 83 -4.312 2.842 -4.427 706 HB ILE 83 HB ILE 83 -4.180 2.504 -1.383 707 HG12 ILE 83 2HG1 ILE 83 -5.662 0.700 -3.355 708 HG13 ILE 83 3HG1 ILE 83 -4.056 0.329 -2.728 709 HG21 ILE 83 1HG2 ILE 83 -6.570 3.090 -3.181 710 HG22 ILE 83 2HG2 ILE 83 -5.802 4.224 -2.067 711 HG23 ILE 83 3HG2 ILE 83 -6.638 2.806 -1.439 712 HD11 ILE 83 3HD1 ILE 83 -5.658 -0.875 -1.462 713 HD12 ILE 83 1HD1 ILE 83 -6.593 0.582 -1.131 714 HD13 ILE 83 2HD1 ILE 83 -4.986 0.381 -0.428 715 H LYS 84 H LYS 84 -4.035 4.986 -4.901 716 HA LYS 84 HA LYS 84 -2.376 6.705 -3.119 717 HB2 LYS 84 2HB LYS 84 -1.155 5.697 -5.120 718 HB3 LYS 84 3HB LYS 84 -2.265 6.565 -6.166 719 HG2 LYS 84 2HG LYS 84 -1.285 8.615 -4.581 720 HG3 LYS 84 3HG LYS 84 0.111 7.544 -4.675 721 HD2 LYS 84 2HD LYS 84 -1.366 8.909 -6.933 722 HD3 LYS 84 3HD LYS 84 0.311 9.120 -6.447 723 HE2 LYS 84 2HE LYS 84 -0.833 6.600 -7.695 724 HE3 LYS 84 3HE LYS 84 0.048 7.853 -8.559 725 HZ1 LYS 84 3HZ LYS 84 1.572 6.125 -8.087 726 HZ2 LYS 84 1HZ LYS 84 1.101 6.043 -6.464 727 HZ3 LYS 84 2HZ LYS 84 1.949 7.386 -7.024 728 H VAL 85 H VAL 85 -3.321 8.680 -2.711 729 HA VAL 85 HA VAL 85 -5.719 9.489 -4.172 730 HB VAL 85 HB VAL 85 -4.306 10.930 -1.866 731 HG11 VAL 85 1HG1 VAL 85 -5.666 12.484 -3.209 732 HG12 VAL 85 2HG1 VAL 85 -6.411 12.226 -1.632 733 HG13 VAL 85 3HG1 VAL 85 -7.068 11.421 -3.059 734 HG21 VAL 85 3HG2 VAL 85 -6.761 9.118 -1.783 735 HG22 VAL 85 1HG2 VAL 85 -6.095 10.015 -0.412 736 HG23 VAL 85 2HG2 VAL 85 -5.156 8.720 -1.157 737 H ALA 86 H ALA 86 -5.297 10.235 -6.130 738 HA ALA 86 HA ALA 86 -3.000 11.898 -6.800 739 HB1 ALA 86 3HB ALA 86 -5.301 10.878 -8.510 740 HB2 ALA 86 1HB ALA 86 -3.722 10.106 -8.329 741 HB3 ALA 86 2HB ALA 86 -3.846 11.685 -9.106 742 H GLN 87 H GLN 87 -3.103 14.100 -7.271 743 HA GLN 87 HA GLN 87 -5.689 15.515 -7.229 744 HB2 GLN 87 2HB GLN 87 -3.414 16.139 -5.279 745 HB3 GLN 87 3HB GLN 87 -4.830 17.153 -5.511 746 HG2 GLN 87 2HG GLN 87 -6.270 15.379 -4.619 747 HG3 GLN 87 3HG GLN 87 -4.874 14.317 -4.433 748 HE21 GLN 87 1HE2 GLN 87 -6.746 15.280 -2.405 749 HE22 GLN 87 2HE2 GLN 87 -5.796 16.102 -1.224 750 H ASP 88 H ASP 88 -4.993 15.711 -9.480 751 HA ASP 88 HA ASP 88 -4.230 16.735 -11.315 752 HB2 ASP 88 2HB ASP 88 -3.537 18.983 -9.388 753 HB3 ASP 88 3HB ASP 88 -3.324 19.119 -11.134 754 H GLN 89 H GLN 89 -1.702 17.911 -9.098 755 HA GLN 89 HA GLN 89 0.644 17.902 -9.674 756 HB2 GLN 89 2HB GLN 89 -0.229 15.491 -8.054 757 HB3 GLN 89 3HB GLN 89 1.443 16.043 -8.145 758 HG2 GLN 89 2HG GLN 89 0.937 18.090 -7.031 759 HG3 GLN 89 3HG GLN 89 -0.802 17.835 -7.193 760 HE21 GLN 89 1HE2 GLN 89 -1.825 16.345 -5.832 761 HE22 GLN 89 2HE2 GLN 89 -1.095 15.778 -4.373 762 H GLU 90 H GLU 90 1.084 17.600 -11.856 763 HA GLU 90 HA GLU 90 1.114 15.172 -13.258 764 HB2 GLU 90 2HB GLU 90 2.712 17.725 -13.628 765 HB3 GLU 90 3HB GLU 90 2.792 16.379 -14.765 766 HG2 GLU 90 2HG GLU 90 0.344 16.586 -15.158 767 HG3 GLU 90 3HG GLU 90 0.301 17.961 -14.055 768 H LEU 91 H LEU 91 3.448 16.598 -11.085 769 HA LEU 91 HA LEU 91 5.696 14.977 -11.440 770 HB2 LEU 91 2HB LEU 91 4.585 16.313 -8.937 771 HB3 LEU 91 3HB LEU 91 6.122 15.471 -8.957 772 HG LEU 91 HG LEU 91 6.959 17.114 -10.676 773 HD11 LEU 91 1HD1 LEU 91 4.847 17.893 -11.628 774 HD12 LEU 91 2HD1 LEU 91 5.815 19.240 -11.034 775 HD13 LEU 91 3HD1 LEU 91 4.426 18.676 -10.102 776 HD21 LEU 91 3HD2 LEU 91 7.526 17.355 -8.309 777 HD22 LEU 91 1HD2 LEU 91 6.074 18.323 -8.035 778 HD23 LEU 91 2HD2 LEU 91 7.366 18.932 -9.076 779 H LEU 92 H LEU 92 2.920 14.553 -9.258 780 HA LEU 92 HA LEU 92 3.476 12.010 -8.194 781 HB2 LEU 92 2HB LEU 92 1.862 13.511 -7.208 782 HB3 LEU 92 3HB LEU 92 0.903 13.572 -8.664 783 HG LEU 92 HG LEU 92 1.116 11.000 -7.046 784 HD11 LEU 92 1HD1 LEU 92 -0.898 13.240 -6.587 785 HD12 LEU 92 2HD1 LEU 92 0.373 12.731 -5.473 786 HD13 LEU 92 3HD1 LEU 92 -0.951 11.632 -5.850 787 HD21 LEU 92 3HD2 LEU 92 -1.143 10.559 -8.048 788 HD22 LEU 92 1HD2 LEU 92 0.132 10.707 -9.255 789 HD23 LEU 92 2HD2 LEU 92 -0.984 12.039 -8.991 790 H GLU 93 H GLU 93 1.770 13.007 -11.118 791 HA GLU 93 HA GLU 93 0.713 10.515 -11.931 792 HB2 GLU 93 2HB GLU 93 -0.239 12.603 -12.703 793 HB3 GLU 93 3HB GLU 93 1.278 13.095 -13.442 794 HG2 GLU 93 2HG GLU 93 1.053 11.347 -15.133 795 HG3 GLU 93 3HG GLU 93 -0.422 10.762 -14.368 796 H ARG 94 H ARG 94 3.892 11.954 -12.384 797 HA ARG 94 HA ARG 94 4.760 10.312 -14.556 798 HB2 ARG 94 2HB ARG 94 6.480 11.591 -12.384 799 HB3 ARG 94 3HB ARG 94 7.056 10.970 -13.928 800 HG2 ARG 94 2HG ARG 94 5.341 13.408 -13.435 801 HG3 ARG 94 3HG ARG 94 6.976 13.350 -14.088 802 HD2 ARG 94 2HD ARG 94 6.152 12.287 -16.134 803 HD3 ARG 94 3HD ARG 94 4.514 12.223 -15.477 804 HE ARG 94 HE ARG 94 5.977 14.689 -16.212 805 HH11 ARG 94 1HH1 ARG 94 2.919 13.041 -15.644 806 HH12 ARG 94 2HH1 ARG 94 1.955 14.370 -16.203 807 HH21 ARG 94 1HH2 ARG 94 4.715 16.406 -16.977 808 HH22 ARG 94 2HH2 ARG 94 2.981 16.287 -16.959 809 H PHE 95 H PHE 95 5.290 10.105 -11.026 810 HA PHE 95 HA PHE 95 6.683 7.650 -11.017 811 HB2 PHE 95 2HB PHE 95 6.700 9.263 -9.107 812 HB3 PHE 95 3HB PHE 95 5.015 8.872 -8.765 813 HD1 PHE 95 HD2 PHE 95 8.464 7.504 -8.843 814 HD2 PHE 95 HD1 PHE 95 4.452 6.851 -7.522 815 HE1 PHE 95 HE2 PHE 95 9.200 5.562 -7.545 816 HE2 PHE 95 HE1 PHE 95 5.204 4.900 -6.232 817 HZ PHE 95 HZ PHE 95 7.577 4.250 -6.247 818 H TYR 96 H TYR 96 3.285 8.448 -10.797 819 HA TYR 96 HA TYR 96 2.049 6.057 -10.185 820 HB2 TYR 96 2HB TYR 96 0.638 7.926 -10.287 821 HB3 TYR 96 3HB TYR 96 1.317 8.498 -11.799 822 HD1 TYR 96 HD1 TYR 96 -0.871 5.765 -10.422 823 HD2 TYR 96 HD2 TYR 96 0.110 8.188 -13.803 824 HE1 TYR 96 HE1 TYR 96 -2.816 4.873 -11.626 825 HE2 TYR 96 HE2 TYR 96 -1.837 7.297 -15.006 826 HH TYR 96 HH TYR 96 -4.319 5.600 -13.537 827 H GLU 97 H GLU 97 3.409 7.117 -13.274 828 HA GLU 97 HA GLU 97 2.210 5.059 -14.884 829 HB2 GLU 97 2HB GLU 97 2.827 7.330 -15.735 830 HB3 GLU 97 3HB GLU 97 4.530 6.932 -15.532 831 HG2 GLU 97 2HG GLU 97 4.307 5.125 -17.194 832 HG3 GLU 97 3HG GLU 97 2.598 5.500 -17.389 833 H GLN 98 H GLN 98 5.340 5.541 -13.310 834 HA GLN 98 HA GLN 98 6.766 3.439 -14.545 835 HB2 GLN 98 2HB GLN 98 7.164 5.001 -11.992 836 HB3 GLN 98 3HB GLN 98 8.165 3.581 -12.289 837 HG2 GLN 98 2HG GLN 98 9.411 5.469 -13.040 838 HG3 GLN 98 3HG GLN 98 8.850 4.630 -14.488 839 HE21 GLN 98 1HE2 GLN 98 7.110 5.585 -15.695 840 HE22 GLN 98 2HE2 GLN 98 6.763 7.273 -15.564 841 H LEU 99 H LEU 99 4.716 3.500 -11.673 842 HA LEU 99 HA LEU 99 5.122 0.912 -10.676 843 HB2 LEU 99 2HB LEU 99 2.580 2.596 -10.698 844 HB3 LEU 99 3HB LEU 99 2.820 1.179 -9.686 845 HG LEU 99 HG LEU 99 4.440 3.756 -9.505 846 HD11 LEU 99 1HD1 LEU 99 2.311 2.709 -7.611 847 HD12 LEU 99 2HD1 LEU 99 2.141 4.083 -8.707 848 HD13 LEU 99 3HD1 LEU 99 3.299 4.158 -7.380 849 HD21 LEU 99 3HD2 LEU 99 4.543 1.263 -7.782 850 HD22 LEU 99 1HD2 LEU 99 5.405 2.772 -7.460 851 HD23 LEU 99 2HD2 LEU 99 5.790 1.828 -8.897 852 H LYS 100 H LYS 100 3.050 2.086 -13.266 853 HA LYS 100 HA LYS 100 1.559 -0.326 -13.686 854 HB2 LYS 100 2HB LYS 100 1.928 1.946 -15.687 855 HB3 LYS 100 3HB LYS 100 0.564 0.834 -15.551 856 HG2 LYS 100 2HG LYS 100 -0.054 1.830 -13.384 857 HG3 LYS 100 3HG LYS 100 1.338 2.908 -13.480 858 HD2 LYS 100 2HD LYS 100 -0.509 4.236 -14.151 859 HD3 LYS 100 3HD LYS 100 0.308 3.818 -15.656 860 HE2 LYS 100 2HE LYS 100 -1.364 2.012 -16.029 861 HE3 LYS 100 3HE LYS 100 -2.185 2.490 -14.539 862 HZ1 LYS 100 3HZ LYS 100 -2.536 4.698 -15.531 863 HZ2 LYS 100 1HZ LYS 100 -3.278 3.468 -16.419 864 HZ3 LYS 100 2HZ LYS 100 -1.844 4.160 -16.974 865 H LYS 101 H LYS 101 4.497 1.058 -15.064 866 HA LYS 101 HA LYS 101 4.840 -0.830 -17.188 867 HB2 LYS 101 2HB LYS 101 6.890 0.940 -15.793 868 HB3 LYS 101 3HB LYS 101 7.173 0.054 -17.290 869 HG2 LYS 101 2HG LYS 101 5.368 1.400 -18.386 870 HG3 LYS 101 3HG LYS 101 5.203 2.331 -16.891 871 HD2 LYS 101 2HD LYS 101 7.561 3.071 -17.084 872 HD3 LYS 101 3HD LYS 101 7.735 2.138 -18.575 873 HE2 LYS 101 2HE LYS 101 5.857 4.486 -18.152 874 HE3 LYS 101 3HE LYS 101 7.379 4.524 -19.041 875 HZ1 LYS 101 3HZ LYS 101 6.436 2.957 -20.631 876 HZ2 LYS 101 1HZ LYS 101 5.496 4.355 -20.526 877 HZ3 LYS 101 2HZ LYS 101 4.981 2.935 -19.778 878 H ASP 102 H ASP 102 5.869 -0.710 -13.800 879 HA ASP 102 HA ASP 102 7.458 -3.089 -13.785 880 HB2 ASP 102 2HB ASP 102 5.985 -1.638 -11.543 881 HB3 ASP 102 3HB ASP 102 7.023 -3.032 -11.258 882 H GLY 103 H GLY 103 4.089 -2.577 -14.017 883 HA2 GLY 103 2HA GLY 103 2.382 -4.121 -14.313 884 HA3 GLY 103 3HA GLY 103 3.468 -5.415 -13.819 885 H VAL 104 H VAL 104 3.373 -2.650 -11.797 886 HA VAL 104 HA VAL 104 1.930 -3.982 -9.656 887 HB VAL 104 HB VAL 104 3.118 -1.159 -9.800 888 HG11 VAL 104 1HG1 VAL 104 2.028 -2.641 -7.370 889 HG12 VAL 104 2HG1 VAL 104 1.290 -1.239 -8.146 890 HG13 VAL 104 3HG1 VAL 104 2.851 -1.078 -7.343 891 HG21 VAL 104 3HG2 VAL 104 4.925 -2.074 -8.390 892 HG22 VAL 104 1HG2 VAL 104 4.824 -2.922 -9.935 893 HG23 VAL 104 2HG2 VAL 104 4.186 -3.678 -8.469 894 H ASP 105 H ASP 105 -0.166 -3.643 -9.140 895 HA ASP 105 HA ASP 105 -1.819 -2.113 -10.968 896 HB2 ASP 105 2HB ASP 105 -2.371 -4.455 -10.001 897 HB3 ASP 105 3HB ASP 105 -2.754 -3.636 -8.506 898 H VAL 106 H VAL 106 -1.307 0.059 -10.507 899 HA VAL 106 HA VAL 106 -1.728 1.056 -7.778 900 HB VAL 106 HB VAL 106 0.207 1.983 -8.856 901 HG11 VAL 106 1HG1 VAL 106 -0.352 1.625 -11.198 902 HG12 VAL 106 2HG1 VAL 106 0.179 3.285 -10.930 903 HG13 VAL 106 3HG1 VAL 106 -1.539 2.932 -11.136 904 HG21 VAL 106 3HG2 VAL 106 -0.221 4.416 -8.706 905 HG22 VAL 106 1HG2 VAL 106 -1.011 3.536 -7.394 906 HG23 VAL 106 2HG2 VAL 106 -1.959 4.118 -8.765 907 H ARG 107 H ARG 107 -3.705 1.481 -7.181 908 HA ARG 107 HA ARG 107 -5.789 2.309 -9.070 909 HB2 ARG 107 2HB ARG 107 -6.207 1.721 -6.119 910 HB3 ARG 107 3HB ARG 107 -7.397 1.698 -7.409 911 HG2 ARG 107 2HG ARG 107 -5.231 -0.341 -6.870 912 HG3 ARG 107 3HG ARG 107 -6.969 -0.555 -6.690 913 HD2 ARG 107 2HD ARG 107 -5.503 -0.130 -9.312 914 HD3 ARG 107 3HD ARG 107 -6.090 -1.675 -8.697 915 HE ARG 107 HE ARG 107 -8.220 0.208 -8.891 916 HH11 ARG 107 1HH1 ARG 107 -6.207 -1.911 -10.868 917 HH12 ARG 107 2HH1 ARG 107 -7.405 -2.068 -12.117 918 HH21 ARG 107 1HH2 ARG 107 -9.764 -0.012 -10.569 919 HH22 ARG 107 2HH2 ARG 107 -9.407 -1.001 -11.945 920 H VAL 108 H VAL 108 -5.699 4.535 -9.384 921 HA VAL 108 HA VAL 108 -5.132 6.312 -7.139 922 HB VAL 108 HB VAL 108 -5.615 8.201 -8.725 923 HG11 VAL 108 1HG1 VAL 108 -3.320 7.384 -8.448 924 HG12 VAL 108 2HG1 VAL 108 -3.588 7.931 -10.101 925 HG13 VAL 108 3HG1 VAL 108 -3.557 6.203 -9.739 926 HG21 VAL 108 3HG2 VAL 108 -7.238 7.104 -10.210 927 HG22 VAL 108 1HG2 VAL 108 -5.985 6.024 -10.823 928 HG23 VAL 108 2HG2 VAL 108 -5.896 7.759 -11.144 929 H THR 109 H THR 109 -6.598 7.051 -5.793 930 HA THR 109 HA THR 109 -9.415 6.407 -6.056 931 HB THR 109 HB THR 109 -9.609 7.364 -3.788 932 HG1 THR 109 HG1 THR 109 -8.285 8.956 -3.346 933 HG21 THR 109 3HG2 THR 109 -7.964 5.956 -2.568 934 HG22 THR 109 1HG2 THR 109 -7.082 5.689 -4.073 935 HG23 THR 109 2HG2 THR 109 -8.728 5.073 -3.889 936 H ASP 110 H ASP 110 -7.274 9.164 -6.156 937 HA ASP 110 HA ASP 110 -7.358 11.320 -6.656 938 HB2 ASP 110 2HB ASP 110 -8.428 10.424 -8.803 939 HB3 ASP 110 3HB ASP 110 -9.988 10.855 -8.116 940 H ASN 111 H ASN 111 -10.852 10.636 -6.203 941 HA ASN 111 HA ASN 111 -11.361 12.515 -4.172 942 HB2 ASN 111 2HB ASN 111 -13.113 11.320 -5.474 943 HB3 ASN 111 3HB ASN 111 -12.688 9.811 -4.679 944 HD21 ASN 111 1HD2 ASN 111 -15.238 11.294 -4.771 945 HD22 ASN 111 2HD2 ASN 111 -15.699 11.545 -3.125 946 H GLU 112 H GLU 112 -10.784 12.539 -2.145 947 HA GLU 112 HA GLU 112 -8.883 10.697 -1.049 948 HB2 GLU 112 2HB GLU 112 -9.304 12.375 1.049 949 HB3 GLU 112 3HB GLU 112 -8.292 12.786 -0.323 950 HG2 GLU 112 2HG GLU 112 -9.724 14.670 0.258 951 HG3 GLU 112 3HG GLU 112 -10.111 14.055 -1.346 952 H ASP 113 H ASP 113 -12.296 11.370 -0.409 953 HA ASP 113 HA ASP 113 -12.499 9.769 1.970 954 HB2 ASP 113 2HB ASP 113 -13.991 11.691 1.589 955 HB3 ASP 113 3HB ASP 113 -14.656 10.929 0.152 956 H GLU 114 H GLU 114 -12.963 9.229 -1.463 957 HA GLU 114 HA GLU 114 -14.273 6.731 -1.431 958 HB2 GLU 114 2HB GLU 114 -13.948 8.185 -3.457 959 HB3 GLU 114 3HB GLU 114 -12.248 7.731 -3.482 960 HG2 GLU 114 2HG GLU 114 -13.017 5.312 -3.720 961 HG3 GLU 114 3HG GLU 114 -14.649 5.932 -3.962 962 H ALA 115 H ALA 115 -10.912 7.606 -0.909 963 HA ALA 115 HA ALA 115 -9.596 5.178 -1.333 964 HB1 ALA 115 3HB ALA 115 -7.825 6.057 0.123 965 HB2 ALA 115 1HB ALA 115 -8.922 7.302 0.730 966 HB3 ALA 115 2HB ALA 115 -8.425 7.312 -0.962 967 H LYS 116 H LYS 116 -11.115 6.454 1.607 968 HA LYS 116 HA LYS 116 -10.702 4.422 3.460 969 HB2 LYS 116 2HB LYS 116 -11.610 6.532 4.131 970 HB3 LYS 116 3HB LYS 116 -12.914 6.434 2.959 971 HG2 LYS 116 2HG LYS 116 -13.744 4.406 4.406 972 HG3 LYS 116 3HG LYS 116 -12.687 5.077 5.648 973 HD2 LYS 116 2HD LYS 116 -14.936 6.550 4.238 974 HD3 LYS 116 3HD LYS 116 -15.012 5.900 5.879 975 HE2 LYS 116 2HE LYS 116 -13.294 7.479 6.613 976 HE3 LYS 116 3HE LYS 116 -13.085 8.062 4.957 977 HZ1 LYS 116 3HZ LYS 116 -14.481 9.530 6.293 978 HZ2 LYS 116 1HZ LYS 116 -15.590 8.277 6.537 979 HZ3 LYS 116 2HZ LYS 116 -15.336 8.885 4.984 980 H LYS 117 H LYS 117 -13.301 4.840 1.086 981 HA LYS 117 HA LYS 117 -14.957 2.698 1.899 982 HB2 LYS 117 2HB LYS 117 -14.778 3.929 -0.885 983 HB3 LYS 117 3HB LYS 117 -16.150 3.058 -0.206 984 HG2 LYS 117 2HG LYS 117 -16.450 4.885 1.464 985 HG3 LYS 117 3HG LYS 117 -15.106 5.754 0.719 986 HD2 LYS 117 2HD LYS 117 -16.391 5.817 -1.437 987 HD3 LYS 117 3HD LYS 117 -17.751 5.042 -0.619 988 HE2 LYS 117 2HE LYS 117 -16.569 7.760 0.053 989 HE3 LYS 117 3HE LYS 117 -18.095 7.464 -0.776 990 HZ1 LYS 117 3HZ LYS 117 -18.942 6.411 1.230 991 HZ2 LYS 117 1HZ LYS 117 -18.434 7.992 1.553 992 HZ3 LYS 117 2HZ LYS 117 -17.476 6.683 2.026 993 H ARG 118 H ARG 118 -12.491 2.986 -0.642 994 HA ARG 118 HA ARG 118 -12.893 0.373 -1.697 995 HB2 ARG 118 2HB ARG 118 -10.545 2.259 -2.139 996 HB3 ARG 118 3HB ARG 118 -10.865 0.793 -3.056 997 HG2 ARG 118 2HG ARG 118 -13.207 1.996 -3.526 998 HG3 ARG 118 3HG ARG 118 -12.278 3.445 -3.156 999 HD2 ARG 118 2HD ARG 118 -11.819 1.454 -5.393 1000 HD3 ARG 118 3HD ARG 118 -12.221 3.167 -5.527 1001 HE ARG 118 HE ARG 118 -9.651 2.367 -4.332 1002 HH11 ARG 118 1HH1 ARG 118 -11.338 3.953 -6.996 1003 HH12 ARG 118 2HH1 ARG 118 -9.885 4.644 -7.650 1004 HH21 ARG 118 1HH2 ARG 118 -7.778 3.251 -5.221 1005 HH22 ARG 118 2HH2 ARG 118 -7.874 4.241 -6.640 1006 H LEU 119 H LEU 119 -10.855 1.640 0.896 1007 HA LEU 119 HA LEU 119 -9.059 -0.519 1.168 1008 HB2 LEU 119 2HB LEU 119 -10.249 1.343 3.257 1009 HB3 LEU 119 3HB LEU 119 -9.067 0.108 3.674 1010 HG LEU 119 HG LEU 119 -8.609 2.472 1.822 1011 HD11 LEU 119 1HD1 LEU 119 -7.046 3.226 3.554 1012 HD12 LEU 119 2HD1 LEU 119 -7.483 1.847 4.567 1013 HD13 LEU 119 3HD1 LEU 119 -8.686 3.082 4.184 1014 HD21 LEU 119 3HD2 LEU 119 -7.389 0.497 1.015 1015 HD22 LEU 119 1HD2 LEU 119 -6.666 0.278 2.613 1016 HD23 LEU 119 2HD2 LEU 119 -6.293 1.714 1.654 1017 H LYS 120 H LYS 120 -12.202 0.018 2.799 1018 HA LYS 120 HA LYS 120 -12.327 -2.441 4.156 1019 HB2 LYS 120 2HB LYS 120 -13.784 -0.503 4.716 1020 HB3 LYS 120 3HB LYS 120 -14.646 -0.703 3.189 1021 HG2 LYS 120 2HG LYS 120 -15.390 -2.962 3.923 1022 HG3 LYS 120 3HG LYS 120 -14.564 -2.719 5.465 1023 HD2 LYS 120 2HD LYS 120 -16.077 -0.840 5.995 1024 HD3 LYS 120 3HD LYS 120 -16.867 -1.013 4.423 1025 HE2 LYS 120 2HE LYS 120 -17.631 -3.275 5.047 1026 HE3 LYS 120 3HE LYS 120 -16.826 -3.123 6.611 1027 HZ1 LYS 120 3HZ LYS 120 -19.047 -1.397 5.655 1028 HZ2 LYS 120 1HZ LYS 120 -18.298 -1.306 7.166 1029 HZ3 LYS 120 2HZ LYS 120 -19.199 -2.671 6.751 1030 H GLU 121 H GLU 121 -13.442 -1.461 0.955 1031 HA GLU 121 HA GLU 121 -14.861 -3.658 0.046 1032 HB2 GLU 121 2HB GLU 121 -14.715 -1.574 -1.221 1033 HB3 GLU 121 3HB GLU 121 -12.982 -1.772 -1.431 1034 HG2 GLU 121 2HG GLU 121 -14.043 -2.268 -3.520 1035 HG3 GLU 121 3HG GLU 121 -13.427 -3.780 -2.856 1036 H LEU 122 H LEU 122 -11.348 -3.060 -0.262 1037 HA LEU 122 HA LEU 122 -10.718 -5.471 -1.624 1038 HB2 LEU 122 2HB LEU 122 -8.888 -3.683 0.028 1039 HB3 LEU 122 3HB LEU 122 -8.362 -4.890 -1.136 1040 HG LEU 122 HG LEU 122 -9.936 -2.385 -1.830 1041 HD11 LEU 122 1HD1 LEU 122 -7.714 -1.803 -1.070 1042 HD12 LEU 122 2HD1 LEU 122 -7.855 -1.539 -2.805 1043 HD13 LEU 122 3HD1 LEU 122 -6.993 -2.955 -2.196 1044 HD21 LEU 122 3HD2 LEU 122 -10.387 -4.162 -3.426 1045 HD22 LEU 122 1HD2 LEU 122 -8.656 -4.414 -3.670 1046 HD23 LEU 122 2HD2 LEU 122 -9.413 -2.896 -4.167 1047 H LEU 123 H LEU 123 -10.574 -4.523 1.810 1048 HA LEU 123 HA LEU 123 -9.233 -6.743 2.881 1049 HB2 LEU 123 2HB LEU 123 -11.002 -4.588 3.972 1050 HB3 LEU 123 3HB LEU 123 -10.844 -6.012 4.985 1051 HG LEU 123 HG LEU 123 -8.405 -5.704 5.104 1052 HD11 LEU 123 1HD1 LEU 123 -7.284 -3.708 4.246 1053 HD12 LEU 123 2HD1 LEU 123 -8.767 -3.202 3.437 1054 HD13 LEU 123 3HD1 LEU 123 -7.947 -4.680 2.931 1055 HD21 LEU 123 3HD2 LEU 123 -9.991 -3.223 5.816 1056 HD22 LEU 123 1HD2 LEU 123 -8.420 -3.670 6.487 1057 HD23 LEU 123 2HD2 LEU 123 -9.824 -4.685 6.794 1058 H GLU 124 H GLU 124 -12.712 -6.223 2.429 1059 HA GLU 124 HA GLU 124 -13.680 -8.541 3.712 1060 HB2 GLU 124 2HB GLU 124 -14.886 -6.863 1.480 1061 HB3 GLU 124 3HB GLU 124 -15.775 -8.089 2.376 1062 HG2 GLU 124 2HG GLU 124 -15.599 -6.829 4.428 1063 HG3 GLU 124 3HG GLU 124 -14.483 -5.681 3.693 1064 H LYS 125 H LYS 125 -12.487 -8.029 0.426 1065 HA LYS 125 HA LYS 125 -13.089 -10.764 -0.405 1066 HB2 LYS 125 2HB LYS 125 -11.645 -8.448 -1.747 1067 HB3 LYS 125 3HB LYS 125 -11.538 -10.071 -2.402 1068 HG2 LYS 125 2HG LYS 125 -13.190 -9.072 -3.694 1069 HG3 LYS 125 3HG LYS 125 -14.120 -10.010 -2.538 1070 HD2 LYS 125 2HD LYS 125 -13.570 -7.093 -1.980 1071 HD3 LYS 125 3HD LYS 125 -14.797 -7.521 -3.166 1072 HE2 LYS 125 2HE LYS 125 -16.070 -8.729 -1.496 1073 HE3 LYS 125 3HE LYS 125 -14.796 -8.496 -0.300 1074 HZ1 LYS 125 3HZ LYS 125 -16.439 -6.346 -1.539 1075 HZ2 LYS 125 1HZ LYS 125 -15.184 -6.094 -0.435 1076 HZ3 LYS 125 2HZ LYS 125 -16.578 -6.918 0.045 1077 H VAL 126 H VAL 126 -10.018 -8.994 -0.455 1078 HA VAL 126 HA VAL 126 -8.556 -10.351 1.487 1079 HB VAL 126 HB VAL 126 -8.696 -12.357 0.048 1080 HG11 VAL 126 1HG1 VAL 126 -7.708 -12.456 -2.215 1081 HG12 VAL 126 2HG1 VAL 126 -7.405 -10.718 -2.158 1082 HG13 VAL 126 3HG1 VAL 126 -9.061 -11.323 -2.138 1083 HG21 VAL 126 3HG2 VAL 126 -6.286 -12.868 -0.164 1084 HG22 VAL 126 1HG2 VAL 126 -6.650 -12.047 1.355 1085 HG23 VAL 126 2HG2 VAL 126 -5.905 -11.156 0.026 1086 H GLY 127 H GLY 127 -8.529 -8.828 -1.685 1087 HA2 GLY 127 2HA GLY 127 -7.299 -6.447 -1.098 1088 HA3 GLY 127 3HA GLY 127 -5.978 -7.538 -1.532 1089 H SER 128 H SER 128 -9.317 -7.221 -2.688 1090 HA SER 128 HA SER 128 -8.583 -6.467 -5.384 1091 HB2 SER 128 2HB SER 128 -9.630 -8.576 -6.374 1092 HB3 SER 128 3HB SER 128 -8.092 -8.842 -5.554 1093 HG SER 128 HG SER 128 -10.525 -9.876 -5.002 1094 H LEU 129 H LEU 129 -10.501 -6.101 -6.735 1095 HA LEU 129 HA LEU 129 -13.005 -5.628 -5.215 1096 HB2 LEU 129 2HB LEU 129 -13.428 -3.619 -6.527 1097 HB3 LEU 129 3HB LEU 129 -11.890 -3.466 -5.704 1098 HG LEU 129 HG LEU 129 -12.126 -4.198 -8.654 1099 HD11 LEU 129 1HD1 LEU 129 -13.132 -1.995 -8.324 1100 HD12 LEU 129 2HD1 LEU 129 -11.604 -1.855 -9.185 1101 HD13 LEU 129 3HD1 LEU 129 -11.689 -1.434 -7.472 1102 HD21 LEU 129 3HD2 LEU 129 -9.967 -4.818 -7.655 1103 HD22 LEU 129 1HD2 LEU 129 -9.738 -3.165 -7.077 1104 HD23 LEU 129 2HD2 LEU 129 -9.771 -3.504 -8.809 1105 H GLU 130 H GLU 130 -14.962 -5.914 -6.394 1106 HA GLU 130 HA GLU 130 -14.733 -7.895 -8.594 1107 HB2 GLU 130 2HB GLU 130 -17.004 -7.580 -6.583 1108 HB3 GLU 130 3HB GLU 130 -16.785 -8.901 -7.724 1109 HG2 GLU 130 2HG GLU 130 -14.830 -9.692 -6.471 1110 HG3 GLU 130 3HG GLU 130 -14.952 -8.312 -5.376 1111 H HIS 131 H HIS 131 -17.367 -5.888 -7.299 1112 HA HIS 131 HA HIS 131 -18.393 -5.477 -10.038 1113 HB2 HIS 131 2HB HIS 131 -20.663 -5.332 -8.720 1114 HB3 HIS 131 3HB HIS 131 -19.937 -6.905 -8.997 1115 HD1 HIS 131 HD1 HIS 131 -19.334 -8.293 -6.990 1116 HD2 HIS 131 HD2 HIS 131 -20.475 -4.428 -5.956 1117 HE1 HIS 131 HE1 HIS 131 -19.572 -8.305 -4.495 1118 HE2 HIS 131 HE2 HIS 131 -20.170 -5.948 -3.882 1119 H HIS 132 H HIS 132 -16.562 -3.723 -8.365 1120 HA HIS 132 HA HIS 132 -17.965 -1.275 -7.923 1121 HB2 HIS 132 2HB HIS 132 -15.778 -1.625 -6.889 1122 HB3 HIS 132 3HB HIS 132 -15.011 -1.815 -8.459 1123 HD1 HIS 132 HD1 HIS 132 -16.437 0.832 -6.170 1124 HD2 HIS 132 HD2 HIS 132 -14.323 0.582 -9.744 1125 HE1 HIS 132 HE1 HIS 132 -15.681 3.171 -6.677 1126 HE2 HIS 132 HE2 HIS 132 -14.593 3.022 -8.936 1127 H HIS 133 H HIS 133 -19.189 -0.598 -9.566 1128 HA HIS 133 HA HIS 133 -18.536 -0.782 -12.346 1129 HB2 HIS 133 2HB HIS 133 -20.721 0.831 -10.955 1130 HB3 HIS 133 3HB HIS 133 -20.639 0.503 -12.685 1131 HD1 HIS 133 HD1 HIS 133 -22.197 -0.739 -9.698 1132 HD2 HIS 133 HD2 HIS 133 -20.706 -2.481 -13.164 1133 HE1 HIS 133 HE1 HIS 133 -23.303 -2.987 -9.852 1134 HE2 HIS 133 HE2 HIS 133 -22.358 -4.030 -11.931 1135 H HIS 134 H HIS 134 -17.904 0.836 -13.758 1136 HA HIS 134 HA HIS 134 -17.573 3.586 -13.016 1137 HB2 HIS 134 2HB HIS 134 -15.578 2.657 -11.877 1138 HB3 HIS 134 3HB HIS 134 -15.056 1.881 -13.370 1139 HD1 HIS 134 HD1 HIS 134 -13.311 3.167 -14.566 1140 HD2 HIS 134 HD2 HIS 134 -15.748 5.661 -12.309 1141 HE1 HIS 134 HE1 HIS 134 -12.361 5.474 -14.851 1142 HE2 HIS 134 HE2 HIS 134 -13.919 6.970 -13.571 1143 H HIS 135 H HIS 135 -18.100 4.616 -14.853 1144 HA HIS 135 HA HIS 135 -17.772 3.341 -17.459 1145 HB2 HIS 135 2HB HIS 135 -19.855 4.634 -16.842 1146 HB3 HIS 135 3HB HIS 135 -18.893 6.109 -16.827 1147 HD1 HIS 135 HD1 HIS 135 -18.574 7.271 -19.059 1148 HD2 HIS 135 HD2 HIS 135 -20.061 3.412 -19.485 1149 HE1 HIS 135 HE1 HIS 135 -19.190 7.044 -21.481 1150 HE2 HIS 135 HE2 HIS 135 -20.242 4.770 -21.671 1151 H HIS 136 H HIS 136 -16.448 4.140 -19.123 1152 HA HIS 136 HA HIS 136 -14.017 5.392 -18.432 1153 HB2 HIS 136 2HB HIS 136 -13.536 5.447 -20.877 1154 HB3 HIS 136 3HB HIS 136 -14.113 3.878 -20.331 1155 HD1 HIS 136 HD1 HIS 136 -14.952 6.689 -22.610 1156 HD2 HIS 136 HD2 HIS 136 -16.704 3.163 -21.289 1157 HE1 HIS 136 HE1 HIS 136 -16.884 6.275 -24.153 1158 HE2 HIS 136 HE2 HIS 136 -17.802 4.046 -23.448 Start of MODEL 6 1 H1 MET 1 1H MET 1 -0.389 -16.451 -1.410 2 H2 MET 1 2H MET 1 -1.948 -17.060 -1.181 3 H3 MET 1 3H MET 1 -1.033 -16.568 0.148 4 HA MET 1 HA MET 1 -2.015 -14.820 -2.025 5 HB2 MET 1 2HB MET 1 -2.933 -15.050 0.881 6 HB3 MET 1 3HB MET 1 -3.473 -13.806 -0.245 7 HG2 MET 1 2HG MET 1 -5.153 -15.557 -0.035 8 HG3 MET 1 3HG MET 1 -4.488 -15.542 -1.671 9 HE1 MET 1 3HE MET 1 -6.161 -18.047 -0.599 10 HE2 MET 1 1HE MET 1 -5.150 -19.371 -1.169 11 HE3 MET 1 2HE MET 1 -5.424 -17.969 -2.201 12 H GLY 2 H GLY 2 -0.248 -13.586 -2.404 13 HA2 GLY 2 2HA GLY 2 1.169 -12.301 -0.131 14 HA3 GLY 2 3HA GLY 2 1.802 -12.516 -1.759 15 H THR 3 H THR 3 -1.396 -11.378 -0.800 16 HA THR 3 HA THR 3 -1.337 -9.178 -2.614 17 HB THR 3 HB THR 3 -3.558 -8.587 -1.455 18 HG1 THR 3 HG1 THR 3 -3.076 -9.652 0.552 19 HG21 THR 3 3HG2 THR 3 -4.776 -10.508 -2.430 20 HG22 THR 3 1HG2 THR 3 -3.260 -11.406 -2.565 21 HG23 THR 3 2HG2 THR 3 -3.509 -9.940 -3.517 22 H VAL 4 H VAL 4 -0.046 -7.512 -2.243 23 HA VAL 4 HA VAL 4 0.291 -6.385 0.483 24 HB VAL 4 HB VAL 4 2.113 -5.980 -1.959 25 HG11 VAL 4 1HG1 VAL 4 3.719 -5.013 -0.345 26 HG12 VAL 4 2HG1 VAL 4 2.555 -5.238 0.963 27 HG13 VAL 4 3HG1 VAL 4 2.200 -4.115 -0.349 28 HG21 VAL 4 3HG2 VAL 4 2.231 -8.328 -1.240 29 HG22 VAL 4 1HG2 VAL 4 2.576 -7.825 0.416 30 HG23 VAL 4 2HG2 VAL 4 3.740 -7.491 -0.871 31 H VAL 5 H VAL 5 -1.035 -4.665 0.701 32 HA VAL 5 HA VAL 5 -1.635 -2.981 -1.657 33 HB VAL 5 HB VAL 5 -3.764 -2.331 -0.434 34 HG11 VAL 5 1HG1 VAL 5 -3.480 -5.279 -1.149 35 HG12 VAL 5 2HG1 VAL 5 -3.790 -3.960 -2.280 36 HG13 VAL 5 3HG1 VAL 5 -5.002 -4.381 -1.068 37 HG21 VAL 5 3HG2 VAL 5 -3.101 -4.698 1.365 38 HG22 VAL 5 1HG2 VAL 5 -4.640 -3.827 1.338 39 HG23 VAL 5 2HG2 VAL 5 -3.169 -3.007 1.864 40 H ILE 6 H ILE 6 -0.527 -1.156 -1.614 41 HA ILE 6 HA ILE 6 0.572 -0.146 0.929 42 HB ILE 6 HB ILE 6 1.414 0.629 -1.906 43 HG12 ILE 6 2HG1 ILE 6 3.586 -0.723 -1.214 44 HG13 ILE 6 3HG1 ILE 6 2.520 -1.544 -0.084 45 HG21 ILE 6 1HG2 ILE 6 3.415 1.592 -0.789 46 HG22 ILE 6 2HG2 ILE 6 2.724 1.183 0.780 47 HG23 ILE 6 3HG2 ILE 6 1.918 2.359 -0.257 48 HD11 ILE 6 3HD1 ILE 6 2.831 -2.809 -2.134 49 HD12 ILE 6 1HD1 ILE 6 2.200 -1.466 -3.088 50 HD13 ILE 6 2HD1 ILE 6 1.146 -2.320 -1.957 51 H VAL 7 H VAL 7 -0.793 1.333 1.804 52 HA VAL 7 HA VAL 7 -2.379 3.117 0.144 53 HB VAL 7 HB VAL 7 -2.193 3.022 3.190 54 HG11 VAL 7 1HG1 VAL 7 -4.230 4.389 1.374 55 HG12 VAL 7 2HG1 VAL 7 -3.021 5.194 2.378 56 HG13 VAL 7 3HG1 VAL 7 -4.331 4.290 3.136 57 HG21 VAL 7 3HG2 VAL 7 -4.241 1.744 1.342 58 HG22 VAL 7 1HG2 VAL 7 -4.308 1.760 3.107 59 HG23 VAL 7 2HG2 VAL 7 -3.013 0.892 2.281 60 H VAL 8 H VAL 8 -1.268 4.729 -0.735 61 HA VAL 8 HA VAL 8 0.661 6.280 0.881 62 HB VAL 8 HB VAL 8 0.354 6.129 -2.147 63 HG11 VAL 8 1HG1 VAL 8 2.371 7.521 -2.285 64 HG12 VAL 8 2HG1 VAL 8 2.395 7.675 -0.528 65 HG13 VAL 8 3HG1 VAL 8 1.066 8.371 -1.456 66 HG21 VAL 8 3HG2 VAL 8 2.551 5.010 -2.147 67 HG22 VAL 8 1HG2 VAL 8 1.358 4.085 -1.230 68 HG23 VAL 8 2HG2 VAL 8 2.571 5.046 -0.382 69 H SER 9 H SER 9 0.412 8.454 1.066 70 HA SER 9 HA SER 9 -1.652 9.938 -0.381 71 HB2 SER 9 2HB SER 9 -1.458 9.893 2.670 72 HB3 SER 9 3HB SER 9 -2.482 10.985 1.740 73 HG SER 9 HG SER 9 -2.949 8.441 1.014 74 H ASN 10 H ASN 10 -1.216 12.305 -0.182 75 HA ASN 10 HA ASN 10 1.613 12.951 0.345 76 HB2 ASN 10 2HB ASN 10 -0.642 14.691 -0.765 77 HB3 ASN 10 3HB ASN 10 1.029 15.211 -0.565 78 HD21 ASN 10 1HD2 ASN 10 1.156 15.647 -2.800 79 HD22 ASN 10 2HD2 ASN 10 1.304 14.383 -3.961 80 H ASP 11 H ASP 11 -1.349 12.960 1.940 81 HA ASP 11 HA ASP 11 -0.649 15.081 3.863 82 HB2 ASP 11 2HB ASP 11 -2.880 15.109 2.672 83 HB3 ASP 11 3HB ASP 11 -3.288 13.598 3.462 84 H GLU 12 H GLU 12 -0.773 14.647 6.090 85 HA GLU 12 HA GLU 12 0.399 12.105 6.856 86 HB2 GLU 12 2HB GLU 12 -0.237 14.562 8.560 87 HB3 GLU 12 3HB GLU 12 0.805 13.218 9.026 88 HG2 GLU 12 2HG GLU 12 2.413 13.824 7.275 89 HG3 GLU 12 3HG GLU 12 1.354 15.117 6.723 90 H ARG 13 H ARG 13 -2.448 14.015 7.699 91 HA ARG 13 HA ARG 13 -3.530 12.308 9.699 92 HB2 ARG 13 2HB ARG 13 -4.817 14.510 8.040 93 HB3 ARG 13 3HB ARG 13 -5.554 13.766 9.460 94 HG2 ARG 13 2HG ARG 13 -4.052 14.785 10.950 95 HG3 ARG 13 3HG ARG 13 -2.836 15.061 9.701 96 HD2 ARG 13 2HD ARG 13 -5.513 16.501 9.800 97 HD3 ARG 13 3HD ARG 13 -4.006 17.157 10.449 98 HE ARG 13 HE ARG 13 -4.507 16.552 7.580 99 HH11 ARG 13 1HH1 ARG 13 -2.828 18.461 10.024 100 HH12 ARG 13 2HH1 ARG 13 -2.052 19.481 8.855 101 HH21 ARG 13 1HH2 ARG 13 -3.462 17.889 6.069 102 HH22 ARG 13 2HH2 ARG 13 -2.413 19.157 6.621 103 H ILE 14 H ILE 14 -3.893 12.437 6.211 104 HA ILE 14 HA ILE 14 -6.288 10.916 6.019 105 HB ILE 14 HB ILE 14 -4.066 11.383 3.977 106 HG12 ILE 14 2HG1 ILE 14 -5.290 13.422 4.549 107 HG13 ILE 14 3HG1 ILE 14 -5.760 12.924 2.931 108 HG21 ILE 14 1HG2 ILE 14 -5.624 10.552 2.231 109 HG22 ILE 14 2HG2 ILE 14 -6.760 10.051 3.488 110 HG23 ILE 14 3HG2 ILE 14 -5.176 9.280 3.372 111 HD11 ILE 14 3HD1 ILE 14 -7.856 11.992 3.861 112 HD12 ILE 14 1HD1 ILE 14 -7.672 13.722 4.153 113 HD13 ILE 14 2HD1 ILE 14 -7.381 12.577 5.459 114 H LEU 15 H LEU 15 -2.826 9.970 6.046 115 HA LEU 15 HA LEU 15 -3.205 7.179 5.753 116 HB2 LEU 15 2HB LEU 15 -1.032 8.714 7.225 117 HB3 LEU 15 3HB LEU 15 -0.988 6.971 6.988 118 HG LEU 15 HG LEU 15 -0.922 9.062 4.777 119 HD11 LEU 15 1HD1 LEU 15 1.384 8.328 4.438 120 HD12 LEU 15 2HD1 LEU 15 1.256 7.215 5.802 121 HD13 LEU 15 3HD1 LEU 15 1.157 8.958 6.067 122 HD21 LEU 15 3HD2 LEU 15 -2.090 7.050 3.993 123 HD22 LEU 15 1HD2 LEU 15 -0.772 6.024 4.574 124 HD23 LEU 15 2HD2 LEU 15 -0.499 7.158 3.245 125 H GLU 16 H GLU 16 -3.346 9.296 8.571 126 HA GLU 16 HA GLU 16 -3.379 7.265 10.573 127 HB2 GLU 16 2HB GLU 16 -4.285 10.184 10.735 128 HB3 GLU 16 3HB GLU 16 -4.009 9.114 12.115 129 HG2 GLU 16 2HG GLU 16 -1.630 8.879 11.436 130 HG3 GLU 16 3HG GLU 16 -1.919 10.002 10.108 131 H GLU 17 H GLU 17 -5.942 9.221 9.077 132 HA GLU 17 HA GLU 17 -8.121 8.019 10.493 133 HB2 GLU 17 2HB GLU 17 -8.218 10.307 9.556 134 HB3 GLU 17 3HB GLU 17 -8.113 9.672 7.917 135 HG2 GLU 17 2HG GLU 17 -10.281 8.668 8.077 136 HG3 GLU 17 3HG GLU 17 -10.370 8.959 9.813 137 H LEU 18 H LEU 18 -6.494 7.315 7.441 138 HA LEU 18 HA LEU 18 -8.367 5.270 6.628 139 HB2 LEU 18 2HB LEU 18 -5.768 6.315 5.559 140 HB3 LEU 18 3HB LEU 18 -6.260 4.707 5.059 141 HG LEU 18 HG LEU 18 -8.290 5.556 4.015 142 HD11 LEU 18 1HD1 LEU 18 -8.912 7.337 5.585 143 HD12 LEU 18 2HD1 LEU 18 -8.909 7.921 3.924 144 HD13 LEU 18 3HD1 LEU 18 -7.575 8.333 5.005 145 HD21 LEU 18 3HD2 LEU 18 -5.870 7.220 3.253 146 HD22 LEU 18 1HD2 LEU 18 -7.306 6.994 2.253 147 HD23 LEU 18 2HD2 LEU 18 -6.284 5.614 2.645 148 H LEU 19 H LEU 19 -5.479 5.341 8.643 149 HA LEU 19 HA LEU 19 -4.774 2.612 8.593 150 HB2 LEU 19 2HB LEU 19 -3.329 4.281 9.718 151 HB3 LEU 19 3HB LEU 19 -4.557 4.528 10.947 152 HG LEU 19 HG LEU 19 -4.271 1.968 11.461 153 HD11 LEU 19 1HD1 LEU 19 -2.085 1.000 10.978 154 HD12 LEU 19 2HD1 LEU 19 -1.659 2.407 9.999 155 HD13 LEU 19 3HD1 LEU 19 -2.981 1.347 9.499 156 HD21 LEU 19 3HD2 LEU 19 -3.591 3.714 13.026 157 HD22 LEU 19 1HD2 LEU 19 -2.025 3.848 12.223 158 HD23 LEU 19 2HD2 LEU 19 -2.477 2.350 13.049 159 H GLU 20 H GLU 20 -6.907 4.416 10.766 160 HA GLU 20 HA GLU 20 -7.720 2.262 12.364 161 HB2 GLU 20 2HB GLU 20 -9.529 3.740 13.146 162 HB3 GLU 20 3HB GLU 20 -7.983 4.580 13.089 163 HG2 GLU 20 2HG GLU 20 -8.628 5.675 10.995 164 HG3 GLU 20 3HG GLU 20 -10.165 4.810 11.002 165 H VAL 21 H VAL 21 -8.934 3.420 9.247 166 HA VAL 21 HA VAL 21 -11.415 2.071 9.172 167 HB VAL 21 HB VAL 21 -9.527 2.747 6.862 168 HG11 VAL 21 1HG1 VAL 21 -11.504 2.544 5.373 169 HG12 VAL 21 2HG1 VAL 21 -12.461 1.944 6.728 170 HG13 VAL 21 3HG1 VAL 21 -11.093 1.003 6.133 171 HG21 VAL 21 3HG2 VAL 21 -10.965 4.716 6.526 172 HG22 VAL 21 1HG2 VAL 21 -10.265 4.709 8.143 173 HG23 VAL 21 2HG2 VAL 21 -11.951 4.248 7.915 174 H VAL 22 H VAL 22 -8.222 1.079 7.908 175 HA VAL 22 HA VAL 22 -8.927 -1.542 7.104 176 HB VAL 22 HB VAL 22 -6.185 -0.453 7.919 177 HG11 VAL 22 1HG1 VAL 22 -5.244 -2.294 6.550 178 HG12 VAL 22 2HG1 VAL 22 -6.867 -2.932 6.285 179 HG13 VAL 22 3HG1 VAL 22 -6.184 -2.909 7.912 180 HG21 VAL 22 3HG2 VAL 22 -7.193 0.861 6.084 181 HG22 VAL 22 1HG2 VAL 22 -7.470 -0.614 5.152 182 HG23 VAL 22 2HG2 VAL 22 -5.821 -0.075 5.488 183 H LEU 23 H LEU 23 -7.499 -0.238 10.038 184 HA LEU 23 HA LEU 23 -6.795 -2.642 11.321 185 HB2 LEU 23 2HB LEU 23 -5.846 -0.328 11.689 186 HB3 LEU 23 3HB LEU 23 -7.308 0.078 12.571 187 HG LEU 23 HG LEU 23 -6.726 -1.766 14.197 188 HD11 LEU 23 1HD1 LEU 23 -4.071 -1.811 12.768 189 HD12 LEU 23 2HD1 LEU 23 -5.259 -3.120 12.793 190 HD13 LEU 23 3HD1 LEU 23 -4.451 -2.637 14.283 191 HD21 LEU 23 3HD2 LEU 23 -6.268 0.587 14.710 192 HD22 LEU 23 1HD2 LEU 23 -4.696 0.456 13.918 193 HD23 LEU 23 2HD2 LEU 23 -5.024 -0.456 15.393 194 H LYS 24 H LYS 24 -9.733 -0.632 11.496 195 HA LYS 24 HA LYS 24 -10.870 -2.107 13.730 196 HB2 LYS 24 2HB LYS 24 -12.696 -0.579 13.695 197 HB3 LYS 24 3HB LYS 24 -11.277 0.385 13.308 198 HG2 LYS 24 2HG LYS 24 -11.948 0.164 10.851 199 HG3 LYS 24 3HG LYS 24 -13.472 -0.526 11.412 200 HD2 LYS 24 2HD LYS 24 -12.418 2.253 12.093 201 HD3 LYS 24 3HD LYS 24 -13.674 1.896 10.908 202 HE2 LYS 24 2HE LYS 24 -15.157 1.083 12.674 203 HE3 LYS 24 3HE LYS 24 -13.886 1.302 13.880 204 HZ1 LYS 24 3HZ LYS 24 -13.945 3.658 13.526 205 HZ2 LYS 24 1HZ LYS 24 -15.518 3.128 13.844 206 HZ3 LYS 24 2HZ LYS 24 -15.055 3.506 12.264 207 H SER 25 H SER 25 -11.164 -2.075 10.222 208 HA SER 25 HA SER 25 -13.510 -3.675 10.011 209 HB2 SER 25 2HB SER 25 -11.267 -3.132 8.029 210 HB3 SER 25 3HB SER 25 -12.748 -3.992 7.623 211 HG SER 25 HG SER 25 -12.326 -1.367 7.705 212 H ASP 26 H ASP 26 -10.059 -4.412 10.225 213 HA ASP 26 HA ASP 26 -10.656 -6.942 11.426 214 HB2 ASP 26 2HB ASP 26 -10.690 -7.572 8.981 215 HB3 ASP 26 3HB ASP 26 -9.017 -7.040 8.847 216 HA PRO 27 HA PRO 27 -6.939 -5.182 13.347 217 HB2 PRO 27 2HB PRO 27 -6.948 -6.653 15.624 218 HB3 PRO 27 3HB PRO 27 -8.203 -5.430 15.314 219 HG2 PRO 27 2HG PRO 27 -8.350 -8.410 14.882 220 HG3 PRO 27 3HG PRO 27 -9.511 -7.344 15.715 221 HD2 PRO 27 2HD PRO 27 -9.853 -8.110 13.126 222 HD3 PRO 27 3HD PRO 27 -10.393 -6.523 13.722 223 H ASN 28 H ASN 28 -7.334 -8.419 12.220 224 HA ASN 28 HA ASN 28 -4.760 -9.431 13.158 225 HB2 ASN 28 2HB ASN 28 -6.866 -10.798 13.196 226 HB3 ASN 28 3HB ASN 28 -6.912 -10.738 11.437 227 HD21 ASN 28 1HD2 ASN 28 -6.736 -12.896 11.119 228 HD22 ASN 28 2HD2 ASN 28 -5.348 -13.834 11.529 229 H VAL 29 H VAL 29 -6.072 -7.926 10.313 230 HA VAL 29 HA VAL 29 -4.138 -8.728 8.384 231 HB VAL 29 HB VAL 29 -5.831 -6.181 8.573 232 HG11 VAL 29 1HG1 VAL 29 -5.260 -5.748 6.195 233 HG12 VAL 29 2HG1 VAL 29 -4.109 -7.087 6.228 234 HG13 VAL 29 3HG1 VAL 29 -3.834 -5.662 7.232 235 HG21 VAL 29 3HG2 VAL 29 -7.173 -7.239 6.778 236 HG22 VAL 29 1HG2 VAL 29 -7.118 -8.255 8.221 237 HG23 VAL 29 2HG2 VAL 29 -6.120 -8.656 6.822 238 H LYS 30 H LYS 30 -2.138 -7.883 7.880 239 HA LYS 30 HA LYS 30 -0.623 -6.780 10.049 240 HB2 LYS 30 2HB LYS 30 0.242 -8.575 8.569 241 HB3 LYS 30 3HB LYS 30 0.168 -7.492 7.188 242 HG2 LYS 30 2HG LYS 30 2.474 -7.779 7.994 243 HG3 LYS 30 3HG LYS 30 1.947 -6.102 8.137 244 HD2 LYS 30 2HD LYS 30 3.182 -6.697 10.130 245 HD3 LYS 30 3HD LYS 30 1.484 -6.495 10.563 246 HE2 LYS 30 2HE LYS 30 1.313 -9.073 10.286 247 HE3 LYS 30 3HE LYS 30 3.079 -9.056 10.329 248 HZ1 LYS 30 3HZ LYS 30 2.971 -7.976 12.490 249 HZ2 LYS 30 1HZ LYS 30 2.129 -9.438 12.517 250 HZ3 LYS 30 2HZ LYS 30 1.284 -7.979 12.439 251 H THR 31 H THR 31 -1.613 -4.711 10.304 252 HA THR 31 HA THR 31 -1.403 -2.645 8.269 253 HB THR 31 HB THR 31 -2.279 -1.144 10.096 254 HG1 THR 31 HG1 THR 31 -1.652 -1.950 11.987 255 HG21 THR 31 3HG2 THR 31 -3.872 -3.712 9.720 256 HG22 THR 31 1HG2 THR 31 -3.943 -2.275 8.693 257 HG23 THR 31 2HG2 THR 31 -4.524 -2.198 10.364 258 H VAL 32 H VAL 32 0.605 -1.891 7.843 259 HA VAL 32 HA VAL 32 2.474 -1.259 10.067 260 HB VAL 32 HB VAL 32 3.167 -2.434 7.320 261 HG11 VAL 32 1HG1 VAL 32 5.090 -1.580 9.520 262 HG12 VAL 32 2HG1 VAL 32 4.879 -0.789 7.956 263 HG13 VAL 32 3HG1 VAL 32 5.530 -2.426 8.032 264 HG21 VAL 32 3HG2 VAL 32 2.337 -4.129 8.900 265 HG22 VAL 32 1HG2 VAL 32 3.545 -3.635 10.090 266 HG23 VAL 32 2HG2 VAL 32 4.053 -4.370 8.567 267 H ARG 33 H ARG 33 2.426 0.960 10.180 268 HA ARG 33 HA ARG 33 3.006 2.489 7.702 269 HB2 ARG 33 2HB ARG 33 1.119 3.429 8.949 270 HB3 ARG 33 3HB ARG 33 2.059 3.479 10.436 271 HG2 ARG 33 2HG ARG 33 3.308 5.342 9.756 272 HG3 ARG 33 3HG ARG 33 3.071 5.010 8.040 273 HD2 ARG 33 2HD ARG 33 1.853 7.025 8.775 274 HD3 ARG 33 3HD ARG 33 0.763 5.779 8.164 275 HE ARG 33 HE ARG 33 1.191 6.361 11.044 276 HH11 ARG 33 1HH1 ARG 33 -0.924 5.409 8.421 277 HH12 ARG 33 2HH1 ARG 33 -2.331 5.301 9.418 278 HH21 ARG 33 1HH2 ARG 33 -0.666 6.252 12.365 279 HH22 ARG 33 2HH2 ARG 33 -2.185 5.781 11.671 280 H THR 34 H THR 34 5.137 2.348 7.392 281 HA THR 34 HA THR 34 7.022 3.004 9.528 282 HB THR 34 HB THR 34 6.932 0.300 8.116 283 HG1 THR 34 HG1 THR 34 6.411 1.253 10.687 284 HG21 THR 34 3HG2 THR 34 9.005 -0.290 9.334 285 HG22 THR 34 1HG2 THR 34 9.157 1.378 9.890 286 HG23 THR 34 2HG2 THR 34 9.292 1.004 8.171 287 H ASP 35 H ASP 35 8.490 4.298 8.738 288 HA ASP 35 HA ASP 35 8.800 4.814 5.906 289 HB2 ASP 35 2HB ASP 35 10.219 6.679 6.617 290 HB3 ASP 35 3HB ASP 35 8.732 6.674 7.555 291 H ASP 36 H ASP 36 10.368 2.851 8.262 292 HA ASP 36 HA ASP 36 13.009 2.755 7.238 293 HB2 ASP 36 2HB ASP 36 11.470 0.621 8.782 294 HB3 ASP 36 3HB ASP 36 13.204 0.590 8.477 295 H LYS 37 H LYS 37 13.336 2.306 5.189 296 HA LYS 37 HA LYS 37 11.217 1.485 3.515 297 HB2 LYS 37 2HB LYS 37 12.633 2.264 1.745 298 HB3 LYS 37 3HB LYS 37 12.943 3.295 3.117 299 HG2 LYS 37 2HG LYS 37 15.111 2.998 2.445 300 HG3 LYS 37 3HG LYS 37 14.979 1.569 3.475 301 HD2 LYS 37 2HD LYS 37 15.977 0.872 1.389 302 HD3 LYS 37 3HD LYS 37 14.331 0.237 1.439 303 HE2 LYS 37 2HE LYS 37 14.831 1.093 -0.782 304 HE3 LYS 37 3HE LYS 37 13.587 2.093 -0.033 305 HZ1 LYS 37 3HZ LYS 37 15.329 3.698 0.520 306 HZ2 LYS 37 1HZ LYS 37 15.215 3.432 -1.146 307 HZ3 LYS 37 2HZ LYS 37 16.470 2.729 -0.262 308 H GLU 38 H GLU 38 14.251 -0.039 4.404 309 HA GLU 38 HA GLU 38 13.890 -2.427 2.853 310 HB2 GLU 38 2HB GLU 38 15.925 -3.228 3.891 311 HB3 GLU 38 3HB GLU 38 16.140 -1.542 3.458 312 HG2 GLU 38 2HG GLU 38 15.656 -2.631 6.244 313 HG3 GLU 38 3HG GLU 38 17.187 -2.042 5.606 314 H LYS 39 H LYS 39 13.007 -1.374 6.080 315 HA LYS 39 HA LYS 39 12.532 -3.967 7.184 316 HB2 LYS 39 2HB LYS 39 12.902 -1.936 8.585 317 HB3 LYS 39 3HB LYS 39 11.327 -1.326 8.088 318 HG2 LYS 39 2HG LYS 39 10.232 -3.278 9.148 319 HG3 LYS 39 3HG LYS 39 11.814 -3.910 9.619 320 HD2 LYS 39 2HD LYS 39 12.171 -1.896 11.038 321 HD3 LYS 39 3HD LYS 39 10.568 -1.307 10.583 322 HE2 LYS 39 2HE LYS 39 9.543 -3.305 11.614 323 HE3 LYS 39 3HE LYS 39 11.145 -3.896 12.064 324 HZ1 LYS 39 3HZ LYS 39 9.925 -1.364 13.012 325 HZ2 LYS 39 1HZ LYS 39 11.439 -1.967 13.462 326 HZ3 LYS 39 2HZ LYS 39 10.034 -2.796 13.896 327 H VAL 40 H VAL 40 10.525 -1.657 5.400 328 HA VAL 40 HA VAL 40 8.010 -2.818 5.620 329 HB VAL 40 HB VAL 40 9.254 -1.631 3.084 330 HG11 VAL 40 1HG1 VAL 40 6.914 -1.179 2.376 331 HG12 VAL 40 2HG1 VAL 40 6.329 -2.077 3.774 332 HG13 VAL 40 3HG1 VAL 40 7.249 -2.907 2.519 333 HG21 VAL 40 3HG2 VAL 40 7.595 -0.268 5.249 334 HG22 VAL 40 1HG2 VAL 40 8.152 0.487 3.751 335 HG23 VAL 40 2HG2 VAL 40 9.321 -0.037 4.964 336 H LYS 41 H LYS 41 10.768 -3.828 3.666 337 HA LYS 41 HA LYS 41 9.523 -5.978 2.246 338 HB2 LYS 41 2HB LYS 41 12.465 -5.492 2.873 339 HB3 LYS 41 3HB LYS 41 11.845 -6.626 1.669 340 HG2 LYS 41 2HG LYS 41 10.901 -4.779 0.371 341 HG3 LYS 41 3HG LYS 41 11.446 -3.617 1.589 342 HD2 LYS 41 2HD LYS 41 13.791 -4.200 1.126 343 HD3 LYS 41 3HD LYS 41 13.279 -5.427 -0.037 344 HE2 LYS 41 2HE LYS 41 12.279 -3.643 -1.446 345 HE3 LYS 41 3HE LYS 41 12.848 -2.432 -0.291 346 HZ1 LYS 41 3HZ LYS 41 15.113 -3.063 -0.764 347 HZ2 LYS 41 1HZ LYS 41 14.326 -2.673 -2.205 348 HZ3 LYS 41 2HZ LYS 41 14.609 -4.290 -1.806 349 H GLU 42 H GLU 42 11.347 -5.739 5.280 350 HA GLU 42 HA GLU 42 11.485 -8.518 5.891 351 HB2 GLU 42 2HB GLU 42 11.508 -6.137 7.810 352 HB3 GLU 42 3HB GLU 42 12.018 -7.779 8.203 353 HG2 GLU 42 2HG GLU 42 13.843 -7.595 6.528 354 HG3 GLU 42 3HG GLU 42 13.351 -5.939 6.184 355 H GLU 43 H GLU 43 9.060 -6.013 6.485 356 HA GLU 43 HA GLU 43 7.381 -7.594 8.197 357 HB2 GLU 43 2HB GLU 43 6.805 -4.987 6.723 358 HB3 GLU 43 3HB GLU 43 5.741 -5.719 7.923 359 HG2 GLU 43 2HG GLU 43 8.531 -4.644 8.401 360 HG3 GLU 43 3HG GLU 43 7.023 -3.903 8.919 361 H ILE 44 H ILE 44 7.534 -6.872 4.752 362 HA ILE 44 HA ILE 44 5.250 -8.161 3.793 363 HB ILE 44 HB ILE 44 7.963 -7.518 2.670 364 HG12 ILE 44 2HG1 ILE 44 5.109 -7.073 1.706 365 HG13 ILE 44 3HG1 ILE 44 6.219 -5.875 2.365 366 HG21 ILE 44 1HG2 ILE 44 7.682 -8.753 0.562 367 HG22 ILE 44 2HG2 ILE 44 6.262 -9.559 1.224 368 HG23 ILE 44 3HG2 ILE 44 7.846 -9.844 1.939 369 HD11 ILE 44 3HD1 ILE 44 7.648 -6.170 0.362 370 HD12 ILE 44 1HD1 ILE 44 6.027 -5.581 -0.002 371 HD13 ILE 44 2HD1 ILE 44 6.436 -7.271 -0.302 372 H GLU 45 H GLU 45 8.454 -9.450 4.580 373 HA GLU 45 HA GLU 45 8.196 -12.110 3.825 374 HB2 GLU 45 2HB GLU 45 10.272 -10.758 4.597 375 HB3 GLU 45 3HB GLU 45 9.789 -11.139 6.239 376 HG2 GLU 45 2HG GLU 45 10.545 -13.130 4.088 377 HG3 GLU 45 3HG GLU 45 11.581 -12.613 5.409 378 H LYS 46 H LYS 46 7.473 -10.518 6.913 379 HA LYS 46 HA LYS 46 6.702 -12.763 8.434 380 HB2 LYS 46 2HB LYS 46 5.479 -9.998 8.831 381 HB3 LYS 46 3HB LYS 46 5.814 -11.224 10.048 382 HG2 LYS 46 2HG LYS 46 7.878 -9.626 8.535 383 HG3 LYS 46 3HG LYS 46 7.340 -9.291 10.174 384 HD2 LYS 46 2HD LYS 46 8.369 -11.326 11.001 385 HD3 LYS 46 3HD LYS 46 8.704 -11.893 9.359 386 HE2 LYS 46 2HE LYS 46 10.710 -10.930 10.572 387 HE3 LYS 46 3HE LYS 46 10.365 -10.176 9.017 388 HZ1 LYS 46 3HZ LYS 46 10.908 -8.579 10.796 389 HZ2 LYS 46 1HZ LYS 46 9.525 -9.063 11.643 390 HZ3 LYS 46 2HZ LYS 46 9.375 -8.313 10.134 391 H ALA 47 H ALA 47 4.777 -10.432 6.558 392 HA ALA 47 HA ALA 47 2.215 -11.294 7.334 393 HB1 ALA 47 3HB ALA 47 1.398 -9.899 5.488 394 HB2 ALA 47 1HB ALA 47 3.034 -9.813 4.816 395 HB3 ALA 47 2HB ALA 47 2.681 -9.078 6.379 396 H ARG 48 H ARG 48 3.983 -11.934 4.271 397 HA ARG 48 HA ARG 48 2.006 -13.574 3.106 398 HB2 ARG 48 2HB ARG 48 3.758 -14.221 1.458 399 HB3 ARG 48 3HB ARG 48 3.679 -12.490 1.721 400 HG2 ARG 48 2HG ARG 48 5.973 -12.847 1.624 401 HG3 ARG 48 3HG ARG 48 5.682 -12.868 3.359 402 HD2 ARG 48 2HD ARG 48 5.671 -15.376 3.270 403 HD3 ARG 48 3HD ARG 48 6.087 -15.290 1.561 404 HE ARG 48 HE ARG 48 7.804 -14.577 3.852 405 HH11 ARG 48 1HH1 ARG 48 7.515 -15.063 0.375 406 HH12 ARG 48 2HH1 ARG 48 9.234 -15.068 0.128 407 HH21 ARG 48 1HH2 ARG 48 10.024 -14.609 3.490 408 HH22 ARG 48 2HH2 ARG 48 10.643 -14.809 1.878 409 H LYS 49 H LYS 49 4.607 -14.299 5.324 410 HA LYS 49 HA LYS 49 4.558 -17.166 4.958 411 HB2 LYS 49 2HB LYS 49 6.611 -15.844 5.586 412 HB3 LYS 49 3HB LYS 49 5.891 -15.531 7.163 413 HG2 LYS 49 2HG LYS 49 5.963 -17.893 7.725 414 HG3 LYS 49 3HG LYS 49 6.485 -18.310 6.089 415 HD2 LYS 49 2HD LYS 49 8.589 -16.971 6.494 416 HD3 LYS 49 3HD LYS 49 8.070 -16.750 8.168 417 HE2 LYS 49 2HE LYS 49 8.154 -19.164 8.544 418 HE3 LYS 49 3HE LYS 49 8.554 -19.442 6.848 419 HZ1 LYS 49 3HZ LYS 49 10.622 -18.253 7.174 420 HZ2 LYS 49 1HZ LYS 49 10.502 -19.547 8.251 421 HZ3 LYS 49 2HZ LYS 49 10.244 -17.968 8.794 422 H GLN 50 H GLN 50 3.067 -14.822 7.112 423 HA GLN 50 HA GLN 50 1.884 -16.888 8.829 424 HB2 GLN 50 2HB GLN 50 1.578 -13.852 8.935 425 HB3 GLN 50 3HB GLN 50 0.946 -14.985 10.125 426 HG2 GLN 50 2HG GLN 50 3.861 -14.411 9.536 427 HG3 GLN 50 3HG GLN 50 2.965 -13.923 10.970 428 HE21 GLN 50 1HE2 GLN 50 5.432 -15.512 10.717 429 HE22 GLN 50 2HE2 GLN 50 5.118 -17.017 11.506 430 H GLY 51 H GLY 51 1.223 -15.884 5.807 431 HA2 GLY 51 2HA GLY 51 -0.578 -16.181 4.414 432 HA3 GLY 51 3HA GLY 51 -1.386 -17.001 5.741 433 H ARG 52 H ARG 52 -0.266 -13.651 5.540 434 HA ARG 52 HA ARG 52 -3.015 -12.677 6.045 435 HB2 ARG 52 2HB ARG 52 -0.405 -11.917 7.433 436 HB3 ARG 52 3HB ARG 52 -1.850 -10.912 7.536 437 HG2 ARG 52 2HG ARG 52 -3.074 -12.651 8.668 438 HG3 ARG 52 3HG ARG 52 -1.777 -13.818 8.415 439 HD2 ARG 52 2HD ARG 52 -0.349 -12.693 9.981 440 HD3 ARG 52 3HD ARG 52 -1.406 -11.283 10.035 441 HE ARG 52 HE ARG 52 -2.691 -12.314 11.600 442 HH11 ARG 52 1HH1 ARG 52 -0.768 -14.860 10.108 443 HH12 ARG 52 2HH1 ARG 52 -1.278 -16.064 11.245 444 HH21 ARG 52 1HH2 ARG 52 -3.326 -13.891 13.065 445 HH22 ARG 52 2HH2 ARG 52 -2.727 -15.514 12.916 446 HA PRO 53 HA PRO 53 -1.940 -9.609 2.816 447 HB2 PRO 53 2HB PRO 53 -4.262 -8.045 3.855 448 HB3 PRO 53 3HB PRO 53 -4.024 -8.759 2.247 449 HG2 PRO 53 2HG PRO 53 -5.837 -9.760 3.972 450 HG3 PRO 53 3HG PRO 53 -4.931 -10.806 2.855 451 HD2 PRO 53 2HD PRO 53 -4.427 -10.305 5.791 452 HD3 PRO 53 3HD PRO 53 -4.412 -11.840 4.886 453 H ILE 54 H ILE 54 -0.849 -7.606 2.886 454 HA ILE 54 HA ILE 54 -0.470 -6.370 5.557 455 HB ILE 54 HB ILE 54 1.525 -7.614 5.065 456 HG12 ILE 54 2HG1 ILE 54 2.105 -4.674 4.513 457 HG13 ILE 54 3HG1 ILE 54 1.803 -5.355 6.108 458 HG21 ILE 54 1HG2 ILE 54 2.932 -7.294 3.073 459 HG22 ILE 54 2HG2 ILE 54 1.736 -6.182 2.404 460 HG23 ILE 54 3HG2 ILE 54 1.321 -7.881 2.638 461 HD11 ILE 54 3HD1 ILE 54 3.814 -6.753 5.862 462 HD12 ILE 54 1HD1 ILE 54 4.153 -5.025 5.773 463 HD13 ILE 54 2HD1 ILE 54 4.126 -5.991 4.298 464 H VAL 55 H VAL 55 -0.699 -4.235 5.679 465 HA VAL 55 HA VAL 55 -1.289 -2.708 3.222 466 HB VAL 55 HB VAL 55 -2.513 -2.129 5.961 467 HG11 VAL 55 1HG1 VAL 55 -3.360 -1.322 3.148 468 HG12 VAL 55 2HG1 VAL 55 -2.558 -0.279 4.326 469 HG13 VAL 55 3HG1 VAL 55 -4.186 -0.881 4.647 470 HG21 VAL 55 3HG2 VAL 55 -4.565 -3.299 5.203 471 HG22 VAL 55 1HG2 VAL 55 -3.198 -4.403 5.360 472 HG23 VAL 55 2HG2 VAL 55 -3.715 -3.860 3.766 473 H ILE 56 H ILE 56 0.361 -1.341 2.847 474 HA ILE 56 HA ILE 56 2.041 -0.384 5.074 475 HB ILE 56 HB ILE 56 2.574 -0.410 2.065 476 HG12 ILE 56 2HG1 ILE 56 2.604 -2.673 3.066 477 HG13 ILE 56 3HG1 ILE 56 4.229 -2.188 2.599 478 HG21 ILE 56 1HG2 ILE 56 3.763 1.485 3.077 479 HG22 ILE 56 2HG2 ILE 56 4.912 0.224 2.633 480 HG23 ILE 56 3HG2 ILE 56 4.444 0.431 4.321 481 HD11 ILE 56 3HD1 ILE 56 4.285 -3.312 4.723 482 HD12 ILE 56 1HD1 ILE 56 3.096 -2.200 5.399 483 HD13 ILE 56 2HD1 ILE 56 4.706 -1.618 4.964 484 H PHE 57 H PHE 57 1.416 1.529 5.876 485 HA PHE 57 HA PHE 57 0.294 3.629 4.158 486 HB2 PHE 57 2HB PHE 57 0.588 3.379 7.180 487 HB3 PHE 57 3HB PHE 57 0.010 4.845 6.396 488 HD1 PHE 57 HD2 PHE 57 -0.755 1.240 6.972 489 HD2 PHE 57 HD1 PHE 57 -2.238 5.024 5.637 490 HE1 PHE 57 HE2 PHE 57 -3.043 0.335 6.903 491 HE2 PHE 57 HE1 PHE 57 -4.509 4.108 5.581 492 HZ PHE 57 HZ PHE 57 -4.905 1.778 6.191 493 H ILE 58 H ILE 58 1.757 4.821 3.119 494 HA ILE 58 HA ILE 58 3.943 6.105 4.611 495 HB ILE 58 HB ILE 58 5.433 5.854 2.503 496 HG12 ILE 58 2HG1 ILE 58 3.559 3.501 1.978 497 HG13 ILE 58 3HG1 ILE 58 3.737 4.932 0.964 498 HG21 ILE 58 1HG2 ILE 58 5.958 4.779 4.658 499 HG22 ILE 58 2HG2 ILE 58 6.417 3.739 3.311 500 HG23 ILE 58 3HG2 ILE 58 4.951 3.392 4.232 501 HD11 ILE 58 3HD1 ILE 58 4.923 3.046 0.031 502 HD12 ILE 58 1HD1 ILE 58 5.871 2.868 1.504 503 HD13 ILE 58 2HD1 ILE 58 6.060 4.309 0.498 504 H ARG 59 H ARG 59 4.920 7.937 3.191 505 HA ARG 59 HA ARG 59 2.704 9.407 1.886 506 HB2 ARG 59 2HB ARG 59 2.692 9.780 4.386 507 HB3 ARG 59 3HB ARG 59 4.319 10.421 4.278 508 HG2 ARG 59 2HG ARG 59 3.377 12.206 2.714 509 HG3 ARG 59 3HG ARG 59 1.770 11.611 3.147 510 HD2 ARG 59 2HD ARG 59 2.339 13.538 4.525 511 HD3 ARG 59 3HD ARG 59 2.255 12.092 5.538 512 HE ARG 59 HE ARG 59 4.777 13.331 4.584 513 HH11 ARG 59 1HH1 ARG 59 3.042 11.629 7.147 514 HH12 ARG 59 2HH1 ARG 59 4.409 11.633 8.215 515 HH21 ARG 59 1HH2 ARG 59 6.538 13.314 6.009 516 HH22 ARG 59 2HH2 ARG 59 6.377 12.581 7.573 517 H GLY 60 H GLY 60 3.500 10.328 0.072 518 HA2 GLY 60 2HA GLY 60 4.686 11.689 -1.321 519 HA3 GLY 60 3HA GLY 60 5.142 12.537 0.138 520 H ALA 61 H ALA 61 7.105 11.813 1.236 521 HA ALA 61 HA ALA 61 9.323 11.498 -0.567 522 HB1 ALA 61 3HB ALA 61 9.436 12.929 1.427 523 HB2 ALA 61 1HB ALA 61 10.688 11.689 1.489 524 HB3 ALA 61 2HB ALA 61 9.225 11.526 2.475 525 H TYR 62 H TYR 62 7.675 9.455 1.759 526 HA TYR 62 HA TYR 62 9.422 7.183 1.563 527 HB2 TYR 62 2HB TYR 62 6.573 7.200 2.625 528 HB3 TYR 62 3HB TYR 62 7.877 6.099 3.056 529 HD1 TYR 62 HD2 TYR 62 10.123 7.896 3.716 530 HD2 TYR 62 HD1 TYR 62 5.954 8.346 4.572 531 HE1 TYR 62 HE2 TYR 62 10.660 9.318 5.647 532 HE2 TYR 62 HE1 TYR 62 6.502 9.768 6.499 533 HH TYR 62 HH TYR 62 9.550 11.085 7.006 534 H GLU 63 H GLU 63 6.613 8.319 -0.095 535 HA GLU 63 HA GLU 63 5.418 6.104 -1.224 536 HB2 GLU 63 2HB GLU 63 4.216 7.993 -1.650 537 HB3 GLU 63 3HB GLU 63 5.623 9.008 -1.749 538 HG2 GLU 63 2HG GLU 63 4.717 9.266 -3.839 539 HG3 GLU 63 3HG GLU 63 5.923 8.029 -4.141 540 H GLU 64 H GLU 64 8.390 7.732 -2.356 541 HA GLU 64 HA GLU 64 8.520 6.392 -4.842 542 HB2 GLU 64 2HB GLU 64 10.901 7.153 -4.951 543 HB3 GLU 64 3HB GLU 64 9.725 8.417 -4.643 544 HG2 GLU 64 2HG GLU 64 11.488 8.977 -3.243 545 HG3 GLU 64 3HG GLU 64 10.343 8.181 -2.170 546 H VAL 65 H VAL 65 9.468 5.355 -1.648 547 HA VAL 65 HA VAL 65 11.255 3.286 -2.233 548 HB VAL 65 HB VAL 65 9.211 3.250 0.041 549 HG11 VAL 65 1HG1 VAL 65 10.782 1.760 1.187 550 HG12 VAL 65 2HG1 VAL 65 11.852 1.794 -0.216 551 HG13 VAL 65 3HG1 VAL 65 10.255 1.064 -0.346 552 HG21 VAL 65 3HG2 VAL 65 12.042 4.354 0.082 553 HG22 VAL 65 1HG2 VAL 65 10.950 4.240 1.472 554 HG23 VAL 65 2HG2 VAL 65 10.565 5.316 0.123 555 H VAL 66 H VAL 66 7.747 3.363 -2.724 556 HA VAL 66 HA VAL 66 6.982 0.725 -2.360 557 HB VAL 66 HB VAL 66 5.889 2.579 -4.539 558 HG11 VAL 66 1HG1 VAL 66 3.814 1.206 -4.425 559 HG12 VAL 66 2HG1 VAL 66 4.605 0.103 -3.295 560 HG13 VAL 66 3HG1 VAL 66 5.199 0.245 -4.950 561 HG21 VAL 66 3HG2 VAL 66 4.895 2.150 -1.701 562 HG22 VAL 66 1HG2 VAL 66 4.140 3.185 -2.919 563 HG23 VAL 66 2HG2 VAL 66 5.740 3.580 -2.290 564 H ARG 67 H ARG 67 8.399 2.169 -5.301 565 HA ARG 67 HA ARG 67 7.979 -0.118 -6.952 566 HB2 ARG 67 2HB ARG 67 8.282 2.320 -7.720 567 HB3 ARG 67 3HB ARG 67 10.015 2.067 -7.515 568 HG2 ARG 67 2HG ARG 67 9.963 0.238 -9.163 569 HG3 ARG 67 3HG ARG 67 8.213 0.422 -9.326 570 HD2 ARG 67 2HD ARG 67 9.229 1.503 -11.197 571 HD3 ARG 67 3HD ARG 67 8.604 2.765 -10.140 572 HE ARG 67 HE ARG 67 10.944 3.043 -9.340 573 HH11 ARG 67 1HH1 ARG 67 10.385 1.699 -12.556 574 HH12 ARG 67 2HH1 ARG 67 11.933 2.215 -13.155 575 HH21 ARG 67 1HH2 ARG 67 12.970 3.670 -10.146 576 HH22 ARG 67 2HH2 ARG 67 13.389 3.326 -11.797 577 H ASP 68 H ASP 68 10.609 0.894 -4.872 578 HA ASP 68 HA ASP 68 12.549 -1.068 -5.707 579 HB2 ASP 68 2HB ASP 68 13.289 0.999 -4.627 580 HB3 ASP 68 3HB ASP 68 12.324 0.656 -3.196 581 H ILE 69 H ILE 69 9.993 -0.906 -3.300 582 HA ILE 69 HA ILE 69 10.443 -3.367 -1.934 583 HB ILE 69 HB ILE 69 7.845 -1.803 -2.336 584 HG12 ILE 69 2HG1 ILE 69 9.670 -1.753 0.109 585 HG13 ILE 69 3HG1 ILE 69 9.748 -0.556 -1.179 586 HG21 ILE 69 1HG2 ILE 69 7.355 -4.106 -1.647 587 HG22 ILE 69 2HG2 ILE 69 6.985 -2.981 -0.342 588 HG23 ILE 69 3HG2 ILE 69 8.456 -3.953 -0.277 589 HD11 ILE 69 3HD1 ILE 69 8.469 0.233 0.739 590 HD12 ILE 69 1HD1 ILE 69 7.330 -1.098 0.538 591 HD13 ILE 69 2HD1 ILE 69 7.475 0.140 -0.711 592 H VAL 70 H VAL 70 8.647 -2.443 -4.844 593 HA VAL 70 HA VAL 70 7.124 -4.683 -5.417 594 HB VAL 70 HB VAL 70 8.518 -2.747 -7.328 595 HG11 VAL 70 1HG1 VAL 70 6.403 -4.815 -8.035 596 HG12 VAL 70 2HG1 VAL 70 8.093 -4.848 -8.544 597 HG13 VAL 70 3HG1 VAL 70 7.026 -3.567 -9.116 598 HG21 VAL 70 3HG2 VAL 70 6.802 -1.732 -5.883 599 HG22 VAL 70 1HG2 VAL 70 5.623 -2.917 -6.428 600 HG23 VAL 70 2HG2 VAL 70 6.273 -1.736 -7.562 601 H GLU 71 H GLU 71 10.494 -4.002 -6.383 602 HA GLU 71 HA GLU 71 11.031 -6.208 -7.981 603 HB2 GLU 71 2HB GLU 71 12.562 -4.291 -7.817 604 HB3 GLU 71 3HB GLU 71 12.930 -4.678 -6.139 605 HG2 GLU 71 2HG GLU 71 13.897 -6.868 -6.946 606 HG3 GLU 71 3HG GLU 71 13.656 -6.304 -8.598 607 H TYR 72 H TYR 72 11.595 -5.825 -4.494 608 HA TYR 72 HA TYR 72 12.596 -8.387 -3.900 609 HB2 TYR 72 2HB TYR 72 12.832 -6.481 -2.364 610 HB3 TYR 72 3HB TYR 72 11.090 -6.388 -2.150 611 HD1 TYR 72 HD1 TYR 72 14.127 -8.390 -1.326 612 HD2 TYR 72 HD2 TYR 72 9.950 -7.859 -0.563 613 HE1 TYR 72 HE1 TYR 72 14.284 -9.882 0.621 614 HE2 TYR 72 HE2 TYR 72 10.119 -9.346 1.386 615 HH TYR 72 HH TYR 72 11.630 -11.222 2.138 616 H ALA 73 H ALA 73 9.290 -7.100 -3.875 617 HA ALA 73 HA ALA 73 7.985 -9.340 -2.746 618 HB1 ALA 73 3HB ALA 73 5.914 -8.268 -3.525 619 HB2 ALA 73 1HB ALA 73 6.856 -7.165 -4.539 620 HB3 ALA 73 2HB ALA 73 6.996 -7.089 -2.782 621 H GLN 74 H GLN 74 8.775 -8.464 -6.089 622 HA GLN 74 HA GLN 74 7.301 -10.571 -7.347 623 HB2 GLN 74 2HB GLN 74 9.571 -8.815 -8.357 624 HB3 GLN 74 3HB GLN 74 8.783 -10.034 -9.356 625 HG2 GLN 74 2HG GLN 74 6.584 -8.797 -8.958 626 HG3 GLN 74 3HG GLN 74 7.541 -7.521 -8.201 627 HE21 GLN 74 1HE2 GLN 74 6.729 -6.094 -9.923 628 HE22 GLN 74 2HE2 GLN 74 7.474 -6.134 -11.483 629 H LYS 75 H LYS 75 10.579 -10.280 -6.012 630 HA LYS 75 HA LYS 75 11.583 -12.786 -7.005 631 HB2 LYS 75 2HB LYS 75 12.514 -11.337 -4.480 632 HB3 LYS 75 3HB LYS 75 13.414 -12.548 -5.389 633 HG2 LYS 75 2HG LYS 75 12.752 -9.722 -6.212 634 HG3 LYS 75 3HG LYS 75 14.347 -10.392 -5.892 635 HD2 LYS 75 2HD LYS 75 14.178 -11.785 -7.928 636 HD3 LYS 75 3HD LYS 75 12.539 -11.190 -8.216 637 HE2 LYS 75 2HE LYS 75 13.416 -8.905 -8.532 638 HE3 LYS 75 3HE LYS 75 15.057 -9.485 -8.231 639 HZ1 LYS 75 3HZ LYS 75 14.617 -9.284 -10.594 640 HZ2 LYS 75 1HZ LYS 75 13.302 -10.338 -10.472 641 HZ3 LYS 75 2HZ LYS 75 14.865 -10.904 -10.187 642 H GLU 76 H GLU 76 9.672 -11.802 -4.251 643 HA GLU 76 HA GLU 76 9.649 -14.414 -2.959 644 HB2 GLU 76 2HB GLU 76 8.078 -11.864 -2.358 645 HB3 GLU 76 3HB GLU 76 8.090 -13.306 -1.347 646 HG2 GLU 76 2HG GLU 76 10.582 -11.696 -1.971 647 HG3 GLU 76 3HG GLU 76 9.554 -11.377 -0.581 648 H GLY 77 H GLY 77 8.058 -13.081 -5.600 649 HA2 GLY 77 2HA GLY 77 6.435 -13.908 -6.986 650 HA3 GLY 77 3HA GLY 77 6.369 -15.344 -5.974 651 H LEU 78 H LEU 78 5.657 -11.914 -5.357 652 HA LEU 78 HA LEU 78 3.161 -12.664 -3.980 653 HB2 LEU 78 2HB LEU 78 4.816 -10.118 -3.821 654 HB3 LEU 78 3HB LEU 78 3.383 -10.462 -2.862 655 HG LEU 78 HG LEU 78 6.060 -11.899 -2.696 656 HD11 LEU 78 1HD1 LEU 78 4.636 -10.091 -0.729 657 HD12 LEU 78 2HD1 LEU 78 6.083 -9.702 -1.666 658 HD13 LEU 78 3HD1 LEU 78 6.148 -10.955 -0.429 659 HD21 LEU 78 3HD2 LEU 78 4.243 -13.514 -2.325 660 HD22 LEU 78 1HD2 LEU 78 3.544 -12.460 -1.095 661 HD23 LEU 78 2HD2 LEU 78 5.127 -13.195 -0.834 662 H ARG 79 H ARG 79 2.026 -10.090 -3.979 663 HA ARG 79 HA ARG 79 1.244 -9.547 -6.769 664 HB2 ARG 79 2HB ARG 79 -0.256 -11.271 -5.436 665 HB3 ARG 79 3HB ARG 79 -0.780 -9.886 -4.490 666 HG2 ARG 79 2HG ARG 79 -1.104 -10.124 -7.496 667 HG3 ARG 79 3HG ARG 79 -2.331 -10.594 -6.325 668 HD2 ARG 79 2HD ARG 79 -2.469 -8.251 -5.532 669 HD3 ARG 79 3HD ARG 79 -1.236 -7.786 -6.715 670 HE ARG 79 HE ARG 79 -3.509 -9.129 -7.859 671 HH11 ARG 79 1HH1 ARG 79 -2.279 -5.967 -6.914 672 HH12 ARG 79 2HH1 ARG 79 -3.339 -5.129 -8.001 673 HH21 ARG 79 1HH2 ARG 79 -4.845 -8.006 -9.260 674 HH22 ARG 79 2HH2 ARG 79 -4.789 -6.289 -9.329 675 H VAL 80 H VAL 80 1.589 -7.311 -6.979 676 HA VAL 80 HA VAL 80 1.726 -5.726 -4.484 677 HB VAL 80 HB VAL 80 3.085 -4.991 -7.126 678 HG11 VAL 80 1HG1 VAL 80 4.405 -3.464 -5.690 679 HG12 VAL 80 2HG1 VAL 80 3.492 -3.988 -4.278 680 HG13 VAL 80 3HG1 VAL 80 2.679 -3.115 -5.578 681 HG21 VAL 80 3HG2 VAL 80 4.031 -7.136 -6.340 682 HG22 VAL 80 1HG2 VAL 80 4.346 -6.429 -4.754 683 HG23 VAL 80 2HG2 VAL 80 5.205 -5.830 -6.177 684 H LEU 81 H LEU 81 0.257 -4.218 -4.221 685 HA LEU 81 HA LEU 81 -1.088 -2.909 -6.493 686 HB2 LEU 81 2HB LEU 81 -2.506 -4.793 -5.660 687 HB3 LEU 81 3HB LEU 81 -2.443 -4.112 -4.050 688 HG LEU 81 HG LEU 81 -3.686 -2.100 -4.867 689 HD11 LEU 81 1HD1 LEU 81 -4.771 -2.147 -7.058 690 HD12 LEU 81 2HD1 LEU 81 -3.886 -3.626 -7.452 691 HD13 LEU 81 3HD1 LEU 81 -3.012 -2.119 -7.179 692 HD21 LEU 81 3HD2 LEU 81 -4.917 -3.941 -3.823 693 HD22 LEU 81 1HD2 LEU 81 -5.077 -4.741 -5.389 694 HD23 LEU 81 2HD2 LEU 81 -5.881 -3.193 -5.095 695 H VAL 82 H VAL 82 -0.417 -0.812 -6.179 696 HA VAL 82 HA VAL 82 -0.238 0.226 -3.416 697 HB VAL 82 HB VAL 82 1.747 0.706 -4.709 698 HG11 VAL 82 1HG1 VAL 82 1.783 2.033 -6.780 699 HG12 VAL 82 2HG1 VAL 82 0.018 2.058 -6.797 700 HG13 VAL 82 3HG1 VAL 82 0.878 0.531 -6.983 701 HG21 VAL 82 3HG2 VAL 82 1.895 3.163 -4.524 702 HG22 VAL 82 1HG2 VAL 82 1.020 2.484 -3.147 703 HG23 VAL 82 2HG2 VAL 82 0.135 3.278 -4.452 704 H ILE 83 H ILE 83 -2.024 1.078 -2.613 705 HA ILE 83 HA ILE 83 -4.094 2.305 -4.322 706 HB ILE 83 HB ILE 83 -4.218 1.608 -1.337 707 HG12 ILE 83 2HG1 ILE 83 -5.276 -0.038 -3.692 708 HG13 ILE 83 3HG1 ILE 83 -3.865 -0.450 -2.726 709 HG21 ILE 83 1HG2 ILE 83 -6.458 2.262 -3.298 710 HG22 ILE 83 2HG2 ILE 83 -5.860 3.325 -2.023 711 HG23 ILE 83 3HG2 ILE 83 -6.672 1.817 -1.602 712 HD11 ILE 83 3HD1 ILE 83 -5.808 -1.758 -2.104 713 HD12 ILE 83 1HD1 ILE 83 -6.700 -0.285 -1.712 714 HD13 ILE 83 2HD1 ILE 83 -5.275 -0.739 -0.767 715 H LYS 84 H LYS 84 -3.633 4.470 -4.616 716 HA LYS 84 HA LYS 84 -2.834 6.108 -2.306 717 HB2 LYS 84 2HB LYS 84 -1.054 7.193 -3.573 718 HB3 LYS 84 3HB LYS 84 -0.760 5.470 -3.378 719 HG2 LYS 84 2HG LYS 84 -1.505 5.106 -5.727 720 HG3 LYS 84 3HG LYS 84 -1.692 6.859 -5.907 721 HD2 LYS 84 2HD LYS 84 0.743 7.097 -5.234 722 HD3 LYS 84 3HD LYS 84 0.871 5.337 -5.306 723 HE2 LYS 84 2HE LYS 84 0.291 5.392 -7.693 724 HE3 LYS 84 3HE LYS 84 0.120 7.153 -7.609 725 HZ1 LYS 84 3HZ LYS 84 2.623 5.644 -7.027 726 HZ2 LYS 84 1HZ LYS 84 2.452 7.326 -6.984 727 HZ3 LYS 84 2HZ LYS 84 2.312 6.495 -8.451 728 H VAL 85 H VAL 85 -3.459 8.168 -2.324 729 HA VAL 85 HA VAL 85 -5.614 8.882 -4.136 730 HB VAL 85 HB VAL 85 -4.504 10.484 -1.774 731 HG11 VAL 85 1HG1 VAL 85 -7.256 10.555 -3.053 732 HG12 VAL 85 2HG1 VAL 85 -5.990 11.770 -3.245 733 HG13 VAL 85 3HG1 VAL 85 -6.731 11.516 -1.664 734 HG21 VAL 85 3HG2 VAL 85 -5.095 8.230 -0.978 735 HG22 VAL 85 1HG2 VAL 85 -6.712 8.393 -1.672 736 HG23 VAL 85 2HG2 VAL 85 -6.212 9.436 -0.336 737 H ALA 86 H ALA 86 -5.175 9.947 -5.990 738 HA ALA 86 HA ALA 86 -2.622 11.126 -6.554 739 HB1 ALA 86 3HB ALA 86 -3.886 9.939 -8.296 740 HB2 ALA 86 1HB ALA 86 -3.549 11.605 -8.773 741 HB3 ALA 86 2HB ALA 86 -5.160 11.155 -8.210 742 H GLN 87 H GLN 87 -2.366 12.793 -5.113 743 HA GLN 87 HA GLN 87 -4.281 14.920 -4.771 744 HB2 GLN 87 2HB GLN 87 -1.433 14.514 -3.807 745 HB3 GLN 87 3HB GLN 87 -2.406 15.917 -3.368 746 HG2 GLN 87 2HG GLN 87 -3.064 13.027 -2.723 747 HG3 GLN 87 3HG GLN 87 -2.400 14.210 -1.596 748 HE21 GLN 87 1HE2 GLN 87 -3.764 15.900 -0.845 749 HE22 GLN 87 2HE2 GLN 87 -5.484 15.798 -0.977 750 H ASP 88 H ASP 88 -0.927 14.813 -6.065 751 HA ASP 88 HA ASP 88 -0.872 17.495 -7.012 752 HB2 ASP 88 2HB ASP 88 0.823 15.236 -8.156 753 HB3 ASP 88 3HB ASP 88 1.228 16.947 -8.058 754 H GLN 89 H GLN 89 -2.124 14.557 -8.314 755 HA GLN 89 HA GLN 89 -2.728 13.711 -10.286 756 HB2 GLN 89 2HB GLN 89 -3.145 16.599 -11.161 757 HB3 GLN 89 3HB GLN 89 -3.771 15.175 -11.990 758 HG2 GLN 89 2HG GLN 89 -5.185 14.650 -10.032 759 HG3 GLN 89 3HG GLN 89 -4.536 16.062 -9.191 760 HE21 GLN 89 1HE2 GLN 89 -5.116 18.157 -9.936 761 HE22 GLN 89 2HE2 GLN 89 -6.503 18.405 -10.938 762 H GLU 90 H GLU 90 -1.264 16.634 -11.753 763 HA GLU 90 HA GLU 90 -0.023 15.215 -13.820 764 HB2 GLU 90 2HB GLU 90 -0.625 17.633 -13.918 765 HB3 GLU 90 3HB GLU 90 0.670 18.001 -12.782 766 HG2 GLU 90 2HG GLU 90 2.316 17.121 -14.466 767 HG3 GLU 90 3HG GLU 90 0.984 16.921 -15.603 768 H LEU 91 H LEU 91 1.511 16.641 -10.897 769 HA LEU 91 HA LEU 91 4.150 15.720 -11.460 770 HB2 LEU 91 2HB LEU 91 3.739 17.604 -9.953 771 HB3 LEU 91 3HB LEU 91 2.859 16.572 -8.848 772 HG LEU 91 HG LEU 91 4.996 15.325 -8.369 773 HD11 LEU 91 1HD1 LEU 91 7.149 16.300 -9.034 774 HD12 LEU 91 2HD1 LEU 91 6.311 17.486 -10.040 775 HD13 LEU 91 3HD1 LEU 91 6.212 15.765 -10.430 776 HD21 LEU 91 3HD2 LEU 91 5.088 18.308 -7.799 777 HD22 LEU 91 1HD2 LEU 91 5.993 17.060 -6.934 778 HD23 LEU 91 2HD2 LEU 91 4.233 17.090 -6.849 779 H LEU 92 H LEU 92 1.427 14.323 -9.678 780 HA LEU 92 HA LEU 92 2.913 12.144 -8.536 781 HB2 LEU 92 2HB LEU 92 0.855 13.157 -7.534 782 HB3 LEU 92 3HB LEU 92 -0.105 12.463 -8.821 783 HG LEU 92 HG LEU 92 1.537 10.539 -7.167 784 HD11 LEU 92 1HD1 LEU 92 -0.141 10.416 -5.368 785 HD12 LEU 92 2HD1 LEU 92 -0.979 11.816 -6.040 786 HD13 LEU 92 3HD1 LEU 92 0.658 11.988 -5.405 787 HD21 LEU 92 3HD2 LEU 92 -1.299 10.379 -8.252 788 HD22 LEU 92 1HD2 LEU 92 -0.422 9.071 -7.451 789 HD23 LEU 92 2HD2 LEU 92 0.139 9.686 -9.005 790 H GLU 93 H GLU 93 1.282 12.707 -11.587 791 HA GLU 93 HA GLU 93 0.760 10.080 -12.462 792 HB2 GLU 93 2HB GLU 93 1.357 12.619 -14.027 793 HB3 GLU 93 3HB GLU 93 0.953 11.102 -14.815 794 HG2 GLU 93 2HG GLU 93 -0.818 12.686 -12.955 795 HG3 GLU 93 3HG GLU 93 -0.985 12.552 -14.698 796 H ARG 94 H ARG 94 3.714 11.898 -12.319 797 HA ARG 94 HA ARG 94 5.315 10.525 -14.152 798 HB2 ARG 94 2HB ARG 94 6.003 12.638 -13.146 799 HB3 ARG 94 3HB ARG 94 6.020 11.923 -11.539 800 HG2 ARG 94 2HG ARG 94 8.296 12.211 -12.384 801 HG3 ARG 94 3HG ARG 94 7.926 10.499 -12.172 802 HD2 ARG 94 2HD ARG 94 7.441 10.374 -14.648 803 HD3 ARG 94 3HD ARG 94 8.017 12.040 -14.791 804 HE ARG 94 HE ARG 94 10.171 11.150 -13.808 805 HH11 ARG 94 1HH1 ARG 94 8.079 9.100 -15.769 806 HH12 ARG 94 2HH1 ARG 94 9.381 8.078 -16.297 807 HH21 ARG 94 1HH2 ARG 94 11.856 9.806 -14.502 808 HH22 ARG 94 2HH2 ARG 94 11.526 8.482 -15.575 809 H PHE 95 H PHE 95 4.925 9.940 -10.626 810 HA PHE 95 HA PHE 95 6.448 7.476 -10.743 811 HB2 PHE 95 2HB PHE 95 6.453 9.062 -8.744 812 HB3 PHE 95 3HB PHE 95 4.821 8.509 -8.377 813 HD1 PHE 95 HD2 PHE 95 8.301 7.200 -8.961 814 HD2 PHE 95 HD1 PHE 95 4.562 6.599 -6.959 815 HE1 PHE 95 HE2 PHE 95 9.261 5.301 -7.727 816 HE2 PHE 95 HE1 PHE 95 5.534 4.697 -5.736 817 HZ PHE 95 HZ PHE 95 7.882 4.049 -6.113 818 H TYR 96 H TYR 96 3.076 8.413 -10.683 819 HA TYR 96 HA TYR 96 1.796 6.029 -9.986 820 HB2 TYR 96 2HB TYR 96 0.481 7.999 -10.034 821 HB3 TYR 96 3HB TYR 96 0.997 8.420 -11.658 822 HD1 TYR 96 HD1 TYR 96 -0.944 5.728 -9.873 823 HD2 TYR 96 HD2 TYR 96 -0.523 8.081 -13.408 824 HE1 TYR 96 HE1 TYR 96 -3.038 4.797 -10.752 825 HE2 TYR 96 HE2 TYR 96 -2.614 7.141 -14.289 826 HH TYR 96 HH TYR 96 -4.816 5.458 -12.416 827 H GLU 97 H GLU 97 2.575 7.275 -13.227 828 HA GLU 97 HA GLU 97 1.656 5.013 -14.684 829 HB2 GLU 97 2HB GLU 97 1.791 7.262 -15.671 830 HB3 GLU 97 3HB GLU 97 3.548 7.264 -15.495 831 HG2 GLU 97 2HG GLU 97 3.707 5.377 -17.069 832 HG3 GLU 97 3HG GLU 97 1.951 5.345 -17.226 833 H GLN 98 H GLN 98 4.715 5.914 -13.249 834 HA GLN 98 HA GLN 98 6.530 4.448 -14.747 835 HB2 GLN 98 2HB GLN 98 7.163 6.181 -13.101 836 HB3 GLN 98 3HB GLN 98 6.638 5.142 -11.782 837 HG2 GLN 98 2HG GLN 98 9.088 5.166 -12.016 838 HG3 GLN 98 3HG GLN 98 8.424 3.553 -12.273 839 HE21 GLN 98 1HE2 GLN 98 8.532 2.633 -14.337 840 HE22 GLN 98 2HE2 GLN 98 9.528 3.284 -15.589 841 H LEU 99 H LEU 99 4.792 3.460 -11.775 842 HA LEU 99 HA LEU 99 5.900 0.853 -11.585 843 HB2 LEU 99 2HB LEU 99 3.412 2.112 -10.388 844 HB3 LEU 99 3HB LEU 99 3.762 0.407 -10.148 845 HG LEU 99 HG LEU 99 5.957 1.036 -9.097 846 HD11 LEU 99 1HD1 LEU 99 6.293 3.203 -10.130 847 HD12 LEU 99 2HD1 LEU 99 6.320 3.346 -8.375 848 HD13 LEU 99 3HD1 LEU 99 4.889 3.855 -9.281 849 HD21 LEU 99 3HD2 LEU 99 4.005 0.517 -7.708 850 HD22 LEU 99 1HD2 LEU 99 3.503 2.209 -7.754 851 HD23 LEU 99 2HD2 LEU 99 5.010 1.752 -6.952 852 H LYS 100 H LYS 100 3.121 2.122 -13.321 853 HA LYS 100 HA LYS 100 1.899 -0.384 -13.949 854 HB2 LYS 100 2HB LYS 100 1.635 2.230 -15.500 855 HB3 LYS 100 3HB LYS 100 0.519 0.867 -15.527 856 HG2 LYS 100 2HG LYS 100 0.152 1.313 -13.025 857 HG3 LYS 100 3HG LYS 100 1.010 2.835 -13.266 858 HD2 LYS 100 2HD LYS 100 -1.518 2.021 -14.765 859 HD3 LYS 100 3HD LYS 100 -1.497 3.015 -13.317 860 HE2 LYS 100 2HE LYS 100 -1.751 4.481 -15.169 861 HE3 LYS 100 3HE LYS 100 -0.110 4.691 -14.574 862 HZ1 LYS 100 3HZ LYS 100 -0.267 4.626 -17.007 863 HZ2 LYS 100 1HZ LYS 100 -0.863 3.048 -16.932 864 HZ3 LYS 100 2HZ LYS 100 0.708 3.384 -16.407 865 H LYS 101 H LYS 101 4.376 1.607 -15.466 866 HA LYS 101 HA LYS 101 4.674 0.067 -17.864 867 HB2 LYS 101 2HB LYS 101 6.283 2.253 -16.521 868 HB3 LYS 101 3HB LYS 101 7.035 1.325 -17.814 869 HG2 LYS 101 2HG LYS 101 5.158 1.964 -19.329 870 HG3 LYS 101 3HG LYS 101 4.487 2.969 -18.043 871 HD2 LYS 101 2HD LYS 101 6.332 4.491 -18.132 872 HD3 LYS 101 3HD LYS 101 7.314 3.369 -19.077 873 HE2 LYS 101 2HE LYS 101 6.524 5.194 -20.489 874 HE3 LYS 101 3HE LYS 101 5.800 3.676 -21.009 875 HZ1 LYS 101 3HZ LYS 101 3.776 4.320 -19.812 876 HZ2 LYS 101 1HZ LYS 101 4.183 5.425 -21.027 877 HZ3 LYS 101 2HZ LYS 101 4.487 5.801 -19.409 878 H ASP 102 H ASP 102 6.192 -0.036 -14.652 879 HA ASP 102 HA ASP 102 8.098 -2.113 -15.280 880 HB2 ASP 102 2HB ASP 102 7.078 -1.018 -12.621 881 HB3 ASP 102 3HB ASP 102 8.276 -2.307 -12.718 882 H GLY 103 H GLY 103 4.749 -2.068 -14.415 883 HA2 GLY 103 2HA GLY 103 3.300 -3.892 -14.859 884 HA3 GLY 103 3HA GLY 103 4.613 -5.020 -14.540 885 H VAL 104 H VAL 104 2.905 -2.380 -12.875 886 HA VAL 104 HA VAL 104 2.333 -4.138 -10.563 887 HB VAL 104 HB VAL 104 3.150 -1.186 -10.371 888 HG11 VAL 104 1HG1 VAL 104 2.493 -3.150 -8.137 889 HG12 VAL 104 2HG1 VAL 104 1.479 -1.798 -8.655 890 HG13 VAL 104 3HG1 VAL 104 3.055 -1.487 -7.926 891 HG21 VAL 104 3HG2 VAL 104 5.166 -1.964 -9.218 892 HG22 VAL 104 1HG2 VAL 104 5.077 -2.657 -10.841 893 HG23 VAL 104 2HG2 VAL 104 4.664 -3.648 -9.433 894 H ASP 105 H ASP 105 0.263 -3.964 -9.836 895 HA ASP 105 HA ASP 105 -1.654 -2.462 -11.412 896 HB2 ASP 105 2HB ASP 105 -1.865 -4.899 -10.412 897 HB3 ASP 105 3HB ASP 105 -2.298 -4.083 -8.933 898 H VAL 106 H VAL 106 -2.975 -0.748 -10.534 899 HA VAL 106 HA VAL 106 -2.032 0.486 -8.025 900 HB VAL 106 HB VAL 106 -1.813 2.700 -9.113 901 HG11 VAL 106 1HG1 VAL 106 -0.090 0.650 -10.568 902 HG12 VAL 106 2HG1 VAL 106 0.249 1.350 -8.986 903 HG13 VAL 106 3HG1 VAL 106 0.255 2.377 -10.418 904 HG21 VAL 106 3HG2 VAL 106 -1.887 2.941 -11.584 905 HG22 VAL 106 1HG2 VAL 106 -3.438 2.413 -10.931 906 HG23 VAL 106 2HG2 VAL 106 -2.378 1.253 -11.733 907 H ARG 107 H ARG 107 -3.556 1.693 -7.001 908 HA ARG 107 HA ARG 107 -6.261 1.860 -8.182 909 HB2 ARG 107 2HB ARG 107 -5.469 0.258 -5.957 910 HB3 ARG 107 3HB ARG 107 -6.192 1.672 -5.223 911 HG2 ARG 107 2HG ARG 107 -8.008 0.306 -5.390 912 HG3 ARG 107 3HG ARG 107 -8.168 1.186 -6.903 913 HD2 ARG 107 2HD ARG 107 -6.976 -1.582 -6.557 914 HD3 ARG 107 3HD ARG 107 -8.591 -1.222 -7.172 915 HE ARG 107 HE ARG 107 -6.967 0.142 -8.870 916 HH11 ARG 107 1HH1 ARG 107 -7.040 -3.189 -7.797 917 HH12 ARG 107 2HH1 ARG 107 -6.379 -3.803 -9.277 918 HH21 ARG 107 1HH2 ARG 107 -6.044 -0.684 -10.805 919 HH22 ARG 107 2HH2 ARG 107 -5.817 -2.399 -10.973 920 H VAL 108 H VAL 108 -6.287 4.042 -8.673 921 HA VAL 108 HA VAL 108 -5.606 5.944 -6.514 922 HB VAL 108 HB VAL 108 -5.838 7.749 -8.308 923 HG11 VAL 108 1HG1 VAL 108 -3.662 6.997 -7.460 924 HG12 VAL 108 2HG1 VAL 108 -3.558 7.393 -9.175 925 HG13 VAL 108 3HG1 VAL 108 -3.612 5.703 -8.663 926 HG21 VAL 108 3HG2 VAL 108 -5.587 7.073 -10.686 927 HG22 VAL 108 1HG2 VAL 108 -7.104 6.480 -10.001 928 HG23 VAL 108 2HG2 VAL 108 -5.747 5.376 -10.223 929 H THR 109 H THR 109 -7.072 7.108 -5.572 930 HA THR 109 HA THR 109 -9.926 6.747 -6.280 931 HB THR 109 HB THR 109 -10.351 7.310 -3.893 932 HG1 THR 109 HG1 THR 109 -8.733 7.927 -2.575 933 HG21 THR 109 3HG2 THR 109 -9.385 5.278 -2.864 934 HG22 THR 109 1HG2 THR 109 -8.259 5.122 -4.213 935 HG23 THR 109 2HG2 THR 109 -9.992 4.928 -4.480 936 H ASP 110 H ASP 110 -7.310 8.965 -5.757 937 HA ASP 110 HA ASP 110 -6.960 11.161 -5.606 938 HB2 ASP 110 2HB ASP 110 -7.703 12.536 -7.467 939 HB3 ASP 110 3HB ASP 110 -7.267 10.939 -8.036 940 H ASN 111 H ASN 111 -9.231 10.101 -3.991 941 HA ASN 111 HA ASN 111 -10.216 12.617 -2.894 942 HB2 ASN 111 2HB ASN 111 -12.030 10.279 -3.662 943 HB3 ASN 111 3HB ASN 111 -12.520 11.583 -2.589 944 HD21 ASN 111 1HD2 ASN 111 -11.338 13.752 -4.092 945 HD22 ASN 111 2HD2 ASN 111 -12.269 13.912 -5.537 946 H GLU 112 H GLU 112 -10.746 12.387 -0.703 947 HA GLU 112 HA GLU 112 -8.923 10.611 0.649 948 HB2 GLU 112 2HB GLU 112 -10.874 12.512 2.024 949 HB3 GLU 112 3HB GLU 112 -9.345 11.892 2.631 950 HG2 GLU 112 2HG GLU 112 -8.870 14.127 2.102 951 HG3 GLU 112 3HG GLU 112 -8.226 13.226 0.732 952 H ASP 113 H ASP 113 -12.412 11.175 0.654 953 HA ASP 113 HA ASP 113 -13.071 9.090 2.508 954 HB2 ASP 113 2HB ASP 113 -14.839 10.753 0.658 955 HB3 ASP 113 3HB ASP 113 -15.449 9.657 1.901 956 H GLU 114 H GLU 114 -12.982 9.333 -1.022 957 HA GLU 114 HA GLU 114 -14.145 6.789 -1.544 958 HB2 GLU 114 2HB GLU 114 -12.374 8.621 -3.186 959 HB3 GLU 114 3HB GLU 114 -12.719 6.993 -3.759 960 HG2 GLU 114 2HG GLU 114 -14.779 9.127 -3.145 961 HG3 GLU 114 3HG GLU 114 -14.245 8.634 -4.748 962 H ALA 115 H ALA 115 -10.880 7.787 -0.648 963 HA ALA 115 HA ALA 115 -9.591 5.268 -1.160 964 HB1 ALA 115 3HB ALA 115 -8.320 7.369 -0.954 965 HB2 ALA 115 1HB ALA 115 -7.756 6.160 0.199 966 HB3 ALA 115 2HB ALA 115 -8.777 7.492 0.748 967 H LYS 116 H LYS 116 -10.820 6.828 1.788 968 HA LYS 116 HA LYS 116 -10.504 4.904 3.731 969 HB2 LYS 116 2HB LYS 116 -11.231 7.109 4.267 970 HB3 LYS 116 3HB LYS 116 -12.579 7.034 3.143 971 HG2 LYS 116 2HG LYS 116 -13.705 5.408 4.690 972 HG3 LYS 116 3HG LYS 116 -12.396 5.667 5.850 973 HD2 LYS 116 2HD LYS 116 -14.191 7.852 4.729 974 HD3 LYS 116 3HD LYS 116 -14.413 7.093 6.307 975 HE2 LYS 116 2HE LYS 116 -12.337 8.027 7.121 976 HE3 LYS 116 3HE LYS 116 -11.883 8.576 5.506 977 HZ1 LYS 116 3HZ LYS 116 -14.138 9.615 7.142 978 HZ2 LYS 116 1HZ LYS 116 -13.772 10.116 5.566 979 HZ3 LYS 116 2HZ LYS 116 -12.676 10.409 6.822 980 H LYS 117 H LYS 117 -13.309 5.366 1.626 981 HA LYS 117 HA LYS 117 -14.901 3.211 2.534 982 HB2 LYS 117 2HB LYS 117 -16.061 5.018 1.599 983 HB3 LYS 117 3HB LYS 117 -14.947 5.207 0.266 984 HG2 LYS 117 2HG LYS 117 -16.716 2.776 0.297 985 HG3 LYS 117 3HG LYS 117 -17.438 4.342 -0.080 986 HD2 LYS 117 2HD LYS 117 -15.421 4.528 -1.810 987 HD3 LYS 117 3HD LYS 117 -15.369 2.771 -1.635 988 HE2 LYS 117 2HE LYS 117 -16.733 3.345 -3.561 989 HE3 LYS 117 3HE LYS 117 -17.790 2.691 -2.306 990 HZ1 LYS 117 3HZ LYS 117 -18.761 4.644 -3.285 991 HZ2 LYS 117 1HZ LYS 117 -17.389 5.568 -2.946 992 HZ3 LYS 117 2HZ LYS 117 -18.352 4.983 -1.683 993 H ARG 118 H ARG 118 -12.620 3.554 -0.175 994 HA ARG 118 HA ARG 118 -13.331 1.042 -1.400 995 HB2 ARG 118 2HB ARG 118 -12.441 3.121 -2.594 996 HB3 ARG 118 3HB ARG 118 -10.841 2.681 -2.009 997 HG2 ARG 118 2HG ARG 118 -10.845 0.653 -3.318 998 HG3 ARG 118 3HG ARG 118 -12.559 0.839 -3.709 999 HD2 ARG 118 2HD ARG 118 -10.265 2.597 -4.654 1000 HD3 ARG 118 3HD ARG 118 -11.253 1.511 -5.641 1001 HE ARG 118 HE ARG 118 -13.035 3.272 -4.489 1002 HH11 ARG 118 1HH1 ARG 118 -10.282 3.648 -6.669 1003 HH12 ARG 118 2HH1 ARG 118 -10.913 5.088 -7.400 1004 HH21 ARG 118 1HH2 ARG 118 -13.792 5.205 -5.377 1005 HH22 ARG 118 2HH2 ARG 118 -12.909 5.976 -6.662 1006 H LEU 119 H LEU 119 -10.909 2.083 0.952 1007 HA LEU 119 HA LEU 119 -9.263 -0.235 0.894 1008 HB2 LEU 119 2HB LEU 119 -9.852 1.770 3.102 1009 HB3 LEU 119 3HB LEU 119 -8.782 0.399 3.366 1010 HG LEU 119 HG LEU 119 -8.333 2.658 1.379 1011 HD11 LEU 119 1HD1 LEU 119 -6.851 1.951 3.931 1012 HD12 LEU 119 2HD1 LEU 119 -7.943 3.321 3.704 1013 HD13 LEU 119 3HD1 LEU 119 -6.428 3.248 2.808 1014 HD21 LEU 119 3HD2 LEU 119 -6.592 0.230 1.926 1015 HD22 LEU 119 1HD2 LEU 119 -6.159 1.604 0.907 1016 HD23 LEU 119 2HD2 LEU 119 -7.495 0.554 0.444 1017 H LYS 120 H LYS 120 -12.076 0.642 2.860 1018 HA LYS 120 HA LYS 120 -12.343 -1.724 4.348 1019 HB2 LYS 120 2HB LYS 120 -13.498 0.394 4.887 1020 HB3 LYS 120 3HB LYS 120 -14.467 0.262 3.423 1021 HG2 LYS 120 2HG LYS 120 -15.542 -1.773 4.317 1022 HG3 LYS 120 3HG LYS 120 -14.558 -1.654 5.782 1023 HD2 LYS 120 2HD LYS 120 -15.639 0.485 6.357 1024 HD3 LYS 120 3HD LYS 120 -16.561 0.450 4.850 1025 HE2 LYS 120 2HE LYS 120 -17.772 -1.536 5.589 1026 HE3 LYS 120 3HE LYS 120 -16.786 -1.632 7.051 1027 HZ1 LYS 120 3HZ LYS 120 -18.952 -0.636 7.456 1028 HZ2 LYS 120 1HZ LYS 120 -18.612 0.607 6.367 1029 HZ3 LYS 120 2HZ LYS 120 -17.709 0.459 7.787 1030 H GLU 121 H GLU 121 -13.659 -0.787 1.189 1031 HA GLU 121 HA GLU 121 -15.315 -3.030 0.696 1032 HB2 GLU 121 2HB GLU 121 -15.279 -0.712 -0.437 1033 HB3 GLU 121 3HB GLU 121 -13.941 -1.296 -1.410 1034 HG2 GLU 121 2HG GLU 121 -16.704 -2.540 -1.360 1035 HG3 GLU 121 3HG GLU 121 -16.193 -1.335 -2.530 1036 H LEU 122 H LEU 122 -11.991 -2.265 -0.299 1037 HA LEU 122 HA LEU 122 -11.532 -4.648 -1.783 1038 HB2 LEU 122 2HB LEU 122 -9.622 -2.510 -0.781 1039 HB3 LEU 122 3HB LEU 122 -9.086 -3.896 -1.721 1040 HG LEU 122 HG LEU 122 -11.030 -1.758 -2.688 1041 HD11 LEU 122 1HD1 LEU 122 -8.742 -0.907 -2.536 1042 HD12 LEU 122 2HD1 LEU 122 -9.243 -1.066 -4.216 1043 HD13 LEU 122 3HD1 LEU 122 -8.149 -2.259 -3.506 1044 HD21 LEU 122 3HD2 LEU 122 -10.873 -2.845 -4.892 1045 HD22 LEU 122 1HD2 LEU 122 -11.583 -3.917 -3.685 1046 HD23 LEU 122 2HD2 LEU 122 -9.907 -4.145 -4.190 1047 H LEU 123 H LEU 123 -11.149 -3.859 1.616 1048 HA LEU 123 HA LEU 123 -9.295 -5.850 2.350 1049 HB2 LEU 123 2HB LEU 123 -11.125 -4.058 3.766 1050 HB3 LEU 123 3HB LEU 123 -11.109 -5.629 4.542 1051 HG LEU 123 HG LEU 123 -8.630 -5.476 4.797 1052 HD11 LEU 123 1HD1 LEU 123 -7.452 -3.343 4.422 1053 HD12 LEU 123 2HD1 LEU 123 -8.901 -2.673 3.669 1054 HD13 LEU 123 3HD1 LEU 123 -8.060 -4.027 2.913 1055 HD21 LEU 123 3HD2 LEU 123 -8.646 -3.760 6.576 1056 HD22 LEU 123 1HD2 LEU 123 -10.071 -4.798 6.633 1057 HD23 LEU 123 2HD2 LEU 123 -10.199 -3.163 5.975 1058 H GLU 124 H GLU 124 -12.809 -6.033 1.968 1059 HA GLU 124 HA GLU 124 -13.146 -8.781 2.684 1060 HB2 GLU 124 2HB GLU 124 -14.844 -7.022 0.850 1061 HB3 GLU 124 3HB GLU 124 -15.360 -8.543 1.573 1062 HG2 GLU 124 2HG GLU 124 -14.619 -6.049 3.131 1063 HG3 GLU 124 3HG GLU 124 -16.262 -6.528 2.719 1064 H LYS 125 H LYS 125 -11.984 -7.183 -0.101 1065 HA LYS 125 HA LYS 125 -12.308 -9.470 -1.939 1066 HB2 LYS 125 2HB LYS 125 -13.316 -7.243 -2.469 1067 HB3 LYS 125 3HB LYS 125 -11.722 -6.502 -2.400 1068 HG2 LYS 125 2HG LYS 125 -11.031 -7.774 -4.379 1069 HG3 LYS 125 3HG LYS 125 -12.602 -8.581 -4.432 1070 HD2 LYS 125 2HD LYS 125 -12.170 -5.581 -4.700 1071 HD3 LYS 125 3HD LYS 125 -12.420 -6.687 -6.046 1072 HE2 LYS 125 2HE LYS 125 -14.659 -7.249 -5.185 1073 HE3 LYS 125 3HE LYS 125 -14.407 -6.172 -3.809 1074 HZ1 LYS 125 3HZ LYS 125 -15.716 -5.099 -5.481 1075 HZ2 LYS 125 1HZ LYS 125 -14.539 -5.373 -6.665 1076 HZ3 LYS 125 2HZ LYS 125 -14.221 -4.320 -5.373 1077 H VAL 126 H VAL 126 -10.087 -8.625 0.231 1078 HA VAL 126 HA VAL 126 -7.872 -8.605 0.613 1079 HB VAL 126 HB VAL 126 -6.538 -10.461 -0.166 1080 HG11 VAL 126 1HG1 VAL 126 -8.018 -12.354 0.433 1081 HG12 VAL 126 2HG1 VAL 126 -9.428 -11.309 0.237 1082 HG13 VAL 126 3HG1 VAL 126 -8.240 -10.964 1.497 1083 HG21 VAL 126 3HG2 VAL 126 -6.987 -10.429 -2.586 1084 HG22 VAL 126 1HG2 VAL 126 -8.625 -11.027 -2.314 1085 HG23 VAL 126 2HG2 VAL 126 -7.235 -12.050 -1.932 1086 H GLY 127 H GLY 127 -8.769 -6.767 -1.518 1087 HA2 GLY 127 2HA GLY 127 -7.592 -4.980 -2.483 1088 HA3 GLY 127 3HA GLY 127 -6.157 -5.999 -2.622 1089 H SER 128 H SER 128 -5.720 -6.648 -4.628 1090 HA SER 128 HA SER 128 -5.833 -7.364 -6.766 1091 HB2 SER 128 2HB SER 128 -7.184 -9.195 -5.767 1092 HB3 SER 128 3HB SER 128 -8.646 -8.238 -6.000 1093 HG SER 128 HG SER 128 -8.738 -8.990 -7.946 1094 H LEU 129 H LEU 129 -7.378 -7.218 -8.889 1095 HA LEU 129 HA LEU 129 -8.671 -4.552 -8.983 1096 HB2 LEU 129 2HB LEU 129 -8.352 -4.600 -11.380 1097 HB3 LEU 129 3HB LEU 129 -6.830 -4.953 -10.596 1098 HG LEU 129 HG LEU 129 -7.733 -7.523 -11.089 1099 HD11 LEU 129 1HD1 LEU 129 -8.618 -7.650 -13.384 1100 HD12 LEU 129 2HD1 LEU 129 -8.743 -5.891 -13.443 1101 HD13 LEU 129 3HD1 LEU 129 -9.726 -6.807 -12.300 1102 HD21 LEU 129 3HD2 LEU 129 -6.098 -5.828 -13.024 1103 HD22 LEU 129 1HD2 LEU 129 -6.142 -7.594 -12.975 1104 HD23 LEU 129 2HD2 LEU 129 -5.472 -6.693 -11.618 1105 H GLU 130 H GLU 130 -10.815 -4.410 -9.576 1106 HA GLU 130 HA GLU 130 -12.413 -6.446 -10.700 1107 HB2 GLU 130 2HB GLU 130 -11.836 -7.315 -8.251 1108 HB3 GLU 130 3HB GLU 130 -13.045 -6.151 -7.734 1109 HG2 GLU 130 2HG GLU 130 -13.588 -8.330 -9.753 1110 HG3 GLU 130 3HG GLU 130 -13.787 -8.559 -8.023 1111 H HIS 131 H HIS 131 -14.490 -5.725 -11.077 1112 HA HIS 131 HA HIS 131 -16.350 -4.506 -11.195 1113 HB2 HIS 131 2HB HIS 131 -16.247 -4.123 -8.740 1114 HB3 HIS 131 3HB HIS 131 -15.246 -2.700 -9.004 1115 HD1 HIS 131 HD1 HIS 131 -18.747 -3.976 -9.527 1116 HD2 HIS 131 HD2 HIS 131 -16.666 -0.386 -9.668 1117 HE1 HIS 131 HE1 HIS 131 -20.491 -2.200 -9.824 1118 HE2 HIS 131 HE2 HIS 131 -19.222 -0.037 -9.688 1119 H HIS 132 H HIS 132 -13.601 -2.270 -10.720 1120 HA HIS 132 HA HIS 132 -12.933 -0.353 -11.685 1121 HB2 HIS 132 2HB HIS 132 -12.429 -0.442 -14.095 1122 HB3 HIS 132 3HB HIS 132 -12.068 -1.990 -13.340 1123 HD1 HIS 132 HD1 HIS 132 -13.358 -4.037 -14.152 1124 HD2 HIS 132 HD2 HIS 132 -14.675 -0.503 -15.910 1125 HE1 HIS 132 HE1 HIS 132 -14.930 -4.739 -15.974 1126 HE2 HIS 132 HE2 HIS 132 -15.882 -2.586 -16.860 1127 H HIS 133 H HIS 133 -13.515 1.318 -13.632 1128 HA HIS 133 HA HIS 133 -16.407 1.540 -14.088 1129 HB2 HIS 133 2HB HIS 133 -14.749 3.861 -12.992 1130 HB3 HIS 133 3HB HIS 133 -16.355 4.037 -13.680 1131 HD1 HIS 133 HD1 HIS 133 -14.662 3.551 -10.540 1132 HD2 HIS 133 HD2 HIS 133 -18.385 2.542 -12.094 1133 HE1 HIS 133 HE1 HIS 133 -16.104 3.027 -8.552 1134 HE2 HIS 133 HE2 HIS 133 -18.391 2.607 -9.510 1135 H HIS 134 H HIS 134 -13.744 3.841 -14.681 1136 HA HIS 134 HA HIS 134 -13.694 3.256 -17.550 1137 HB2 HIS 134 2HB HIS 134 -14.449 6.019 -16.457 1138 HB3 HIS 134 3HB HIS 134 -14.113 5.660 -18.143 1139 HD1 HIS 134 HD1 HIS 134 -16.866 6.105 -15.895 1140 HD2 HIS 134 HD2 HIS 134 -16.141 3.669 -19.190 1141 HE1 HIS 134 HE1 HIS 134 -19.125 5.344 -16.686 1142 HE2 HIS 134 HE2 HIS 134 -18.664 3.961 -18.730 1143 H HIS 135 H HIS 135 -11.861 4.309 -18.571 1144 HA HIS 135 HA HIS 135 -10.261 6.217 -17.111 1145 HB2 HIS 135 2HB HIS 135 -8.155 5.078 -17.073 1146 HB3 HIS 135 3HB HIS 135 -9.293 3.893 -16.445 1147 HD1 HIS 135 HD1 HIS 135 -9.844 1.844 -18.025 1148 HD2 HIS 135 HD2 HIS 135 -6.849 4.358 -19.441 1149 HE1 HIS 135 HE1 HIS 135 -8.731 0.590 -19.897 1150 HE2 HIS 135 HE2 HIS 135 -7.016 2.185 -20.817 1151 H HIS 136 H HIS 136 -9.305 7.626 -18.532 1152 HA HIS 136 HA HIS 136 -9.886 7.401 -21.352 1153 HB2 HIS 136 2HB HIS 136 -10.020 9.593 -20.242 1154 HB3 HIS 136 3HB HIS 136 -8.320 9.514 -19.787 1155 HD1 HIS 136 HD1 HIS 136 -6.643 10.345 -21.487 1156 HD2 HIS 136 HD2 HIS 136 -10.450 9.936 -23.112 1157 HE1 HIS 136 HE1 HIS 136 -6.528 11.409 -23.765 1158 HE2 HIS 136 HE2 HIS 136 -8.840 11.154 -24.722 Start of MODEL 7 1 H1 MET 1 1H MET 1 -6.371 -13.653 -4.341 2 H2 MET 1 2H MET 1 -4.961 -14.536 -4.643 3 H3 MET 1 3H MET 1 -4.948 -12.858 -4.814 4 HA MET 1 HA MET 1 -5.331 -12.567 -2.475 5 HB2 MET 1 2HB MET 1 -5.217 -15.611 -2.421 6 HB3 MET 1 3HB MET 1 -5.117 -14.611 -0.976 7 HG2 MET 1 2HG MET 1 -7.370 -13.720 -1.456 8 HG3 MET 1 3HG MET 1 -7.470 -14.772 -2.871 9 HE1 MET 1 3HE MET 1 -9.946 -16.390 -0.222 10 HE2 MET 1 1HE MET 1 -9.822 -15.702 -1.842 11 HE3 MET 1 2HE MET 1 -9.615 -14.669 -0.425 12 H GLY 2 H GLY 2 -3.565 -12.703 -0.845 13 HA2 GLY 2 2HA GLY 2 -1.316 -12.697 -0.258 14 HA3 GLY 2 3HA GLY 2 -0.914 -13.476 -1.785 15 H THR 3 H THR 3 -2.483 -10.423 -0.807 16 HA THR 3 HA THR 3 -0.875 -8.952 -2.808 17 HB THR 3 HB THR 3 -3.615 -8.259 -1.649 18 HG1 THR 3 HG1 THR 3 -3.074 -10.027 -3.441 19 HG21 THR 3 3HG2 THR 3 -2.332 -6.227 -2.307 20 HG22 THR 3 1HG2 THR 3 -3.715 -6.506 -3.368 21 HG23 THR 3 2HG2 THR 3 -2.088 -6.914 -3.916 22 H VAL 4 H VAL 4 0.414 -7.362 -2.153 23 HA VAL 4 HA VAL 4 0.358 -6.299 0.597 24 HB VAL 4 HB VAL 4 2.396 -5.774 -1.639 25 HG11 VAL 4 1HG1 VAL 4 2.353 -3.991 0.049 26 HG12 VAL 4 2HG1 VAL 4 3.850 -4.915 0.180 27 HG13 VAL 4 3HG1 VAL 4 2.551 -5.176 1.344 28 HG21 VAL 4 3HG2 VAL 4 3.901 -7.363 -0.484 29 HG22 VAL 4 1HG2 VAL 4 2.429 -8.160 -1.048 30 HG23 VAL 4 2HG2 VAL 4 2.616 -7.755 0.661 31 H VAL 5 H VAL 5 -0.927 -4.527 0.811 32 HA VAL 5 HA VAL 5 -1.411 -2.771 -1.527 33 HB VAL 5 HB VAL 5 -3.536 -2.118 -0.594 34 HG11 VAL 5 1HG1 VAL 5 -3.537 -4.233 -1.842 35 HG12 VAL 5 2HG1 VAL 5 -4.767 -4.268 -0.581 36 HG13 VAL 5 3HG1 VAL 5 -3.247 -5.139 -0.356 37 HG21 VAL 5 3HG2 VAL 5 -2.992 -2.038 1.801 38 HG22 VAL 5 1HG2 VAL 5 -2.928 -3.801 1.861 39 HG23 VAL 5 2HG2 VAL 5 -4.456 -2.981 1.525 40 H ILE 6 H ILE 6 -1.057 -0.566 -1.340 41 HA ILE 6 HA ILE 6 0.401 0.348 1.084 42 HB ILE 6 HB ILE 6 1.172 0.999 -1.816 43 HG12 ILE 6 2HG1 ILE 6 3.436 -0.142 -1.026 44 HG13 ILE 6 3HG1 ILE 6 2.432 -0.918 0.189 45 HG21 ILE 6 1HG2 ILE 6 2.471 1.872 0.792 46 HG22 ILE 6 2HG2 ILE 6 1.566 2.903 -0.320 47 HG23 ILE 6 3HG2 ILE 6 3.103 2.199 -0.824 48 HD11 ILE 6 3HD1 ILE 6 2.817 -2.365 -1.723 49 HD12 ILE 6 1HD1 ILE 6 2.114 -1.163 -2.805 50 HD13 ILE 6 2HD1 ILE 6 1.105 -1.960 -1.596 51 H VAL 7 H VAL 7 -0.867 1.888 1.969 52 HA VAL 7 HA VAL 7 -2.551 3.670 0.381 53 HB VAL 7 HB VAL 7 -2.074 3.760 3.404 54 HG11 VAL 7 1HG1 VAL 7 -4.388 4.838 1.739 55 HG12 VAL 7 2HG1 VAL 7 -3.119 5.804 2.498 56 HG13 VAL 7 3HG1 VAL 7 -4.259 4.905 3.500 57 HG21 VAL 7 3HG2 VAL 7 -4.194 2.206 1.908 58 HG22 VAL 7 1HG2 VAL 7 -4.108 2.403 3.660 59 HG23 VAL 7 2HG2 VAL 7 -2.837 1.528 2.805 60 H VAL 8 H VAL 8 -1.734 5.487 -0.420 61 HA VAL 8 HA VAL 8 0.354 6.976 1.049 62 HB VAL 8 HB VAL 8 0.034 7.130 -1.970 63 HG11 VAL 8 1HG1 VAL 8 1.229 8.985 -0.877 64 HG12 VAL 8 2HG1 VAL 8 2.293 8.062 -1.936 65 HG13 VAL 8 3HG1 VAL 8 2.385 7.840 -0.186 66 HG21 VAL 8 3HG2 VAL 8 1.908 5.568 -2.273 67 HG22 VAL 8 1HG2 VAL 8 0.537 4.776 -1.493 68 HG23 VAL 8 2HG2 VAL 8 1.942 5.253 -0.538 69 H SER 9 H SER 9 0.106 9.210 1.055 70 HA SER 9 HA SER 9 -2.087 10.577 -0.248 71 HB2 SER 9 2HB SER 9 -3.335 9.695 1.673 72 HB3 SER 9 3HB SER 9 -2.070 10.226 2.787 73 HG SER 9 HG SER 9 -4.009 11.745 1.420 74 H ASN 10 H ASN 10 -2.007 12.943 0.291 75 HA ASN 10 HA ASN 10 0.774 13.850 0.557 76 HB2 ASN 10 2HB ASN 10 -1.802 15.263 -0.256 77 HB3 ASN 10 3HB ASN 10 -0.263 16.101 -0.082 78 HD21 ASN 10 1HD2 ASN 10 1.356 15.785 -1.629 79 HD22 ASN 10 2HD2 ASN 10 1.059 14.982 -3.131 80 H ASP 11 H ASP 11 -1.684 13.217 2.667 81 HA ASP 11 HA ASP 11 -0.698 15.132 4.705 82 HB2 ASP 11 2HB ASP 11 -2.869 15.951 3.949 83 HB3 ASP 11 3HB ASP 11 -3.590 14.359 4.115 84 H GLU 12 H GLU 12 -0.723 14.378 6.846 85 HA GLU 12 HA GLU 12 -0.238 11.558 7.197 86 HB2 GLU 12 2HB GLU 12 -0.200 13.891 9.142 87 HB3 GLU 12 3HB GLU 12 0.178 12.238 9.619 88 HG2 GLU 12 2HG GLU 12 2.097 12.191 8.119 89 HG3 GLU 12 3HG GLU 12 1.679 13.785 7.489 90 H ARG 13 H ARG 13 -2.849 13.810 8.153 91 HA ARG 13 HA ARG 13 -4.050 12.051 10.074 92 HB2 ARG 13 2HB ARG 13 -5.165 14.532 8.711 93 HB3 ARG 13 3HB ARG 13 -6.090 13.582 9.870 94 HG2 ARG 13 2HG ARG 13 -5.207 15.450 11.047 95 HG3 ARG 13 3HG ARG 13 -4.302 14.033 11.580 96 HD2 ARG 13 2HD ARG 13 -2.408 14.678 10.173 97 HD3 ARG 13 3HD ARG 13 -3.326 16.037 9.513 98 HE ARG 13 HE ARG 13 -2.527 15.808 12.355 99 HH11 ARG 13 1HH1 ARG 13 -2.946 17.783 9.475 100 HH12 ARG 13 2HH1 ARG 13 -2.442 19.245 10.262 101 HH21 ARG 13 1HH2 ARG 13 -1.919 17.709 13.378 102 HH22 ARG 13 2HH2 ARG 13 -1.859 19.197 12.488 103 H ILE 14 H ILE 14 -4.441 12.503 6.627 104 HA ILE 14 HA ILE 14 -6.733 10.869 6.264 105 HB ILE 14 HB ILE 14 -4.401 11.376 4.350 106 HG12 ILE 14 2HG1 ILE 14 -5.500 13.466 4.996 107 HG13 ILE 14 3HG1 ILE 14 -5.904 13.091 3.328 108 HG21 ILE 14 1HG2 ILE 14 -7.172 10.290 3.706 109 HG22 ILE 14 2HG2 ILE 14 -5.660 9.383 3.637 110 HG23 ILE 14 3HG2 ILE 14 -5.932 10.723 2.523 111 HD11 ILE 14 3HD1 ILE 14 -7.812 13.970 4.502 112 HD12 ILE 14 1HD1 ILE 14 -7.699 12.715 5.732 113 HD13 ILE 14 2HD1 ILE 14 -8.119 12.291 4.068 114 H LEU 15 H LEU 15 -3.225 10.146 6.306 115 HA LEU 15 HA LEU 15 -3.420 7.342 5.937 116 HB2 LEU 15 2HB LEU 15 -1.288 8.983 7.354 117 HB3 LEU 15 3HB LEU 15 -1.110 7.285 6.929 118 HG LEU 15 HG LEU 15 -1.522 9.517 4.904 119 HD11 LEU 15 1HD1 LEU 15 1.054 8.117 5.670 120 HD12 LEU 15 2HD1 LEU 15 0.619 9.788 6.049 121 HD13 LEU 15 3HD1 LEU 15 0.849 9.300 4.372 122 HD21 LEU 15 3HD2 LEU 15 -0.846 7.809 3.245 123 HD22 LEU 15 1HD2 LEU 15 -2.333 7.370 4.086 124 HD23 LEU 15 2HD2 LEU 15 -0.813 6.585 4.520 125 H GLU 16 H GLU 16 -3.646 9.370 8.822 126 HA GLU 16 HA GLU 16 -3.398 7.264 10.761 127 HB2 GLU 16 2HB GLU 16 -4.422 10.124 11.007 128 HB3 GLU 16 3HB GLU 16 -4.215 9.034 12.378 129 HG2 GLU 16 2HG GLU 16 -1.804 8.886 11.925 130 HG3 GLU 16 3HG GLU 16 -1.996 9.936 10.522 131 H GLU 17 H GLU 17 -6.151 9.117 9.469 132 HA GLU 17 HA GLU 17 -8.194 7.843 10.977 133 HB2 GLU 17 2HB GLU 17 -8.429 10.070 9.913 134 HB3 GLU 17 3HB GLU 17 -8.324 9.336 8.316 135 HG2 GLU 17 2HG GLU 17 -10.445 8.144 8.711 136 HG3 GLU 17 3HG GLU 17 -10.542 8.840 10.330 137 H LEU 18 H LEU 18 -6.961 7.352 7.678 138 HA LEU 18 HA LEU 18 -8.672 5.184 6.981 139 HB2 LEU 18 2HB LEU 18 -6.185 6.380 5.763 140 HB3 LEU 18 3HB LEU 18 -6.740 4.824 5.184 141 HG LEU 18 HG LEU 18 -8.881 5.795 4.459 142 HD11 LEU 18 1HD1 LEU 18 -9.185 7.544 6.138 143 HD12 LEU 18 2HD1 LEU 18 -9.368 8.177 4.506 144 HD13 LEU 18 3HD1 LEU 18 -7.882 8.487 5.409 145 HD21 LEU 18 3HD2 LEU 18 -6.516 7.389 3.428 146 HD22 LEU 18 1HD2 LEU 18 -8.065 7.179 2.603 147 HD23 LEU 18 2HD2 LEU 18 -7.016 5.789 2.873 148 H LEU 19 H LEU 19 -5.556 5.367 8.648 149 HA LEU 19 HA LEU 19 -4.774 2.674 8.643 150 HB2 LEU 19 2HB LEU 19 -3.409 4.508 9.657 151 HB3 LEU 19 3HB LEU 19 -4.587 4.657 10.946 152 HG LEU 19 HG LEU 19 -3.986 2.074 11.363 153 HD11 LEU 19 1HD1 LEU 19 -1.449 3.063 10.044 154 HD12 LEU 19 2HD1 LEU 19 -2.531 1.803 9.444 155 HD13 LEU 19 3HD1 LEU 19 -1.642 1.554 10.943 156 HD21 LEU 19 3HD2 LEU 19 -2.138 4.282 12.295 157 HD22 LEU 19 1HD2 LEU 19 -2.371 2.705 13.056 158 HD23 LEU 19 2HD2 LEU 19 -3.696 3.866 13.014 159 H GLU 20 H GLU 20 -6.838 4.449 10.880 160 HA GLU 20 HA GLU 20 -7.488 2.351 12.631 161 HB2 GLU 20 2HB GLU 20 -9.038 4.904 12.019 162 HB3 GLU 20 3HB GLU 20 -9.204 3.918 13.469 163 HG2 GLU 20 2HG GLU 20 -6.922 4.462 14.159 164 HG3 GLU 20 3HG GLU 20 -6.639 5.332 12.654 165 H VAL 21 H VAL 21 -8.958 3.439 9.617 166 HA VAL 21 HA VAL 21 -11.358 1.934 9.721 167 HB VAL 21 HB VAL 21 -9.826 2.981 7.296 168 HG11 VAL 21 1HG1 VAL 21 -11.342 1.174 6.581 169 HG12 VAL 21 2HG1 VAL 21 -11.947 2.736 6.027 170 HG13 VAL 21 3HG1 VAL 21 -12.690 1.945 7.420 171 HG21 VAL 21 3HG2 VAL 21 -11.457 4.835 7.338 172 HG22 VAL 21 1HG2 VAL 21 -10.561 4.748 8.854 173 HG23 VAL 21 2HG2 VAL 21 -12.217 4.148 8.775 174 H VAL 22 H VAL 22 -8.154 1.221 8.291 175 HA VAL 22 HA VAL 22 -8.750 -1.367 7.299 176 HB VAL 22 HB VAL 22 -6.058 -0.201 8.163 177 HG11 VAL 22 1HG1 VAL 22 -5.034 -1.919 6.724 178 HG12 VAL 22 2HG1 VAL 22 -6.624 -2.598 6.380 179 HG13 VAL 22 3HG1 VAL 22 -5.972 -2.666 8.018 180 HG21 VAL 22 3HG2 VAL 22 -7.323 -0.314 5.396 181 HG22 VAL 22 1HG2 VAL 22 -5.714 0.318 5.776 182 HG23 VAL 22 2HG2 VAL 22 -7.154 1.133 6.392 183 H LEU 23 H LEU 23 -7.481 -0.219 10.416 184 HA LEU 23 HA LEU 23 -6.821 -2.680 11.608 185 HB2 LEU 23 2HB LEU 23 -7.293 0.115 12.581 186 HB3 LEU 23 3HB LEU 23 -7.385 -1.142 13.793 187 HG LEU 23 HG LEU 23 -5.077 -1.841 13.324 188 HD11 LEU 23 1HD1 LEU 23 -4.963 -1.396 10.947 189 HD12 LEU 23 2HD1 LEU 23 -3.623 -0.633 11.797 190 HD13 LEU 23 3HD1 LEU 23 -4.987 0.341 11.249 191 HD21 LEU 23 3HD2 LEU 23 -5.403 -0.084 14.991 192 HD22 LEU 23 1HD2 LEU 23 -5.282 1.155 13.738 193 HD23 LEU 23 2HD2 LEU 23 -3.881 0.151 14.133 194 H LYS 24 H LYS 24 -9.856 -0.817 11.697 195 HA LYS 24 HA LYS 24 -11.202 -2.748 13.398 196 HB2 LYS 24 2HB LYS 24 -13.126 -1.281 13.280 197 HB3 LYS 24 3HB LYS 24 -11.686 -0.307 13.540 198 HG2 LYS 24 2HG LYS 24 -11.684 0.216 11.072 199 HG3 LYS 24 3HG LYS 24 -13.237 -0.617 10.950 200 HD2 LYS 24 2HD LYS 24 -14.177 1.003 12.635 201 HD3 LYS 24 3HD LYS 24 -12.634 1.861 12.616 202 HE2 LYS 24 2HE LYS 24 -12.968 2.256 10.152 203 HE3 LYS 24 3HE LYS 24 -14.575 1.542 10.307 204 HZ1 LYS 24 3HZ LYS 24 -14.653 3.953 10.438 205 HZ2 LYS 24 1HZ LYS 24 -13.609 3.943 11.765 206 HZ3 LYS 24 2HZ LYS 24 -15.149 3.265 11.897 207 H SER 25 H SER 25 -10.714 -2.338 10.012 208 HA SER 25 HA SER 25 -12.927 -3.894 9.052 209 HB2 SER 25 2HB SER 25 -11.691 -2.345 7.570 210 HB3 SER 25 3HB SER 25 -10.224 -3.307 7.754 211 HG SER 25 HG SER 25 -12.484 -4.685 6.889 212 H ASP 26 H ASP 26 -9.518 -4.576 9.798 213 HA ASP 26 HA ASP 26 -10.067 -7.207 10.758 214 HB2 ASP 26 2HB ASP 26 -10.013 -7.585 8.232 215 HB3 ASP 26 3HB ASP 26 -8.336 -7.057 8.237 216 HA PRO 27 HA PRO 27 -6.448 -5.386 12.835 217 HB2 PRO 27 2HB PRO 27 -6.485 -6.871 15.109 218 HB3 PRO 27 3HB PRO 27 -7.731 -5.649 14.765 219 HG2 PRO 27 2HG PRO 27 -7.881 -8.628 14.414 220 HG3 PRO 27 3HG PRO 27 -9.084 -7.514 15.105 221 HD2 PRO 27 2HD PRO 27 -9.192 -8.438 12.510 222 HD3 PRO 27 3HD PRO 27 -9.893 -6.890 13.031 223 H ASN 28 H ASN 28 -6.595 -8.639 11.629 224 HA ASN 28 HA ASN 28 -3.947 -9.453 12.531 225 HB2 ASN 28 2HB ASN 28 -5.960 -11.015 12.026 226 HB3 ASN 28 3HB ASN 28 -5.579 -10.785 10.328 227 HD21 ASN 28 1HD2 ASN 28 -5.585 -13.227 11.823 228 HD22 ASN 28 2HD2 ASN 28 -3.990 -13.876 11.749 229 H VAL 29 H VAL 29 -5.454 -8.141 9.597 230 HA VAL 29 HA VAL 29 -3.239 -8.174 7.856 231 HB VAL 29 HB VAL 29 -5.524 -6.140 7.969 232 HG11 VAL 29 1HG1 VAL 29 -4.985 -5.646 5.602 233 HG12 VAL 29 2HG1 VAL 29 -3.599 -6.735 5.688 234 HG13 VAL 29 3HG1 VAL 29 -3.623 -5.263 6.660 235 HG21 VAL 29 3HG2 VAL 29 -6.329 -8.447 7.660 236 HG22 VAL 29 1HG2 VAL 29 -5.236 -8.660 6.292 237 HG23 VAL 29 2HG2 VAL 29 -6.566 -7.503 6.189 238 H LYS 30 H LYS 30 -1.316 -7.504 8.627 239 HA LYS 30 HA LYS 30 -1.005 -5.466 10.585 240 HB2 LYS 30 2HB LYS 30 1.007 -7.030 8.953 241 HB3 LYS 30 3HB LYS 30 1.493 -5.835 10.154 242 HG2 LYS 30 2HG LYS 30 -0.111 -8.360 10.678 243 HG3 LYS 30 3HG LYS 30 1.589 -8.096 11.071 244 HD2 LYS 30 2HD LYS 30 -0.763 -6.583 12.262 245 HD3 LYS 30 3HD LYS 30 0.145 -7.869 13.057 246 HE2 LYS 30 2HE LYS 30 2.178 -6.469 13.034 247 HE3 LYS 30 3HE LYS 30 1.296 -5.188 12.196 248 HZ1 LYS 30 3HZ LYS 30 0.693 -6.218 14.917 249 HZ2 LYS 30 1HZ LYS 30 -0.188 -5.025 14.109 250 HZ3 LYS 30 2HZ LYS 30 1.414 -4.735 14.555 251 H THR 31 H THR 31 -1.379 -3.464 10.101 252 HA THR 31 HA THR 31 -0.470 -2.120 7.695 253 HB THR 31 HB THR 31 -1.405 -0.104 8.782 254 HG1 THR 31 HG1 THR 31 -2.282 -1.655 10.974 255 HG21 THR 31 3HG2 THR 31 -3.755 -0.812 8.982 256 HG22 THR 31 1HG2 THR 31 -3.251 -2.499 9.093 257 HG23 THR 31 2HG2 THR 31 -2.989 -1.594 7.599 258 H VAL 32 H VAL 32 1.480 -1.124 7.526 259 HA VAL 32 HA VAL 32 3.108 -0.634 9.947 260 HB VAL 32 HB VAL 32 4.230 -1.726 7.309 261 HG11 VAL 32 1HG1 VAL 32 6.304 -2.070 8.600 262 HG12 VAL 32 2HG1 VAL 32 5.539 -1.383 10.033 263 HG13 VAL 32 3HG1 VAL 32 5.820 -0.373 8.613 264 HG21 VAL 32 3HG2 VAL 32 3.725 -3.290 9.872 265 HG22 VAL 32 1HG2 VAL 32 4.547 -3.902 8.435 266 HG23 VAL 32 2HG2 VAL 32 2.838 -3.476 8.357 267 H ARG 33 H ARG 33 3.216 1.546 10.006 268 HA ARG 33 HA ARG 33 3.605 3.142 7.578 269 HB2 ARG 33 2HB ARG 33 2.036 4.018 9.293 270 HB3 ARG 33 3HB ARG 33 3.313 3.978 10.506 271 HG2 ARG 33 2HG ARG 33 4.589 5.660 9.155 272 HG3 ARG 33 3HG ARG 33 3.231 5.744 8.035 273 HD2 ARG 33 2HD ARG 33 1.787 6.618 9.832 274 HD3 ARG 33 3HD ARG 33 3.125 6.475 10.985 275 HE ARG 33 HE ARG 33 3.893 8.043 8.744 276 HH11 ARG 33 1HH1 ARG 33 2.018 8.308 11.717 277 HH12 ARG 33 2HH1 ARG 33 2.237 10.025 11.832 278 HH21 ARG 33 1HH2 ARG 33 4.164 10.272 8.908 279 HH22 ARG 33 2HH2 ARG 33 3.458 11.142 10.232 280 H THR 34 H THR 34 5.677 2.849 6.872 281 HA THR 34 HA THR 34 7.799 4.015 8.425 282 HB THR 34 HB THR 34 7.914 1.668 9.242 283 HG1 THR 34 HG1 THR 34 9.827 2.991 8.935 284 HG21 THR 34 3HG2 THR 34 8.650 -0.166 7.772 285 HG22 THR 34 1HG2 THR 34 8.548 0.901 6.368 286 HG23 THR 34 2HG2 THR 34 7.084 0.456 7.248 287 H ASP 35 H ASP 35 9.279 4.945 7.169 288 HA ASP 35 HA ASP 35 8.980 5.039 4.295 289 HB2 ASP 35 2HB ASP 35 9.520 7.062 5.611 290 HB3 ASP 35 3HB ASP 35 11.007 6.320 6.185 291 H ASP 36 H ASP 36 10.864 3.273 6.604 292 HA ASP 36 HA ASP 36 13.185 2.714 5.061 293 HB2 ASP 36 2HB ASP 36 12.009 1.326 7.510 294 HB3 ASP 36 3HB ASP 36 13.566 0.899 6.798 295 H LYS 37 H LYS 37 13.043 1.662 3.181 296 HA LYS 37 HA LYS 37 11.101 -0.188 2.356 297 HB2 LYS 37 2HB LYS 37 12.537 -0.646 0.457 298 HB3 LYS 37 3HB LYS 37 12.636 1.058 0.836 299 HG2 LYS 37 2HG LYS 37 14.806 0.503 2.097 300 HG3 LYS 37 3HG LYS 37 14.723 -1.069 1.304 301 HD2 LYS 37 2HD LYS 37 16.107 0.143 -0.152 302 HD3 LYS 37 3HD LYS 37 14.523 0.325 -0.914 303 HE2 LYS 37 2HE LYS 37 14.288 2.555 0.015 304 HE3 LYS 37 3HE LYS 37 15.787 2.370 0.929 305 HZ1 LYS 37 3HZ LYS 37 15.555 2.407 -2.032 306 HZ2 LYS 37 1HZ LYS 37 16.993 2.198 -1.170 307 HZ3 LYS 37 2HZ LYS 37 16.148 3.657 -1.068 308 H GLU 38 H GLU 38 14.154 -0.593 4.044 309 HA GLU 38 HA GLU 38 14.566 -3.345 3.762 310 HB2 GLU 38 2HB GLU 38 16.036 -3.152 5.739 311 HB3 GLU 38 3HB GLU 38 16.311 -1.832 4.611 312 HG2 GLU 38 2HG GLU 38 15.175 -0.259 6.023 313 HG3 GLU 38 3HG GLU 38 14.541 -1.536 7.055 314 H LYS 39 H LYS 39 12.662 -1.500 6.144 315 HA LYS 39 HA LYS 39 11.931 -3.765 7.728 316 HB2 LYS 39 2HB LYS 39 11.991 -1.546 8.750 317 HB3 LYS 39 3HB LYS 39 10.760 -0.956 7.633 318 HG2 LYS 39 2HG LYS 39 9.078 -2.397 8.610 319 HG3 LYS 39 3HG LYS 39 10.288 -3.237 9.581 320 HD2 LYS 39 2HD LYS 39 10.669 -1.191 10.902 321 HD3 LYS 39 3HD LYS 39 9.494 -0.320 9.907 322 HE2 LYS 39 2HE LYS 39 8.561 -1.100 12.094 323 HE3 LYS 39 3HE LYS 39 7.691 -1.733 10.697 324 HZ1 LYS 39 3HZ LYS 39 8.866 -3.821 10.932 325 HZ2 LYS 39 1HZ LYS 39 8.083 -3.437 12.379 326 HZ3 LYS 39 2HZ LYS 39 9.752 -3.224 12.237 327 H VAL 40 H VAL 40 10.264 -1.794 5.228 328 HA VAL 40 HA VAL 40 7.730 -2.931 5.285 329 HB VAL 40 HB VAL 40 9.238 -1.942 2.811 330 HG11 VAL 40 1HG1 VAL 40 6.246 -2.347 3.173 331 HG12 VAL 40 2HG1 VAL 40 7.303 -3.284 2.122 332 HG13 VAL 40 3HG1 VAL 40 7.012 -1.580 1.781 333 HG21 VAL 40 3HG2 VAL 40 8.082 0.203 3.157 334 HG22 VAL 40 1HG2 VAL 40 9.058 -0.215 4.565 335 HG23 VAL 40 2HG2 VAL 40 7.308 -0.431 4.613 336 H LYS 41 H LYS 41 10.617 -4.048 3.569 337 HA LYS 41 HA LYS 41 9.466 -6.195 2.133 338 HB2 LYS 41 2HB LYS 41 12.341 -5.742 3.020 339 HB3 LYS 41 3HB LYS 41 11.834 -6.984 1.872 340 HG2 LYS 41 2HG LYS 41 11.032 -5.265 0.318 341 HG3 LYS 41 3HG LYS 41 11.472 -3.996 1.466 342 HD2 LYS 41 2HD LYS 41 13.857 -4.725 1.307 343 HD3 LYS 41 3HD LYS 41 13.385 -5.933 0.108 344 HE2 LYS 41 2HE LYS 41 12.576 -4.074 -1.359 345 HE3 LYS 41 3HE LYS 41 13.203 -2.918 -0.177 346 HZ1 LYS 41 3HZ LYS 41 15.418 -3.928 -0.498 347 HZ2 LYS 41 1HZ LYS 41 14.805 -3.233 -1.910 348 HZ3 LYS 41 2HZ LYS 41 14.779 -4.910 -1.722 349 H GLU 42 H GLU 42 11.103 -6.064 5.308 350 HA GLU 42 HA GLU 42 11.043 -8.798 5.970 351 HB2 GLU 42 2HB GLU 42 10.859 -6.367 7.807 352 HB3 GLU 42 3HB GLU 42 11.150 -8.015 8.366 353 HG2 GLU 42 2HG GLU 42 13.255 -8.080 7.070 354 HG3 GLU 42 3HG GLU 42 12.964 -6.434 6.519 355 H GLU 43 H GLU 43 8.638 -6.252 6.305 356 HA GLU 43 HA GLU 43 6.728 -7.729 7.817 357 HB2 GLU 43 2HB GLU 43 6.164 -5.321 6.040 358 HB3 GLU 43 3HB GLU 43 5.221 -5.872 7.417 359 HG2 GLU 43 2HG GLU 43 7.928 -4.544 7.442 360 HG3 GLU 43 3HG GLU 43 6.414 -3.898 8.044 361 H ILE 44 H ILE 44 7.191 -7.125 4.337 362 HA ILE 44 HA ILE 44 4.868 -8.297 3.278 363 HB ILE 44 HB ILE 44 7.689 -8.031 2.131 364 HG12 ILE 44 2HG1 ILE 44 5.119 -6.518 1.468 365 HG13 ILE 44 3HG1 ILE 44 6.423 -5.908 2.478 366 HG21 ILE 44 1HG2 ILE 44 5.246 -8.975 0.595 367 HG22 ILE 44 2HG2 ILE 44 6.657 -9.952 0.996 368 HG23 ILE 44 3HG2 ILE 44 6.818 -8.590 -0.111 369 HD11 ILE 44 3HD1 ILE 44 7.938 -5.970 0.541 370 HD12 ILE 44 1HD1 ILE 44 6.532 -4.941 0.273 371 HD13 ILE 44 2HD1 ILE 44 6.605 -6.538 -0.471 372 H GLU 45 H GLU 45 7.956 -9.712 4.271 373 HA GLU 45 HA GLU 45 7.416 -12.396 3.488 374 HB2 GLU 45 2HB GLU 45 9.707 -11.545 3.823 375 HB3 GLU 45 3HB GLU 45 9.393 -11.332 5.544 376 HG2 GLU 45 2HG GLU 45 9.160 -13.713 5.866 377 HG3 GLU 45 3HG GLU 45 9.227 -14.007 4.129 378 H LYS 46 H LYS 46 6.914 -10.591 6.511 379 HA LYS 46 HA LYS 46 6.079 -12.760 8.149 380 HB2 LYS 46 2HB LYS 46 5.368 -9.802 8.342 381 HB3 LYS 46 3HB LYS 46 5.091 -10.987 9.619 382 HG2 LYS 46 2HG LYS 46 7.481 -11.330 9.904 383 HG3 LYS 46 3HG LYS 46 7.835 -10.311 8.507 384 HD2 LYS 46 2HD LYS 46 6.763 -8.376 9.750 385 HD3 LYS 46 3HD LYS 46 6.652 -9.424 11.168 386 HE2 LYS 46 2HE LYS 46 9.101 -9.656 11.194 387 HE3 LYS 46 3HE LYS 46 9.222 -8.652 9.746 388 HZ1 LYS 46 3HZ LYS 46 8.253 -7.797 12.420 389 HZ2 LYS 46 1HZ LYS 46 8.200 -6.832 11.036 390 HZ3 LYS 46 2HZ LYS 46 9.688 -7.330 11.660 391 H ALA 47 H ALA 47 4.387 -10.721 5.844 392 HA ALA 47 HA ALA 47 1.709 -11.371 6.533 393 HB1 ALA 47 3HB ALA 47 2.816 -10.384 3.888 394 HB2 ALA 47 1HB ALA 47 2.316 -9.372 5.245 395 HB3 ALA 47 2HB ALA 47 1.121 -10.350 4.391 396 H ARG 48 H ARG 48 3.867 -12.596 3.957 397 HA ARG 48 HA ARG 48 2.025 -14.521 2.937 398 HB2 ARG 48 2HB ARG 48 3.889 -15.361 1.581 399 HB3 ARG 48 3HB ARG 48 3.872 -13.603 1.555 400 HG2 ARG 48 2HG ARG 48 5.714 -13.511 3.144 401 HG3 ARG 48 3HG ARG 48 5.698 -15.263 3.320 402 HD2 ARG 48 2HD ARG 48 6.329 -15.451 0.890 403 HD3 ARG 48 3HD ARG 48 6.479 -13.687 0.840 404 HE ARG 48 HE ARG 48 8.057 -14.298 2.919 405 HH11 ARG 48 1HH1 ARG 48 7.991 -15.751 -0.287 406 HH12 ARG 48 2HH1 ARG 48 9.676 -16.155 -0.258 407 HH21 ARG 48 1HH2 ARG 48 10.267 -14.776 2.899 408 HH22 ARG 48 2HH2 ARG 48 10.953 -15.604 1.540 409 H LYS 49 H LYS 49 4.527 -14.617 5.415 410 HA LYS 49 HA LYS 49 4.694 -17.417 5.823 411 HB2 LYS 49 2HB LYS 49 6.410 -15.924 6.737 412 HB3 LYS 49 3HB LYS 49 5.216 -15.087 7.727 413 HG2 LYS 49 2HG LYS 49 4.851 -17.211 9.010 414 HG3 LYS 49 3HG LYS 49 6.141 -17.964 8.069 415 HD2 LYS 49 2HD LYS 49 7.787 -16.406 9.001 416 HD3 LYS 49 3HD LYS 49 6.514 -15.500 9.825 417 HE2 LYS 49 2HE LYS 49 6.024 -17.437 11.250 418 HE3 LYS 49 3HE LYS 49 7.236 -18.395 10.397 419 HZ1 LYS 49 3HZ LYS 49 7.818 -15.928 11.954 420 HZ2 LYS 49 1HZ LYS 49 8.951 -16.938 11.214 421 HZ3 LYS 49 2HZ LYS 49 8.042 -17.505 12.516 422 H GLN 50 H GLN 50 2.776 -14.872 7.374 423 HA GLN 50 HA GLN 50 1.401 -16.604 9.192 424 HB2 GLN 50 2HB GLN 50 1.900 -14.164 9.614 425 HB3 GLN 50 3HB GLN 50 0.731 -13.736 8.370 426 HG2 GLN 50 2HG GLN 50 -0.222 -13.482 10.616 427 HG3 GLN 50 3HG GLN 50 -1.076 -14.726 9.709 428 HE21 GLN 50 1HE2 GLN 50 -0.902 -16.886 10.389 429 HE22 GLN 50 2HE2 GLN 50 -0.232 -17.327 11.920 430 H GLY 51 H GLY 51 0.835 -15.414 5.955 431 HA2 GLY 51 2HA GLY 51 -0.612 -16.151 4.325 432 HA3 GLY 51 3HA GLY 51 -1.345 -17.246 5.490 433 H ARG 52 H ARG 52 -1.006 -13.723 5.017 434 HA ARG 52 HA ARG 52 -3.802 -13.224 4.761 435 HB2 ARG 52 2HB ARG 52 -4.059 -11.849 6.894 436 HB3 ARG 52 3HB ARG 52 -3.972 -13.584 7.132 437 HG2 ARG 52 2HG ARG 52 -2.675 -12.737 8.879 438 HG3 ARG 52 3HG ARG 52 -1.476 -13.218 7.680 439 HD2 ARG 52 2HD ARG 52 -1.445 -10.771 6.927 440 HD3 ARG 52 3HD ARG 52 -2.409 -10.412 8.363 441 HE ARG 52 HE ARG 52 -0.404 -11.654 9.511 442 HH11 ARG 52 1HH1 ARG 52 -0.288 -9.213 6.976 443 HH12 ARG 52 2HH1 ARG 52 1.280 -8.635 7.450 444 HH21 ARG 52 1HH2 ARG 52 1.677 -10.950 10.058 445 HH22 ARG 52 2HH2 ARG 52 2.394 -9.620 9.198 446 HA PRO 53 HA PRO 53 -2.227 -9.581 2.733 447 HB2 PRO 53 2HB PRO 53 -4.312 -7.775 3.891 448 HB3 PRO 53 3HB PRO 53 -4.042 -8.252 2.201 449 HG2 PRO 53 2HG PRO 53 -6.146 -9.171 3.624 450 HG3 PRO 53 3HG PRO 53 -5.348 -10.146 2.370 451 HD2 PRO 53 2HD PRO 53 -5.087 -10.342 5.364 452 HD3 PRO 53 3HD PRO 53 -5.143 -11.636 4.145 453 H ILE 54 H ILE 54 -1.386 -7.373 2.965 454 HA ILE 54 HA ILE 54 -0.791 -6.392 5.682 455 HB ILE 54 HB ILE 54 1.199 -7.673 5.159 456 HG12 ILE 54 2HG1 ILE 54 1.645 -4.685 4.749 457 HG13 ILE 54 3HG1 ILE 54 1.738 -5.589 6.252 458 HG21 ILE 54 1HG2 ILE 54 2.533 -7.398 3.118 459 HG22 ILE 54 2HG2 ILE 54 1.361 -6.234 2.497 460 HG23 ILE 54 3HG2 ILE 54 0.889 -7.917 2.738 461 HD11 ILE 54 3HD1 ILE 54 3.916 -4.962 5.494 462 HD12 ILE 54 1HD1 ILE 54 3.663 -5.763 3.944 463 HD13 ILE 54 2HD1 ILE 54 3.748 -6.715 5.431 464 H VAL 55 H VAL 55 -0.496 -4.134 5.768 465 HA VAL 55 HA VAL 55 -0.966 -2.585 3.291 466 HB VAL 55 HB VAL 55 -2.013 -1.704 6.015 467 HG11 VAL 55 1HG1 VAL 55 -3.435 -0.199 4.678 468 HG12 VAL 55 2HG1 VAL 55 -2.720 -0.827 3.192 469 HG13 VAL 55 3HG1 VAL 55 -1.724 0.074 4.339 470 HG21 VAL 55 3HG2 VAL 55 -3.184 -3.766 5.563 471 HG22 VAL 55 1HG2 VAL 55 -3.528 -3.272 3.907 472 HG23 VAL 55 2HG2 VAL 55 -4.282 -2.424 5.251 473 H ILE 56 H ILE 56 0.299 -0.716 3.047 474 HA ILE 56 HA ILE 56 2.248 -0.068 5.211 475 HB ILE 56 HB ILE 56 2.733 0.089 2.190 476 HG12 ILE 56 2HG1 ILE 56 2.716 -2.261 2.966 477 HG13 ILE 56 3HG1 ILE 56 4.339 -1.776 2.504 478 HG21 ILE 56 1HG2 ILE 56 5.084 0.623 2.764 479 HG22 ILE 56 2HG2 ILE 56 4.656 0.669 4.476 480 HG23 ILE 56 3HG2 ILE 56 3.967 1.853 3.362 481 HD11 ILE 56 3HD1 ILE 56 4.377 -3.142 4.491 482 HD12 ILE 56 1HD1 ILE 56 3.288 -2.035 5.323 483 HD13 ILE 56 2HD1 ILE 56 4.920 -1.511 4.887 484 H PHE 57 H PHE 57 2.239 2.055 5.859 485 HA PHE 57 HA PHE 57 0.563 3.985 4.347 486 HB2 PHE 57 2HB PHE 57 1.059 3.647 7.329 487 HB3 PHE 57 3HB PHE 57 0.458 5.170 6.675 488 HD1 PHE 57 HD2 PHE 57 -0.324 1.523 6.928 489 HD2 PHE 57 HD1 PHE 57 -1.840 5.438 6.126 490 HE1 PHE 57 HE2 PHE 57 -2.623 0.644 6.895 491 HE2 PHE 57 HE1 PHE 57 -4.127 4.546 6.109 492 HZ PHE 57 HZ PHE 57 -4.513 2.153 6.464 493 H ILE 58 H ILE 58 1.612 5.531 3.357 494 HA ILE 58 HA ILE 58 3.992 6.824 4.475 495 HB ILE 58 HB ILE 58 5.078 6.706 2.106 496 HG12 ILE 58 2HG1 ILE 58 3.197 4.321 1.877 497 HG13 ILE 58 3HG1 ILE 58 3.166 5.781 0.890 498 HG21 ILE 58 1HG2 ILE 58 6.285 4.621 2.618 499 HG22 ILE 58 2HG2 ILE 58 5.049 4.178 3.797 500 HG23 ILE 58 3HG2 ILE 58 6.063 5.595 4.073 501 HD11 ILE 58 3HD1 ILE 58 5.437 5.202 0.073 502 HD12 ILE 58 1HD1 ILE 58 4.178 4.047 -0.354 503 HD13 ILE 58 2HD1 ILE 58 5.304 3.672 0.944 504 H ARG 59 H ARG 59 4.604 8.753 3.009 505 HA ARG 59 HA ARG 59 2.097 10.136 2.223 506 HB2 ARG 59 2HB ARG 59 2.855 10.676 4.566 507 HB3 ARG 59 3HB ARG 59 4.359 11.298 3.917 508 HG2 ARG 59 2HG ARG 59 3.025 13.005 2.635 509 HG3 ARG 59 3HG ARG 59 1.575 12.428 3.465 510 HD2 ARG 59 2HD ARG 59 2.539 14.457 4.530 511 HD3 ARG 59 3HD ARG 59 2.509 13.073 5.628 512 HE ARG 59 HE ARG 59 4.998 13.217 4.281 513 HH11 ARG 59 1HH1 ARG 59 3.279 14.868 6.882 514 HH12 ARG 59 2HH1 ARG 59 4.737 15.372 7.674 515 HH21 ARG 59 1HH2 ARG 59 6.881 13.853 5.344 516 HH22 ARG 59 2HH2 ARG 59 6.774 14.796 6.798 517 H GLY 60 H GLY 60 2.369 10.423 0.073 518 HA2 GLY 60 2HA GLY 60 3.017 11.367 -1.898 519 HA3 GLY 60 3HA GLY 60 3.680 12.640 -0.902 520 H ALA 61 H ALA 61 5.881 12.664 -0.436 521 HA ALA 61 HA ALA 61 7.714 11.909 -2.413 522 HB1 ALA 61 3HB ALA 61 9.435 12.666 -0.815 523 HB2 ALA 61 1HB ALA 61 8.238 12.620 0.493 524 HB3 ALA 61 2HB ALA 61 8.056 13.769 -0.835 525 H TYR 62 H TYR 62 6.741 10.279 0.517 526 HA TYR 62 HA TYR 62 8.848 8.396 0.724 527 HB2 TYR 62 2HB TYR 62 6.041 8.202 1.877 528 HB3 TYR 62 3HB TYR 62 7.445 7.283 2.405 529 HD1 TYR 62 HD1 TYR 62 9.045 10.230 2.005 530 HD2 TYR 62 HD2 TYR 62 5.863 8.668 4.394 531 HE1 TYR 62 HE1 TYR 62 9.485 11.934 3.704 532 HE2 TYR 62 HE2 TYR 62 6.311 10.389 6.098 533 HH TYR 62 HH TYR 62 8.219 11.839 6.818 534 H GLU 63 H GLU 63 5.869 8.456 -1.129 535 HA GLU 63 HA GLU 63 5.506 5.757 -1.750 536 HB2 GLU 63 2HB GLU 63 3.946 7.656 -2.313 537 HB3 GLU 63 3HB GLU 63 5.001 8.065 -3.662 538 HG2 GLU 63 2HG GLU 63 4.603 5.644 -4.481 539 HG3 GLU 63 3HG GLU 63 3.310 5.578 -3.286 540 H GLU 64 H GLU 64 7.893 8.029 -2.958 541 HA GLU 64 HA GLU 64 8.788 6.855 -5.303 542 HB2 GLU 64 2HB GLU 64 9.642 9.004 -4.612 543 HB3 GLU 64 3HB GLU 64 10.299 8.343 -3.124 544 HG2 GLU 64 2HG GLU 64 12.063 8.869 -4.777 545 HG3 GLU 64 3HG GLU 64 12.038 7.159 -4.355 546 H VAL 65 H VAL 65 9.460 5.928 -1.970 547 HA VAL 65 HA VAL 65 11.645 4.200 -2.404 548 HB VAL 65 HB VAL 65 9.678 3.983 -0.087 549 HG11 VAL 65 1HG1 VAL 65 12.615 3.302 -0.264 550 HG12 VAL 65 2HG1 VAL 65 11.275 2.156 -0.193 551 HG13 VAL 65 3HG1 VAL 65 11.624 3.192 1.192 552 HG21 VAL 65 3HG2 VAL 65 11.049 5.638 1.140 553 HG22 VAL 65 1HG2 VAL 65 10.354 6.352 -0.318 554 HG23 VAL 65 2HG2 VAL 65 12.052 5.875 -0.295 555 H VAL 66 H VAL 66 8.165 3.697 -2.664 556 HA VAL 66 HA VAL 66 7.896 0.937 -2.425 557 HB VAL 66 HB VAL 66 6.299 2.779 -4.267 558 HG11 VAL 66 1HG1 VAL 66 5.567 -0.014 -3.285 559 HG12 VAL 66 2HG1 VAL 66 5.950 0.435 -4.947 560 HG13 VAL 66 3HG1 VAL 66 4.496 1.070 -4.180 561 HG21 VAL 66 3HG2 VAL 66 5.729 1.842 -1.439 562 HG22 VAL 66 1HG2 VAL 66 4.648 2.827 -2.430 563 HG23 VAL 66 2HG2 VAL 66 6.212 3.470 -1.922 564 H ARG 67 H ARG 67 8.946 2.811 -5.257 565 HA ARG 67 HA ARG 67 8.732 0.866 -7.251 566 HB2 ARG 67 2HB ARG 67 9.152 3.142 -7.876 567 HB3 ARG 67 3HB ARG 67 10.642 3.214 -6.950 568 HG2 ARG 67 2HG ARG 67 11.850 1.985 -8.565 569 HG3 ARG 67 3HG ARG 67 10.390 1.329 -9.299 570 HD2 ARG 67 2HD ARG 67 11.544 3.032 -10.706 571 HD3 ARG 67 3HD ARG 67 9.871 3.442 -10.339 572 HE ARG 67 HE ARG 67 11.270 4.792 -8.429 573 HH11 ARG 67 1HH1 ARG 67 11.561 4.705 -11.956 574 HH12 ARG 67 2HH1 ARG 67 12.140 6.333 -12.061 575 HH21 ARG 67 1HH2 ARG 67 11.961 6.973 -8.636 576 HH22 ARG 67 2HH2 ARG 67 12.369 7.611 -10.200 577 H ASP 68 H ASP 68 11.234 1.277 -4.814 578 HA ASP 68 HA ASP 68 13.035 -0.754 -5.784 579 HB2 ASP 68 2HB ASP 68 13.668 1.201 -4.265 580 HB3 ASP 68 3HB ASP 68 12.809 0.397 -2.957 581 H ILE 69 H ILE 69 10.474 -0.550 -3.362 582 HA ILE 69 HA ILE 69 10.874 -3.038 -2.058 583 HB ILE 69 HB ILE 69 8.354 -1.307 -2.147 584 HG12 ILE 69 2HG1 ILE 69 10.622 -1.229 -0.098 585 HG13 ILE 69 3HG1 ILE 69 10.432 -0.072 -1.409 586 HG21 ILE 69 1HG2 ILE 69 9.209 -3.366 -0.081 587 HG22 ILE 69 2HG2 ILE 69 7.917 -3.569 -1.265 588 HG23 ILE 69 3HG2 ILE 69 7.767 -2.352 0.001 589 HD11 ILE 69 3HD1 ILE 69 9.629 0.838 0.679 590 HD12 ILE 69 1HD1 ILE 69 8.488 -0.496 0.857 591 HD13 ILE 69 2HD1 ILE 69 8.303 0.657 -0.466 592 H VAL 70 H VAL 70 8.983 -2.097 -4.873 593 HA VAL 70 HA VAL 70 7.040 -4.045 -5.115 594 HB VAL 70 HB VAL 70 8.612 -2.512 -7.234 595 HG11 VAL 70 1HG1 VAL 70 6.274 -4.381 -7.786 596 HG12 VAL 70 2HG1 VAL 70 7.938 -4.616 -8.318 597 HG13 VAL 70 3HG1 VAL 70 6.993 -3.271 -8.957 598 HG21 VAL 70 3HG2 VAL 70 7.039 -1.205 -5.857 599 HG22 VAL 70 1HG2 VAL 70 5.724 -2.292 -6.298 600 HG23 VAL 70 2HG2 VAL 70 6.480 -1.274 -7.528 601 H GLU 71 H GLU 71 10.421 -4.139 -6.229 602 HA GLU 71 HA GLU 71 10.457 -6.489 -7.688 603 HB2 GLU 71 2HB GLU 71 12.346 -4.959 -7.696 604 HB3 GLU 71 3HB GLU 71 12.643 -5.241 -5.983 605 HG2 GLU 71 2HG GLU 71 13.069 -7.712 -6.647 606 HG3 GLU 71 3HG GLU 71 13.124 -7.130 -8.308 607 H TYR 72 H TYR 72 10.956 -6.037 -4.199 608 HA TYR 72 HA TYR 72 11.679 -8.652 -3.499 609 HB2 TYR 72 2HB TYR 72 11.938 -6.674 -1.990 610 HB3 TYR 72 3HB TYR 72 10.193 -6.613 -1.783 611 HD1 TYR 72 HD2 TYR 72 9.029 -8.324 -0.395 612 HD2 TYR 72 HD1 TYR 72 13.279 -8.420 -0.862 613 HE1 TYR 72 HE2 TYR 72 9.194 -9.910 1.469 614 HE2 TYR 72 HE1 TYR 72 13.443 -10.000 1.012 615 HH TYR 72 HH TYR 72 10.757 -11.606 2.318 616 H ALA 73 H ALA 73 8.449 -7.093 -3.432 617 HA ALA 73 HA ALA 73 7.083 -9.388 -2.473 618 HB1 ALA 73 3HB ALA 73 5.980 -6.984 -3.948 619 HB2 ALA 73 1HB ALA 73 6.176 -7.138 -2.202 620 HB3 ALA 73 2HB ALA 73 5.026 -8.174 -3.055 621 H GLN 74 H GLN 74 7.880 -8.274 -5.742 622 HA GLN 74 HA GLN 74 6.099 -9.963 -7.186 623 HB2 GLN 74 2HB GLN 74 8.706 -8.644 -8.051 624 HB3 GLN 74 3HB GLN 74 7.607 -9.462 -9.156 625 HG2 GLN 74 2HG GLN 74 6.806 -7.070 -7.472 626 HG3 GLN 74 3HG GLN 74 7.449 -6.936 -9.102 627 HE21 GLN 74 1HE2 GLN 74 5.564 -5.905 -9.821 628 HE22 GLN 74 2HE2 GLN 74 4.068 -6.743 -10.048 629 H LYS 75 H LYS 75 9.548 -10.339 -6.289 630 HA LYS 75 HA LYS 75 9.841 -12.979 -7.405 631 HB2 LYS 75 2HB LYS 75 12.018 -13.026 -6.189 632 HB3 LYS 75 3HB LYS 75 11.816 -11.571 -7.155 633 HG2 LYS 75 2HG LYS 75 11.267 -10.280 -5.166 634 HG3 LYS 75 3HG LYS 75 11.357 -11.721 -4.160 635 HD2 LYS 75 2HD LYS 75 13.709 -10.570 -5.712 636 HD3 LYS 75 3HD LYS 75 13.358 -10.206 -4.020 637 HE2 LYS 75 2HE LYS 75 13.993 -12.949 -5.156 638 HE3 LYS 75 3HE LYS 75 15.066 -11.942 -4.187 639 HZ1 LYS 75 3HZ LYS 75 12.513 -13.175 -3.286 640 HZ2 LYS 75 1HZ LYS 75 13.441 -12.106 -2.361 641 HZ3 LYS 75 2HZ LYS 75 14.077 -13.604 -2.809 642 H GLU 76 H GLU 76 8.718 -11.702 -4.376 643 HA GLU 76 HA GLU 76 8.611 -14.241 -2.978 644 HB2 GLU 76 2HB GLU 76 7.966 -11.380 -2.358 645 HB3 GLU 76 3HB GLU 76 7.006 -12.566 -1.492 646 HG2 GLU 76 2HG GLU 76 9.064 -11.711 -0.296 647 HG3 GLU 76 3HG GLU 76 8.879 -13.453 -0.374 648 H GLY 77 H GLY 77 6.912 -13.212 -5.583 649 HA2 GLY 77 2HA GLY 77 5.095 -14.123 -6.646 650 HA3 GLY 77 3HA GLY 77 5.001 -15.312 -5.356 651 H LEU 78 H LEU 78 4.825 -11.883 -4.838 652 HA LEU 78 HA LEU 78 2.021 -12.086 -3.931 653 HB2 LEU 78 2HB LEU 78 4.287 -10.408 -2.761 654 HB3 LEU 78 3HB LEU 78 2.616 -10.355 -2.217 655 HG LEU 78 HG LEU 78 4.508 -12.733 -1.965 656 HD11 LEU 78 1HD1 LEU 78 5.057 -10.978 -0.393 657 HD12 LEU 78 2HD1 LEU 78 4.350 -12.352 0.452 658 HD13 LEU 78 3HD1 LEU 78 3.384 -10.901 0.164 659 HD21 LEU 78 3HD2 LEU 78 2.228 -13.528 -2.345 660 HD22 LEU 78 1HD2 LEU 78 1.624 -12.494 -1.048 661 HD23 LEU 78 2HD2 LEU 78 2.716 -13.834 -0.681 662 H ARG 79 H ARG 79 0.646 -10.716 -4.855 663 HA ARG 79 HA ARG 79 1.467 -8.946 -6.962 664 HB2 ARG 79 2HB ARG 79 -0.613 -10.347 -7.023 665 HB3 ARG 79 3HB ARG 79 -1.289 -9.399 -5.711 666 HG2 ARG 79 2HG ARG 79 -0.484 -8.012 -8.268 667 HG3 ARG 79 3HG ARG 79 -1.978 -8.941 -8.228 668 HD2 ARG 79 2HD ARG 79 -1.335 -6.666 -6.320 669 HD3 ARG 79 3HD ARG 79 -2.283 -6.496 -7.796 670 HE ARG 79 HE ARG 79 -3.062 -8.055 -5.411 671 HH11 ARG 79 1HH1 ARG 79 -3.999 -6.460 -8.423 672 HH12 ARG 79 2HH1 ARG 79 -5.699 -6.645 -8.120 673 HH21 ARG 79 1HH2 ARG 79 -5.293 -8.266 -5.028 674 HH22 ARG 79 2HH2 ARG 79 -6.425 -7.664 -6.200 675 H VAL 80 H VAL 80 1.440 -6.707 -6.931 676 HA VAL 80 HA VAL 80 1.380 -5.415 -4.263 677 HB VAL 80 HB VAL 80 2.886 -3.610 -5.453 678 HG11 VAL 80 1HG1 VAL 80 4.046 -6.337 -4.777 679 HG12 VAL 80 2HG1 VAL 80 3.690 -5.041 -3.634 680 HG13 VAL 80 3HG1 VAL 80 4.950 -4.820 -4.849 681 HG21 VAL 80 3HG2 VAL 80 3.430 -5.977 -7.298 682 HG22 VAL 80 1HG2 VAL 80 4.357 -4.471 -7.254 683 HG23 VAL 80 2HG2 VAL 80 2.667 -4.455 -7.762 684 H LEU 81 H LEU 81 0.091 -3.763 -3.973 685 HA LEU 81 HA LEU 81 -1.558 -2.673 -6.174 686 HB2 LEU 81 2HB LEU 81 -2.584 -4.571 -4.664 687 HB3 LEU 81 3HB LEU 81 -2.597 -3.367 -3.392 688 HG LEU 81 HG LEU 81 -4.188 -1.983 -4.732 689 HD11 LEU 81 1HD1 LEU 81 -3.574 -2.679 -6.981 690 HD12 LEU 81 2HD1 LEU 81 -5.290 -2.948 -6.702 691 HD13 LEU 81 3HD1 LEU 81 -4.165 -4.311 -6.666 692 HD21 LEU 81 3HD2 LEU 81 -5.066 -4.852 -4.285 693 HD22 LEU 81 1HD2 LEU 81 -6.145 -3.458 -4.458 694 HD23 LEU 81 2HD2 LEU 81 -5.053 -3.560 -3.079 695 H VAL 82 H VAL 82 -0.817 -0.552 -6.170 696 HA VAL 82 HA VAL 82 -0.266 0.743 -3.550 697 HB VAL 82 HB VAL 82 0.639 1.642 -6.335 698 HG11 VAL 82 1HG1 VAL 82 0.375 3.558 -4.812 699 HG12 VAL 82 2HG1 VAL 82 2.087 3.261 -5.120 700 HG13 VAL 82 3HG1 VAL 82 1.365 2.752 -3.591 701 HG21 VAL 82 3HG2 VAL 82 1.758 -0.445 -5.641 702 HG22 VAL 82 1HG2 VAL 82 2.244 0.309 -4.119 703 HG23 VAL 82 2HG2 VAL 82 2.894 0.905 -5.649 704 H ILE 83 H ILE 83 -1.935 1.810 -2.838 705 HA ILE 83 HA ILE 83 -3.832 3.099 -4.688 706 HB ILE 83 HB ILE 83 -4.268 2.044 -1.858 707 HG12 ILE 83 2HG1 ILE 83 -5.290 1.083 -4.573 708 HG13 ILE 83 3HG1 ILE 83 -4.108 0.263 -3.561 709 HG21 ILE 83 1HG2 ILE 83 -6.646 2.648 -2.135 710 HG22 ILE 83 2HG2 ILE 83 -6.288 3.381 -3.699 711 HG23 ILE 83 3HG2 ILE 83 -5.621 4.083 -2.225 712 HD11 ILE 83 3HD1 ILE 83 -7.021 0.678 -2.920 713 HD12 ILE 83 1HD1 ILE 83 -5.831 -0.091 -1.862 714 HD13 ILE 83 2HD1 ILE 83 -6.231 -0.819 -3.415 715 H LYS 84 H LYS 84 -3.309 5.194 -4.857 716 HA LYS 84 HA LYS 84 -3.027 6.769 -2.384 717 HB2 LYS 84 2HB LYS 84 -1.401 8.239 -3.278 718 HB3 LYS 84 3HB LYS 84 -0.795 6.623 -3.575 719 HG2 LYS 84 2HG LYS 84 -2.144 8.329 -5.688 720 HG3 LYS 84 3HG LYS 84 -0.404 8.311 -5.398 721 HD2 LYS 84 2HD LYS 84 -0.481 5.795 -5.856 722 HD3 LYS 84 3HD LYS 84 -2.142 6.040 -6.422 723 HE2 LYS 84 2HE LYS 84 -0.574 6.077 -8.312 724 HE3 LYS 84 3HE LYS 84 -1.313 7.665 -8.103 725 HZ1 LYS 84 3HZ LYS 84 0.745 8.279 -6.817 726 HZ2 LYS 84 1HZ LYS 84 0.998 7.995 -8.465 727 HZ3 LYS 84 2HZ LYS 84 1.430 6.825 -7.326 728 H VAL 85 H VAL 85 -4.075 8.710 -2.371 729 HA VAL 85 HA VAL 85 -6.339 8.846 -4.157 730 HB VAL 85 HB VAL 85 -6.858 9.293 -1.860 731 HG11 VAL 85 1HG1 VAL 85 -4.793 11.511 -1.864 732 HG12 VAL 85 2HG1 VAL 85 -4.643 9.948 -1.049 733 HG13 VAL 85 3HG1 VAL 85 -5.874 11.099 -0.526 734 HG21 VAL 85 3HG2 VAL 85 -7.904 11.509 -1.948 735 HG22 VAL 85 1HG2 VAL 85 -8.097 10.679 -3.486 736 HG23 VAL 85 2HG2 VAL 85 -6.897 11.959 -3.320 737 H ALA 86 H ALA 86 -6.348 9.914 -5.963 738 HA ALA 86 HA ALA 86 -4.096 11.451 -6.847 739 HB1 ALA 86 3HB ALA 86 -6.728 10.835 -8.233 740 HB2 ALA 86 1HB ALA 86 -5.236 9.904 -8.380 741 HB3 ALA 86 2HB ALA 86 -5.310 11.555 -8.999 742 H GLN 87 H GLN 87 -4.177 13.513 -7.634 743 HA GLN 87 HA GLN 87 -6.287 15.369 -7.478 744 HB2 GLN 87 2HB GLN 87 -5.251 16.942 -5.807 745 HB3 GLN 87 3HB GLN 87 -5.813 15.448 -5.065 746 HG2 GLN 87 2HG GLN 87 -3.540 14.593 -4.947 747 HG3 GLN 87 3HG GLN 87 -2.929 16.005 -5.805 748 HE21 GLN 87 1HE2 GLN 87 -4.134 14.815 -2.746 749 HE22 GLN 87 2HE2 GLN 87 -3.673 16.196 -1.813 750 H ASP 88 H ASP 88 -5.253 17.621 -8.104 751 HA ASP 88 HA ASP 88 -3.972 17.088 -10.578 752 HB2 ASP 88 2HB ASP 88 -5.644 18.867 -10.266 753 HB3 ASP 88 3HB ASP 88 -4.537 19.754 -9.223 754 H GLN 89 H GLN 89 -2.045 16.053 -9.960 755 HA GLN 89 HA GLN 89 0.289 17.788 -9.559 756 HB2 GLN 89 2HB GLN 89 -0.061 15.076 -8.183 757 HB3 GLN 89 3HB GLN 89 1.361 16.107 -8.091 758 HG2 GLN 89 2HG GLN 89 0.053 17.783 -6.832 759 HG3 GLN 89 3HG GLN 89 -1.368 16.739 -6.932 760 HE21 GLN 89 1HE2 GLN 89 -1.318 14.712 -5.795 761 HE22 GLN 89 2HE2 GLN 89 -0.286 14.490 -4.430 762 H GLU 90 H GLU 90 1.443 17.522 -11.391 763 HA GLU 90 HA GLU 90 1.248 15.321 -13.186 764 HB2 GLU 90 2HB GLU 90 3.331 17.541 -12.974 765 HB3 GLU 90 3HB GLU 90 3.215 16.408 -14.322 766 HG2 GLU 90 2HG GLU 90 0.977 17.256 -14.880 767 HG3 GLU 90 3HG GLU 90 1.025 18.340 -13.490 768 H LEU 91 H LEU 91 3.406 16.115 -10.533 769 HA LEU 91 HA LEU 91 5.454 14.221 -10.909 770 HB2 LEU 91 2HB LEU 91 5.612 16.141 -9.373 771 HB3 LEU 91 3HB LEU 91 4.347 15.467 -8.363 772 HG LEU 91 HG LEU 91 5.876 13.555 -7.780 773 HD11 LEU 91 1HD1 LEU 91 8.270 13.699 -8.296 774 HD12 LEU 91 2HD1 LEU 91 7.973 15.101 -9.325 775 HD13 LEU 91 3HD1 LEU 91 7.294 13.528 -9.754 776 HD21 LEU 91 3HD2 LEU 91 5.701 15.485 -6.276 777 HD22 LEU 91 1HD2 LEU 91 7.001 16.304 -7.145 778 HD23 LEU 91 2HD2 LEU 91 7.330 14.815 -6.255 779 H LEU 92 H LEU 92 2.375 14.044 -9.123 780 HA LEU 92 HA LEU 92 2.621 11.513 -7.946 781 HB2 LEU 92 2HB LEU 92 0.923 13.111 -7.267 782 HB3 LEU 92 3HB LEU 92 0.160 13.065 -8.837 783 HG LEU 92 HG LEU 92 0.210 10.498 -7.214 784 HD11 LEU 92 1HD1 LEU 92 -1.778 12.730 -6.661 785 HD12 LEU 92 2HD1 LEU 92 -0.508 12.184 -5.566 786 HD13 LEU 92 3HD1 LEU 92 -1.824 11.095 -5.991 787 HD21 LEU 92 3HD2 LEU 92 -1.890 11.703 -9.068 788 HD22 LEU 92 1HD2 LEU 92 -2.000 10.123 -8.275 789 HD23 LEU 92 2HD2 LEU 92 -0.751 10.420 -9.481 790 H GLU 93 H GLU 93 1.332 12.467 -11.115 791 HA GLU 93 HA GLU 93 0.562 9.803 -11.893 792 HB2 GLU 93 2HB GLU 93 0.762 12.379 -13.493 793 HB3 GLU 93 3HB GLU 93 0.118 10.866 -14.131 794 HG2 GLU 93 2HG GLU 93 -1.643 10.940 -12.328 795 HG3 GLU 93 3HG GLU 93 -1.041 12.541 -11.882 796 H ARG 94 H ARG 94 3.458 11.772 -12.301 797 HA ARG 94 HA ARG 94 4.522 10.422 -14.567 798 HB2 ARG 94 2HB ARG 94 5.309 12.682 -13.710 799 HB3 ARG 94 3HB ARG 94 6.143 11.834 -12.410 800 HG2 ARG 94 2HG ARG 94 7.373 10.529 -14.257 801 HG3 ARG 94 3HG ARG 94 6.712 11.713 -15.388 802 HD2 ARG 94 2HD ARG 94 8.966 12.365 -14.761 803 HD3 ARG 94 3HD ARG 94 7.818 13.525 -14.080 804 HE ARG 94 HE ARG 94 8.478 11.382 -12.286 805 HH11 ARG 94 1HH1 ARG 94 9.522 14.571 -13.374 806 HH12 ARG 94 2HH1 ARG 94 10.412 14.893 -11.918 807 HH21 ARG 94 1HH2 ARG 94 9.648 11.814 -10.418 808 HH22 ARG 94 2HH2 ARG 94 10.479 13.327 -10.246 809 H PHE 95 H PHE 95 5.174 10.128 -11.081 810 HA PHE 95 HA PHE 95 6.924 7.914 -11.238 811 HB2 PHE 95 2HB PHE 95 6.880 9.402 -9.279 812 HB3 PHE 95 3HB PHE 95 5.230 8.904 -8.904 813 HD1 PHE 95 HD2 PHE 95 8.624 7.383 -9.488 814 HD2 PHE 95 HD1 PHE 95 4.954 7.203 -7.285 815 HE1 PHE 95 HE2 PHE 95 9.480 5.480 -8.195 816 HE2 PHE 95 HE1 PHE 95 5.826 5.297 -6.007 817 HZ PHE 95 HZ PHE 95 8.081 4.431 -6.463 818 H TYR 96 H TYR 96 3.447 8.202 -10.721 819 HA TYR 96 HA TYR 96 2.666 5.617 -10.154 820 HB2 TYR 96 2HB TYR 96 0.849 6.986 -9.945 821 HB3 TYR 96 3HB TYR 96 1.426 8.103 -11.155 822 HD1 TYR 96 HD1 TYR 96 -0.581 5.032 -10.621 823 HD2 TYR 96 HD2 TYR 96 0.512 8.081 -13.387 824 HE1 TYR 96 HE1 TYR 96 -2.392 4.327 -12.109 825 HE2 TYR 96 HE2 TYR 96 -1.294 7.392 -14.884 826 HH TYR 96 HH TYR 96 -3.780 5.347 -13.966 827 H GLU 97 H GLU 97 3.689 6.917 -13.245 828 HA GLU 97 HA GLU 97 2.596 4.832 -14.896 829 HB2 GLU 97 2HB GLU 97 3.032 7.117 -15.762 830 HB3 GLU 97 3HB GLU 97 4.764 6.878 -15.528 831 HG2 GLU 97 2HG GLU 97 4.637 4.937 -17.136 832 HG3 GLU 97 3HG GLU 97 2.955 5.361 -17.443 833 H GLN 98 H GLN 98 5.725 5.474 -13.337 834 HA GLN 98 HA GLN 98 7.278 3.465 -14.569 835 HB2 GLN 98 2HB GLN 98 7.513 4.937 -11.939 836 HB3 GLN 98 3HB GLN 98 8.600 3.593 -12.271 837 HG2 GLN 98 2HG GLN 98 9.776 5.567 -12.871 838 HG3 GLN 98 3HG GLN 98 9.308 4.796 -14.382 839 HE21 GLN 98 1HE2 GLN 98 7.629 5.769 -15.629 840 HE22 GLN 98 2HE2 GLN 98 7.188 7.424 -15.400 841 H LEU 99 H LEU 99 4.970 3.330 -11.946 842 HA LEU 99 HA LEU 99 5.530 0.710 -10.992 843 HB2 LEU 99 2HB LEU 99 3.074 2.490 -10.836 844 HB3 LEU 99 3HB LEU 99 3.042 0.853 -10.204 845 HG LEU 99 HG LEU 99 4.865 1.420 -8.605 846 HD11 LEU 99 1HD1 LEU 99 4.626 4.226 -9.691 847 HD12 LEU 99 2HD1 LEU 99 6.021 3.155 -9.835 848 HD13 LEU 99 3HD1 LEU 99 5.539 3.756 -8.250 849 HD21 LEU 99 3HD2 LEU 99 2.509 3.316 -8.448 850 HD22 LEU 99 1HD2 LEU 99 3.559 2.850 -7.105 851 HD23 LEU 99 2HD2 LEU 99 2.540 1.643 -7.886 852 H LYS 100 H LYS 100 3.178 1.958 -13.377 853 HA LYS 100 HA LYS 100 2.100 -0.580 -14.118 854 HB2 LYS 100 2HB LYS 100 2.090 2.017 -15.714 855 HB3 LYS 100 3HB LYS 100 1.043 0.619 -15.986 856 HG2 LYS 100 2HG LYS 100 0.110 0.964 -13.671 857 HG3 LYS 100 3HG LYS 100 1.050 2.458 -13.568 858 HD2 LYS 100 2HD LYS 100 -1.143 1.838 -15.588 859 HD3 LYS 100 3HD LYS 100 -1.272 2.934 -14.210 860 HE2 LYS 100 2HE LYS 100 0.378 4.437 -15.203 861 HE3 LYS 100 3HE LYS 100 0.641 3.314 -16.541 862 HZ1 LYS 100 3HZ LYS 100 -1.916 4.702 -15.936 863 HZ2 LYS 100 1HZ LYS 100 -1.657 3.636 -17.223 864 HZ3 LYS 100 2HZ LYS 100 -0.838 5.117 -17.170 865 H LYS 101 H LYS 101 4.858 1.262 -15.188 866 HA LYS 101 HA LYS 101 5.490 0.056 -17.637 867 HB2 LYS 101 2HB LYS 101 6.744 1.921 -15.823 868 HB3 LYS 101 3HB LYS 101 7.930 0.664 -16.120 869 HG2 LYS 101 2HG LYS 101 8.328 2.414 -17.681 870 HG3 LYS 101 3HG LYS 101 7.645 1.060 -18.579 871 HD2 LYS 101 2HD LYS 101 5.427 2.198 -18.574 872 HD3 LYS 101 3HD LYS 101 6.137 3.554 -17.688 873 HE2 LYS 101 2HE LYS 101 7.687 3.954 -19.609 874 HE3 LYS 101 3HE LYS 101 6.902 2.637 -20.484 875 HZ1 LYS 101 3HZ LYS 101 4.804 3.895 -20.302 876 HZ2 LYS 101 1HZ LYS 101 5.988 4.704 -21.201 877 HZ3 LYS 101 2HZ LYS 101 5.658 5.184 -19.617 878 H ASP 102 H ASP 102 6.332 -0.817 -14.304 879 HA ASP 102 HA ASP 102 7.643 -3.298 -14.856 880 HB2 ASP 102 2HB ASP 102 7.962 -2.126 -12.706 881 HB3 ASP 102 3HB ASP 102 6.248 -2.252 -12.338 882 H GLY 103 H GLY 103 4.347 -2.422 -13.851 883 HA2 GLY 103 2HA GLY 103 2.466 -3.653 -14.934 884 HA3 GLY 103 3HA GLY 103 3.321 -5.133 -14.521 885 H VAL 104 H VAL 104 3.539 -2.610 -12.225 886 HA VAL 104 HA VAL 104 2.212 -3.944 -10.118 887 HB VAL 104 HB VAL 104 2.945 -0.984 -10.374 888 HG11 VAL 104 1HG1 VAL 104 2.293 -2.550 -7.849 889 HG12 VAL 104 2HG1 VAL 104 1.309 -1.274 -8.567 890 HG13 VAL 104 3HG1 VAL 104 2.896 -0.890 -7.902 891 HG21 VAL 104 3HG2 VAL 104 4.890 -2.451 -10.647 892 HG22 VAL 104 1HG2 VAL 104 4.512 -3.259 -9.123 893 HG23 VAL 104 2HG2 VAL 104 4.984 -1.557 -9.128 894 H ASP 105 H ASP 105 0.150 -3.827 -9.374 895 HA ASP 105 HA ASP 105 -1.943 -2.543 -10.905 896 HB2 ASP 105 2HB ASP 105 -2.045 -4.047 -8.247 897 HB3 ASP 105 3HB ASP 105 -3.451 -3.532 -9.172 898 H VAL 106 H VAL 106 -1.058 -0.327 -10.596 899 HA VAL 106 HA VAL 106 -1.417 0.807 -7.905 900 HB VAL 106 HB VAL 106 0.580 1.546 -9.036 901 HG11 VAL 106 1HG1 VAL 106 -0.018 1.182 -11.348 902 HG12 VAL 106 2HG1 VAL 106 0.627 2.811 -11.115 903 HG13 VAL 106 3HG1 VAL 106 -1.111 2.569 -11.304 904 HG21 VAL 106 3HG2 VAL 106 -0.504 3.199 -7.578 905 HG22 VAL 106 1HG2 VAL 106 -1.417 3.834 -8.950 906 HG23 VAL 106 2HG2 VAL 106 0.340 3.997 -8.904 907 H ARG 107 H ARG 107 -3.292 1.521 -7.311 908 HA ARG 107 HA ARG 107 -5.387 2.176 -9.287 909 HB2 ARG 107 2HB ARG 107 -5.738 1.218 -6.407 910 HB3 ARG 107 3HB ARG 107 -7.013 1.438 -7.605 911 HG2 ARG 107 2HG ARG 107 -4.768 -0.596 -7.780 912 HG3 ARG 107 3HG ARG 107 -6.418 -0.944 -7.267 913 HD2 ARG 107 2HD ARG 107 -5.785 0.204 -10.006 914 HD3 ARG 107 3HD ARG 107 -5.786 -1.530 -9.685 915 HE ARG 107 HE ARG 107 -8.138 -1.330 -9.055 916 HH11 ARG 107 1HH1 ARG 107 -6.844 1.293 -11.021 917 HH12 ARG 107 2HH1 ARG 107 -8.400 1.743 -11.646 918 HH21 ARG 107 1HH2 ARG 107 -10.140 -0.775 -9.903 919 HH22 ARG 107 2HH2 ARG 107 -10.272 0.560 -11.004 920 H VAL 108 H VAL 108 -5.556 4.295 -9.500 921 HA VAL 108 HA VAL 108 -5.021 6.171 -7.339 922 HB VAL 108 HB VAL 108 -5.597 7.939 -9.052 923 HG11 VAL 108 1HG1 VAL 108 -3.597 7.604 -10.471 924 HG12 VAL 108 2HG1 VAL 108 -3.518 5.913 -9.969 925 HG13 VAL 108 3HG1 VAL 108 -3.271 7.196 -8.785 926 HG21 VAL 108 3HG2 VAL 108 -7.216 6.706 -10.418 927 HG22 VAL 108 1HG2 VAL 108 -5.966 5.572 -10.935 928 HG23 VAL 108 2HG2 VAL 108 -5.889 7.263 -11.436 929 H THR 109 H THR 109 -6.559 7.329 -6.260 930 HA THR 109 HA THR 109 -9.417 6.739 -6.702 931 HB THR 109 HB THR 109 -8.785 5.082 -5.064 932 HG1 THR 109 HG1 THR 109 -10.600 6.770 -4.568 933 HG21 THR 109 3HG2 THR 109 -7.647 5.547 -2.940 934 HG22 THR 109 1HG2 THR 109 -7.445 7.235 -3.420 935 HG23 THR 109 2HG2 THR 109 -6.625 5.959 -4.320 936 H ASP 110 H ASP 110 -9.362 8.886 -7.568 937 HA ASP 110 HA ASP 110 -8.483 11.187 -6.089 938 HB2 ASP 110 2HB ASP 110 -8.556 11.020 -8.585 939 HB3 ASP 110 3HB ASP 110 -10.313 11.005 -8.534 940 H ASN 111 H ASN 111 -9.635 10.600 -4.152 941 HA ASN 111 HA ASN 111 -11.589 12.197 -3.220 942 HB2 ASN 111 2HB ASN 111 -12.854 9.694 -4.375 943 HB3 ASN 111 3HB ASN 111 -13.458 10.265 -2.833 944 HD21 ASN 111 1HD2 ASN 111 -13.140 13.109 -3.448 945 HD22 ASN 111 2HD2 ASN 111 -14.354 13.491 -4.616 946 H GLU 112 H GLU 112 -10.841 12.213 -1.214 947 HA GLU 112 HA GLU 112 -9.236 10.119 -0.099 948 HB2 GLU 112 2HB GLU 112 -10.311 12.640 1.247 949 HB3 GLU 112 3HB GLU 112 -8.970 11.643 1.823 950 HG2 GLU 112 2HG GLU 112 -7.648 12.193 -0.151 951 HG3 GLU 112 3HG GLU 112 -8.991 13.082 -0.851 952 H ASP 113 H ASP 113 -12.602 10.935 0.135 953 HA ASP 113 HA ASP 113 -13.321 9.226 2.312 954 HB2 ASP 113 2HB ASP 113 -15.023 10.113 -0.067 955 HB3 ASP 113 3HB ASP 113 -15.639 9.409 1.423 956 H GLU 114 H GLU 114 -13.130 8.828 -1.211 957 HA GLU 114 HA GLU 114 -14.202 6.202 -1.360 958 HB2 GLU 114 2HB GLU 114 -14.210 7.733 -3.282 959 HB3 GLU 114 3HB GLU 114 -12.449 7.724 -3.327 960 HG2 GLU 114 2HG GLU 114 -12.544 5.251 -3.824 961 HG3 GLU 114 3HG GLU 114 -14.299 5.389 -3.922 962 H ALA 115 H ALA 115 -10.926 7.473 -1.021 963 HA ALA 115 HA ALA 115 -9.364 5.214 -1.496 964 HB1 ALA 115 3HB ALA 115 -8.893 7.426 0.545 965 HB2 ALA 115 1HB ALA 115 -8.427 7.471 -1.157 966 HB3 ALA 115 2HB ALA 115 -7.668 6.311 -0.067 967 H LYS 116 H LYS 116 -10.832 6.381 1.480 968 HA LYS 116 HA LYS 116 -10.123 4.427 3.328 969 HB2 LYS 116 2HB LYS 116 -10.996 6.554 3.983 970 HB3 LYS 116 3HB LYS 116 -12.441 6.353 3.004 971 HG2 LYS 116 2HG LYS 116 -13.205 4.563 4.568 972 HG3 LYS 116 3HG LYS 116 -11.793 4.894 5.580 973 HD2 LYS 116 2HD LYS 116 -13.960 6.900 4.858 974 HD3 LYS 116 3HD LYS 116 -13.827 6.060 6.408 975 HE2 LYS 116 2HE LYS 116 -11.615 7.162 6.771 976 HE3 LYS 116 3HE LYS 116 -11.826 8.039 5.253 977 HZ1 LYS 116 3HZ LYS 116 -13.488 8.277 7.706 978 HZ2 LYS 116 1HZ LYS 116 -13.887 8.992 6.220 979 HZ3 LYS 116 2HZ LYS 116 -12.478 9.447 7.022 980 H LYS 117 H LYS 117 -12.921 4.644 1.149 981 HA LYS 117 HA LYS 117 -14.391 2.414 2.104 982 HB2 LYS 117 2HB LYS 117 -14.436 3.772 -0.634 983 HB3 LYS 117 3HB LYS 117 -15.641 2.614 -0.075 984 HG2 LYS 117 2HG LYS 117 -16.389 4.134 1.666 985 HG3 LYS 117 3HG LYS 117 -15.066 5.243 1.327 986 HD2 LYS 117 2HD LYS 117 -17.011 6.227 0.364 987 HD3 LYS 117 3HD LYS 117 -16.073 5.594 -0.983 988 HE2 LYS 117 2HE LYS 117 -18.417 4.118 0.252 989 HE3 LYS 117 3HE LYS 117 -18.579 5.238 -1.096 990 HZ1 LYS 117 3HZ LYS 117 -17.088 3.832 -2.386 991 HZ2 LYS 117 1HZ LYS 117 -18.462 2.984 -1.880 992 HZ3 LYS 117 2HZ LYS 117 -16.983 2.737 -1.103 993 H ARG 118 H ARG 118 -12.123 2.800 -0.618 994 HA ARG 118 HA ARG 118 -12.348 0.222 -1.722 995 HB2 ARG 118 2HB ARG 118 -10.118 2.292 -1.914 996 HB3 ARG 118 3HB ARG 118 -10.093 0.782 -2.819 997 HG2 ARG 118 2HG ARG 118 -12.211 1.442 -3.946 998 HG3 ARG 118 3HG ARG 118 -12.178 2.980 -3.078 999 HD2 ARG 118 2HD ARG 118 -10.024 3.538 -4.169 1000 HD3 ARG 118 3HD ARG 118 -10.064 2.000 -5.038 1001 HE ARG 118 HE ARG 118 -12.406 3.602 -5.493 1002 HH11 ARG 118 1HH1 ARG 118 -9.074 3.153 -6.560 1003 HH12 ARG 118 2HH1 ARG 118 -9.351 3.867 -8.119 1004 HH21 ARG 118 1HH2 ARG 118 -12.732 4.593 -7.517 1005 HH22 ARG 118 2HH2 ARG 118 -11.422 4.676 -8.656 1006 H LEU 119 H LEU 119 -10.252 1.524 0.818 1007 HA LEU 119 HA LEU 119 -8.418 -0.573 1.113 1008 HB2 LEU 119 2HB LEU 119 -9.560 1.333 3.193 1009 HB3 LEU 119 3HB LEU 119 -8.235 0.226 3.531 1010 HG LEU 119 HG LEU 119 -8.193 2.519 1.544 1011 HD11 LEU 119 1HD1 LEU 119 -8.063 3.260 3.867 1012 HD12 LEU 119 2HD1 LEU 119 -6.533 3.514 3.032 1013 HD13 LEU 119 3HD1 LEU 119 -6.707 2.165 4.158 1014 HD21 LEU 119 3HD2 LEU 119 -6.019 0.512 2.190 1015 HD22 LEU 119 1HD2 LEU 119 -5.833 1.949 1.180 1016 HD23 LEU 119 2HD2 LEU 119 -6.902 0.648 0.663 1017 H LYS 120 H LYS 120 -11.526 -0.043 2.783 1018 HA LYS 120 HA LYS 120 -11.380 -2.416 4.338 1019 HB2 LYS 120 2HB LYS 120 -12.726 -0.328 4.890 1020 HB3 LYS 120 3HB LYS 120 -13.895 -0.828 3.671 1021 HG2 LYS 120 2HG LYS 120 -14.381 -2.874 4.930 1022 HG3 LYS 120 3HG LYS 120 -13.111 -2.485 6.088 1023 HD2 LYS 120 2HD LYS 120 -15.279 -1.970 7.056 1024 HD3 LYS 120 3HD LYS 120 -14.383 -0.471 6.799 1025 HE2 LYS 120 2HE LYS 120 -16.760 -0.250 6.166 1026 HE3 LYS 120 3HE LYS 120 -15.708 -0.019 4.768 1027 HZ1 LYS 120 3HZ LYS 120 -17.208 -2.490 5.456 1028 HZ2 LYS 120 1HZ LYS 120 -16.167 -2.326 4.132 1029 HZ3 LYS 120 2HZ LYS 120 -17.582 -1.406 4.215 1030 H GLU 121 H GLU 121 -12.831 -1.632 1.184 1031 HA GLU 121 HA GLU 121 -14.281 -3.948 0.609 1032 HB2 GLU 121 2HB GLU 121 -12.643 -2.185 -1.259 1033 HB3 GLU 121 3HB GLU 121 -13.728 -3.446 -1.833 1034 HG2 GLU 121 2HG GLU 121 -14.560 -1.021 -0.219 1035 HG3 GLU 121 3HG GLU 121 -14.709 -1.179 -1.966 1036 H LEU 122 H LEU 122 -10.797 -3.344 0.384 1037 HA LEU 122 HA LEU 122 -10.038 -5.688 -1.017 1038 HB2 LEU 122 2HB LEU 122 -8.408 -4.027 0.937 1039 HB3 LEU 122 3HB LEU 122 -7.741 -5.225 -0.166 1040 HG LEU 122 HG LEU 122 -9.144 -2.668 -1.001 1041 HD11 LEU 122 1HD1 LEU 122 -6.201 -3.336 -1.001 1042 HD12 LEU 122 2HD1 LEU 122 -7.023 -2.185 0.058 1043 HD13 LEU 122 3HD1 LEU 122 -6.938 -1.883 -1.671 1044 HD21 LEU 122 3HD2 LEU 122 -7.721 -4.729 -2.707 1045 HD22 LEU 122 1HD2 LEU 122 -8.355 -3.180 -3.270 1046 HD23 LEU 122 2HD2 LEU 122 -9.459 -4.415 -2.672 1047 H LEU 123 H LEU 123 -10.033 -4.925 2.473 1048 HA LEU 123 HA LEU 123 -8.863 -7.372 3.323 1049 HB2 LEU 123 2HB LEU 123 -10.325 -5.151 4.771 1050 HB3 LEU 123 3HB LEU 123 -9.885 -6.618 5.628 1051 HG LEU 123 HG LEU 123 -7.473 -6.193 5.078 1052 HD11 LEU 123 1HD1 LEU 123 -8.396 -3.507 4.046 1053 HD12 LEU 123 2HD1 LEU 123 -7.724 -4.815 3.072 1054 HD13 LEU 123 3HD1 LEU 123 -6.723 -4.023 4.288 1055 HD21 LEU 123 3HD2 LEU 123 -8.417 -5.554 7.230 1056 HD22 LEU 123 1HD2 LEU 123 -8.873 -3.975 6.585 1057 HD23 LEU 123 2HD2 LEU 123 -7.169 -4.423 6.730 1058 H GLU 124 H GLU 124 -12.207 -6.313 3.008 1059 HA GLU 124 HA GLU 124 -13.464 -8.559 4.240 1060 HB2 GLU 124 2HB GLU 124 -14.523 -6.485 2.272 1061 HB3 GLU 124 3HB GLU 124 -15.539 -7.654 3.116 1062 HG2 GLU 124 2HG GLU 124 -14.964 -6.685 5.273 1063 HG3 GLU 124 3HG GLU 124 -13.798 -5.599 4.522 1064 H LYS 125 H LYS 125 -12.173 -8.020 1.039 1065 HA LYS 125 HA LYS 125 -13.182 -10.656 0.101 1066 HB2 LYS 125 2HB LYS 125 -12.152 -8.345 -1.601 1067 HB3 LYS 125 3HB LYS 125 -12.900 -9.832 -2.186 1068 HG2 LYS 125 2HG LYS 125 -15.036 -9.173 -1.130 1069 HG3 LYS 125 3HG LYS 125 -14.278 -7.696 -0.528 1070 HD2 LYS 125 2HD LYS 125 -13.805 -7.096 -2.968 1071 HD3 LYS 125 3HD LYS 125 -14.858 -8.443 -3.416 1072 HE2 LYS 125 2HE LYS 125 -16.142 -6.392 -3.453 1073 HE3 LYS 125 3HE LYS 125 -16.696 -7.367 -2.089 1074 HZ1 LYS 125 3HZ LYS 125 -16.421 -5.061 -1.444 1075 HZ2 LYS 125 1HZ LYS 125 -14.801 -5.084 -1.933 1076 HZ3 LYS 125 2HZ LYS 125 -15.303 -6.027 -0.627 1077 H VAL 126 H VAL 126 -10.711 -9.673 1.722 1078 HA VAL 126 HA VAL 126 -8.537 -10.106 2.049 1079 HB VAL 126 HB VAL 126 -9.104 -12.653 0.476 1080 HG11 VAL 126 1HG1 VAL 126 -7.311 -13.673 1.856 1081 HG12 VAL 126 2HG1 VAL 126 -6.966 -12.097 2.573 1082 HG13 VAL 126 3HG1 VAL 126 -6.697 -12.360 0.848 1083 HG21 VAL 126 3HG2 VAL 126 -9.685 -13.677 2.650 1084 HG22 VAL 126 1HG2 VAL 126 -10.767 -12.339 2.260 1085 HG23 VAL 126 2HG2 VAL 126 -9.482 -12.116 3.450 1086 H GLY 127 H GLY 127 -7.926 -8.283 0.764 1087 HA2 GLY 127 2HA GLY 127 -6.294 -7.292 -0.483 1088 HA3 GLY 127 3HA GLY 127 -5.689 -8.891 -0.869 1089 H SER 128 H SER 128 -8.972 -7.848 -1.708 1090 HA SER 128 HA SER 128 -8.304 -7.083 -4.421 1091 HB2 SER 128 2HB SER 128 -9.622 -8.913 -5.513 1092 HB3 SER 128 3HB SER 128 -8.210 -9.532 -4.658 1093 HG SER 128 HG SER 128 -9.972 -9.682 -2.848 1094 H LEU 129 H LEU 129 -10.275 -6.580 -5.703 1095 HA LEU 129 HA LEU 129 -12.798 -6.230 -4.304 1096 HB2 LEU 129 2HB LEU 129 -12.985 -3.869 -4.507 1097 HB3 LEU 129 3HB LEU 129 -11.414 -4.139 -3.784 1098 HG LEU 129 HG LEU 129 -11.879 -3.444 -6.722 1099 HD11 LEU 129 1HD1 LEU 129 -11.022 -1.206 -6.196 1100 HD12 LEU 129 2HD1 LEU 129 -10.893 -1.634 -4.488 1101 HD13 LEU 129 3HD1 LEU 129 -12.476 -1.558 -5.262 1102 HD21 LEU 129 3HD2 LEU 129 -9.803 -4.728 -6.403 1103 HD22 LEU 129 1HD2 LEU 129 -9.261 -3.580 -5.180 1104 HD23 LEU 129 2HD2 LEU 129 -9.453 -3.063 -6.858 1105 H GLU 130 H GLU 130 -14.502 -5.444 -5.848 1106 HA GLU 130 HA GLU 130 -14.212 -6.694 -8.448 1107 HB2 GLU 130 2HB GLU 130 -16.550 -5.275 -7.113 1108 HB3 GLU 130 3HB GLU 130 -16.637 -5.991 -8.722 1109 HG2 GLU 130 2HG GLU 130 -16.020 -7.489 -6.164 1110 HG3 GLU 130 3HG GLU 130 -17.585 -7.457 -6.974 1111 H HIS 131 H HIS 131 -14.881 -5.640 -10.428 1112 HA HIS 131 HA HIS 131 -13.664 -3.015 -10.782 1113 HB2 HIS 131 2HB HIS 131 -14.984 -4.816 -12.872 1114 HB3 HIS 131 3HB HIS 131 -13.946 -3.433 -13.190 1115 HD1 HIS 131 HD1 HIS 131 -13.787 -6.891 -13.369 1116 HD2 HIS 131 HD2 HIS 131 -11.236 -4.061 -11.718 1117 HE1 HIS 131 HE1 HIS 131 -11.548 -8.014 -13.223 1118 HE2 HIS 131 HE2 HIS 131 -10.008 -6.249 -12.320 1119 H HIS 132 H HIS 132 -15.276 -1.969 -9.406 1120 HA HIS 132 HA HIS 132 -17.988 -1.641 -10.487 1121 HB2 HIS 132 2HB HIS 132 -17.581 -1.957 -8.012 1122 HB3 HIS 132 3HB HIS 132 -16.733 -0.417 -7.986 1123 HD1 HIS 132 HD1 HIS 132 -18.343 0.739 -6.432 1124 HD2 HIS 132 HD2 HIS 132 -20.233 -0.835 -9.770 1125 HE1 HIS 132 HE1 HIS 132 -20.701 1.597 -6.328 1126 HE2 HIS 132 HE2 HIS 132 -21.728 0.828 -8.494 1127 H HIS 133 H HIS 133 -17.739 -0.462 -12.325 1128 HA HIS 133 HA HIS 133 -17.113 2.371 -12.111 1129 HB2 HIS 133 2HB HIS 133 -14.897 1.461 -12.639 1130 HB3 HIS 133 3HB HIS 133 -15.554 0.511 -13.964 1131 HD1 HIS 133 HD1 HIS 133 -14.563 1.512 -15.998 1132 HD2 HIS 133 HD2 HIS 133 -15.909 4.445 -13.389 1133 HE1 HIS 133 HE1 HIS 133 -14.203 3.688 -17.182 1134 HE2 HIS 133 HE2 HIS 133 -14.909 5.443 -15.542 1135 H HIS 134 H HIS 134 -18.746 3.329 -13.089 1136 HA HIS 134 HA HIS 134 -20.716 2.029 -14.599 1137 HB2 HIS 134 2HB HIS 134 -21.726 4.251 -14.922 1138 HB3 HIS 134 3HB HIS 134 -21.187 4.046 -13.263 1139 HD1 HIS 134 HD1 HIS 134 -21.168 6.437 -15.903 1140 HD2 HIS 134 HD2 HIS 134 -18.507 5.422 -12.878 1141 HE1 HIS 134 HE1 HIS 134 -19.664 8.424 -15.635 1142 HE2 HIS 134 HE2 HIS 134 -17.929 7.675 -13.990 1143 H HIS 135 H HIS 135 -21.091 1.761 -16.730 1144 HA HIS 135 HA HIS 135 -19.687 3.265 -18.793 1145 HB2 HIS 135 2HB HIS 135 -18.972 1.165 -20.023 1146 HB3 HIS 135 3HB HIS 135 -18.073 1.473 -18.541 1147 HD1 HIS 135 HD1 HIS 135 -18.888 -0.007 -16.421 1148 HD2 HIS 135 HD2 HIS 135 -20.051 -1.370 -20.169 1149 HE1 HIS 135 HE1 HIS 135 -19.587 -2.382 -16.079 1150 HE2 HIS 135 HE2 HIS 135 -20.303 -3.185 -18.353 1151 H HIS 136 H HIS 136 -21.375 3.989 -19.911 1152 HA HIS 136 HA HIS 136 -23.319 2.135 -21.067 1153 HB2 HIS 136 2HB HIS 136 -24.411 2.882 -18.949 1154 HB3 HIS 136 3HB HIS 136 -24.213 4.563 -19.433 1155 HD1 HIS 136 HD1 HIS 136 -26.472 5.410 -20.052 1156 HD2 HIS 136 HD2 HIS 136 -25.872 1.542 -21.454 1157 HE1 HIS 136 HE1 HIS 136 -28.533 4.841 -21.369 1158 HE2 HIS 136 HE2 HIS 136 -28.051 2.576 -22.358 Start of MODEL 8 1 H1 MET 1 1H MET 1 -1.390 -17.135 -1.365 2 H2 MET 1 2H MET 1 -1.758 -15.969 -2.526 3 H3 MET 1 3H MET 1 -2.924 -17.106 -2.077 4 HA MET 1 HA MET 1 -3.407 -14.992 -1.090 5 HB2 MET 1 2HB MET 1 -2.333 -16.884 1.049 6 HB3 MET 1 3HB MET 1 -3.623 -15.710 1.241 7 HG2 MET 1 2HG MET 1 -5.047 -17.033 -0.270 8 HG3 MET 1 3HG MET 1 -3.745 -18.202 -0.472 9 HE1 MET 1 3HE MET 1 -3.482 -19.634 3.235 10 HE2 MET 1 1HE MET 1 -2.620 -18.200 2.671 11 HE3 MET 1 2HE MET 1 -2.738 -19.630 1.640 12 H GLY 2 H GLY 2 -1.836 -13.441 -1.771 13 HA2 GLY 2 2HA GLY 2 -0.125 -12.430 0.299 14 HA3 GLY 2 3HA GLY 2 0.791 -13.171 -1.010 15 H THR 3 H THR 3 -1.681 -10.740 -0.311 16 HA THR 3 HA THR 3 -0.859 -9.188 -2.696 17 HB THR 3 HB THR 3 -2.933 -7.855 -2.293 18 HG1 THR 3 HG1 THR 3 -3.805 -9.755 -0.409 19 HG21 THR 3 3HG2 THR 3 -3.109 -9.787 -3.815 20 HG22 THR 3 1HG2 THR 3 -4.602 -9.587 -2.901 21 HG23 THR 3 2HG2 THR 3 -3.462 -10.858 -2.455 22 H VAL 4 H VAL 4 -0.149 -7.063 -2.420 23 HA VAL 4 HA VAL 4 0.522 -6.168 0.332 24 HB VAL 4 HB VAL 4 2.291 -5.792 -2.164 25 HG11 VAL 4 1HG1 VAL 4 3.997 -4.923 -0.598 26 HG12 VAL 4 2HG1 VAL 4 2.869 -5.106 0.747 27 HG13 VAL 4 3HG1 VAL 4 2.524 -3.953 -0.541 28 HG21 VAL 4 3HG2 VAL 4 2.309 -8.157 -1.466 29 HG22 VAL 4 1HG2 VAL 4 2.761 -7.682 0.173 30 HG23 VAL 4 2HG2 VAL 4 3.875 -7.400 -1.168 31 H VAL 5 H VAL 5 -0.671 -4.363 0.672 32 HA VAL 5 HA VAL 5 -1.327 -2.626 -1.642 33 HB VAL 5 HB VAL 5 -3.487 -2.047 -0.434 34 HG11 VAL 5 1HG1 VAL 5 -3.186 -4.944 -1.317 35 HG12 VAL 5 2HG1 VAL 5 -3.451 -3.560 -2.377 36 HG13 VAL 5 3HG1 VAL 5 -4.704 -4.040 -1.234 37 HG21 VAL 5 3HG2 VAL 5 -2.924 -2.858 1.830 38 HG22 VAL 5 1HG2 VAL 5 -2.869 -4.518 1.236 39 HG23 VAL 5 2HG2 VAL 5 -4.394 -3.626 1.233 40 H ILE 6 H ILE 6 -0.324 -0.774 -1.534 41 HA ILE 6 HA ILE 6 0.674 0.243 1.059 42 HB ILE 6 HB ILE 6 1.655 0.999 -1.737 43 HG12 ILE 6 2HG1 ILE 6 3.799 -0.336 -0.906 44 HG13 ILE 6 3HG1 ILE 6 2.671 -1.149 0.165 45 HG21 ILE 6 1HG2 ILE 6 2.834 1.603 1.002 46 HG22 ILE 6 2HG2 ILE 6 2.053 2.762 -0.077 47 HG23 ILE 6 3HG2 ILE 6 3.581 2.016 -0.542 48 HD11 ILE 6 3HD1 ILE 6 1.407 -1.941 -1.789 49 HD12 ILE 6 1HD1 ILE 6 3.097 -2.449 -1.840 50 HD13 ILE 6 2HD1 ILE 6 2.547 -1.115 -2.854 51 H VAL 7 H VAL 7 -0.698 1.725 1.866 52 HA VAL 7 HA VAL 7 -2.391 3.376 0.145 53 HB VAL 7 HB VAL 7 -2.256 3.381 3.200 54 HG11 VAL 7 1HG1 VAL 7 -4.466 4.300 1.312 55 HG12 VAL 7 2HG1 VAL 7 -3.401 5.345 2.256 56 HG13 VAL 7 3HG1 VAL 7 -4.551 4.291 3.076 57 HG21 VAL 7 3HG2 VAL 7 -4.135 1.793 3.181 58 HG22 VAL 7 1HG2 VAL 7 -2.694 1.100 2.431 59 HG23 VAL 7 2HG2 VAL 7 -4.026 1.671 1.423 60 H VAL 8 H VAL 8 -1.744 5.310 -0.477 61 HA VAL 8 HA VAL 8 0.345 6.790 0.972 62 HB VAL 8 HB VAL 8 0.119 6.626 -2.076 63 HG11 VAL 8 1HG1 VAL 8 2.274 7.825 -2.091 64 HG12 VAL 8 2HG1 VAL 8 2.260 7.909 -0.330 65 HG13 VAL 8 3HG1 VAL 8 1.034 8.767 -1.264 66 HG21 VAL 8 3HG2 VAL 8 0.886 4.459 -1.208 67 HG22 VAL 8 1HG2 VAL 8 2.162 5.258 -0.284 68 HG23 VAL 8 2HG2 VAL 8 2.197 5.289 -2.048 69 H SER 9 H SER 9 0.005 8.911 1.190 70 HA SER 9 HA SER 9 -1.567 10.500 -0.610 71 HB2 SER 9 2HB SER 9 -3.396 9.632 0.838 72 HB3 SER 9 3HB SER 9 -2.545 10.213 2.266 73 HG SER 9 HG SER 9 -4.303 11.552 1.081 74 H ASN 10 H ASN 10 -1.047 12.679 -0.413 75 HA ASN 10 HA ASN 10 1.404 13.354 0.888 76 HB2 ASN 10 2HB ASN 10 0.661 14.417 -1.245 77 HB3 ASN 10 3HB ASN 10 -0.661 15.207 -0.391 78 HD21 ASN 10 1HD2 ASN 10 0.009 17.300 -0.773 79 HD22 ASN 10 2HD2 ASN 10 1.465 17.983 -0.143 80 H ASP 11 H ASP 11 -2.015 13.880 1.613 81 HA ASP 11 HA ASP 11 -1.472 15.436 4.016 82 HB2 ASP 11 2HB ASP 11 -3.592 15.696 2.540 83 HB3 ASP 11 3HB ASP 11 -4.148 14.186 3.255 84 H GLU 12 H GLU 12 -1.056 14.528 5.912 85 HA GLU 12 HA GLU 12 -0.742 11.647 6.061 86 HB2 GLU 12 2HB GLU 12 1.043 13.294 6.697 87 HB3 GLU 12 3HB GLU 12 0.054 13.787 8.064 88 HG2 GLU 12 2HG GLU 12 0.201 11.474 8.971 89 HG3 GLU 12 3HG GLU 12 1.242 11.030 7.615 90 H ARG 13 H ARG 13 -2.985 14.017 7.243 91 HA ARG 13 HA ARG 13 -4.034 12.525 9.485 92 HB2 ARG 13 2HB ARG 13 -5.340 14.719 7.832 93 HB3 ARG 13 3HB ARG 13 -5.939 14.100 9.374 94 HG2 ARG 13 2HG ARG 13 -4.066 15.021 10.572 95 HG3 ARG 13 3HG ARG 13 -3.223 15.425 9.071 96 HD2 ARG 13 2HD ARG 13 -5.822 16.672 10.039 97 HD3 ARG 13 3HD ARG 13 -4.228 17.432 10.064 98 HE ARG 13 HE ARG 13 -5.055 16.562 7.430 99 HH11 ARG 13 1HH1 ARG 13 -5.245 19.240 9.721 100 HH12 ARG 13 2HH1 ARG 13 -5.568 20.420 8.486 101 HH21 ARG 13 1HH2 ARG 13 -5.502 18.092 5.845 102 HH22 ARG 13 2HH2 ARG 13 -5.718 19.767 6.278 103 H ILE 14 H ILE 14 -4.738 12.804 6.057 104 HA ILE 14 HA ILE 14 -6.971 11.097 5.874 105 HB ILE 14 HB ILE 14 -4.793 11.978 3.954 106 HG12 ILE 14 2HG1 ILE 14 -6.610 12.995 2.693 107 HG13 ILE 14 3HG1 ILE 14 -7.820 12.131 3.623 108 HG21 ILE 14 1HG2 ILE 14 -6.799 9.808 3.242 109 HG22 ILE 14 2HG2 ILE 14 -5.046 9.630 3.320 110 HG23 ILE 14 3HG2 ILE 14 -5.771 10.660 2.085 111 HD11 ILE 14 3HD1 ILE 14 -7.277 13.507 5.578 112 HD12 ILE 14 1HD1 ILE 14 -7.772 14.474 4.188 113 HD13 ILE 14 2HD1 ILE 14 -6.070 14.362 4.623 114 H LEU 15 H LEU 15 -3.453 10.441 5.843 115 HA LEU 15 HA LEU 15 -3.592 7.625 5.587 116 HB2 LEU 15 2HB LEU 15 -1.466 9.393 6.836 117 HB3 LEU 15 3HB LEU 15 -1.254 7.671 6.556 118 HG LEU 15 HG LEU 15 -1.779 9.704 4.356 119 HD11 LEU 15 1HD1 LEU 15 0.391 10.106 5.421 120 HD12 LEU 15 2HD1 LEU 15 0.585 9.493 3.782 121 HD13 LEU 15 3HD1 LEU 15 0.851 8.420 5.159 122 HD21 LEU 15 3HD2 LEU 15 -1.018 6.758 4.200 123 HD22 LEU 15 1HD2 LEU 15 -1.134 7.864 2.827 124 HD23 LEU 15 2HD2 LEU 15 -2.574 7.466 3.761 125 H GLU 16 H GLU 16 -3.684 9.736 8.443 126 HA GLU 16 HA GLU 16 -3.436 7.687 10.418 127 HB2 GLU 16 2HB GLU 16 -4.480 10.551 10.582 128 HB3 GLU 16 3HB GLU 16 -4.343 9.496 11.988 129 HG2 GLU 16 2HG GLU 16 -1.911 9.316 11.641 130 HG3 GLU 16 3HG GLU 16 -2.037 10.349 10.217 131 H GLU 17 H GLU 17 -6.260 9.478 9.155 132 HA GLU 17 HA GLU 17 -8.253 8.190 10.687 133 HB2 GLU 17 2HB GLU 17 -8.597 10.346 9.534 134 HB3 GLU 17 3HB GLU 17 -8.441 9.560 7.965 135 HG2 GLU 17 2HG GLU 17 -10.493 8.270 8.391 136 HG3 GLU 17 3HG GLU 17 -10.645 9.015 9.985 137 H LEU 18 H LEU 18 -7.052 7.588 7.392 138 HA LEU 18 HA LEU 18 -8.753 5.379 6.802 139 HB2 LEU 18 2HB LEU 18 -6.325 6.596 5.494 140 HB3 LEU 18 3HB LEU 18 -6.830 4.998 4.984 141 HG LEU 18 HG LEU 18 -9.020 5.861 4.261 142 HD11 LEU 18 1HD1 LEU 18 -9.357 7.667 5.880 143 HD12 LEU 18 2HD1 LEU 18 -9.586 8.228 4.226 144 HD13 LEU 18 3HD1 LEU 18 -8.099 8.623 5.091 145 HD21 LEU 18 3HD2 LEU 18 -8.283 7.203 2.338 146 HD22 LEU 18 1HD2 LEU 18 -7.183 5.857 2.638 147 HD23 LEU 18 2HD2 LEU 18 -6.727 7.492 3.121 148 H LEU 19 H LEU 19 -5.588 5.662 8.335 149 HA LEU 19 HA LEU 19 -4.705 3.011 8.367 150 HB2 LEU 19 2HB LEU 19 -3.366 4.906 9.252 151 HB3 LEU 19 3HB LEU 19 -4.502 5.103 10.571 152 HG LEU 19 HG LEU 19 -3.828 2.658 11.232 153 HD11 LEU 19 1HD1 LEU 19 -1.543 1.996 10.626 154 HD12 LEU 19 2HD1 LEU 19 -1.446 3.340 9.487 155 HD13 LEU 19 3HD1 LEU 19 -2.614 2.040 9.229 156 HD21 LEU 19 3HD2 LEU 19 -3.317 4.593 12.602 157 HD22 LEU 19 1HD2 LEU 19 -1.883 4.946 11.633 158 HD23 LEU 19 2HD2 LEU 19 -1.962 3.470 12.600 159 H GLU 20 H GLU 20 -6.758 4.751 10.617 160 HA GLU 20 HA GLU 20 -7.205 2.661 12.446 161 HB2 GLU 20 2HB GLU 20 -8.815 5.187 11.931 162 HB3 GLU 20 3HB GLU 20 -8.937 4.173 13.373 163 HG2 GLU 20 2HG GLU 20 -6.629 4.684 13.994 164 HG3 GLU 20 3HG GLU 20 -6.394 5.578 12.485 165 H VAL 21 H VAL 21 -8.955 3.640 9.527 166 HA VAL 21 HA VAL 21 -11.315 2.121 9.829 167 HB VAL 21 HB VAL 21 -9.822 2.823 7.247 168 HG11 VAL 21 1HG1 VAL 21 -11.977 2.452 6.057 169 HG12 VAL 21 2HG1 VAL 21 -12.692 1.847 7.553 170 HG13 VAL 21 3HG1 VAL 21 -11.366 0.968 6.794 171 HG21 VAL 21 3HG2 VAL 21 -11.432 4.677 7.040 172 HG22 VAL 21 1HG2 VAL 21 -10.493 4.808 8.528 173 HG23 VAL 21 2HG2 VAL 21 -12.160 4.229 8.584 174 H VAL 22 H VAL 22 -8.148 1.285 8.439 175 HA VAL 22 HA VAL 22 -8.815 -1.394 7.671 176 HB VAL 22 HB VAL 22 -6.011 -0.256 8.116 177 HG11 VAL 22 1HG1 VAL 22 -6.076 -2.698 7.778 178 HG12 VAL 22 2HG1 VAL 22 -5.316 -1.894 6.406 179 HG13 VAL 22 3HG1 VAL 22 -6.975 -2.480 6.275 180 HG21 VAL 22 3HG2 VAL 22 -7.692 -0.083 5.589 181 HG22 VAL 22 1HG2 VAL 22 -6.010 0.431 5.750 182 HG23 VAL 22 2HG2 VAL 22 -7.278 1.262 6.648 183 H LEU 23 H LEU 23 -7.246 0.093 10.519 184 HA LEU 23 HA LEU 23 -6.357 -2.232 11.836 185 HB2 LEU 23 2HB LEU 23 -6.826 0.614 12.640 186 HB3 LEU 23 3HB LEU 23 -6.782 -0.545 13.951 187 HG LEU 23 HG LEU 23 -4.511 -1.265 13.246 188 HD11 LEU 23 1HD1 LEU 23 -4.612 -0.789 10.868 189 HD12 LEU 23 2HD1 LEU 23 -3.224 0.003 11.607 190 HD13 LEU 23 3HD1 LEU 23 -4.658 0.945 11.198 191 HD21 LEU 23 3HD2 LEU 23 -3.300 0.739 13.999 192 HD22 LEU 23 1HD2 LEU 23 -4.740 0.451 14.974 193 HD23 LEU 23 2HD2 LEU 23 -4.748 1.717 13.743 194 H LYS 24 H LYS 24 -9.434 -0.444 12.253 195 HA LYS 24 HA LYS 24 -10.379 -2.229 14.318 196 HB2 LYS 24 2HB LYS 24 -12.455 -0.881 14.295 197 HB3 LYS 24 3HB LYS 24 -11.022 0.123 14.397 198 HG2 LYS 24 2HG LYS 24 -12.326 1.335 12.920 199 HG3 LYS 24 3HG LYS 24 -11.317 0.404 11.813 200 HD2 LYS 24 2HD LYS 24 -13.168 -1.193 11.468 201 HD3 LYS 24 3HD LYS 24 -14.174 -0.290 12.602 202 HE2 LYS 24 2HE LYS 24 -13.054 0.847 10.016 203 HE3 LYS 24 3HE LYS 24 -14.686 0.209 10.207 204 HZ1 LYS 24 3HZ LYS 24 -15.140 1.899 11.846 205 HZ2 LYS 24 1HZ LYS 24 -14.617 2.613 10.406 206 HZ3 LYS 24 2HZ LYS 24 -13.564 2.494 11.723 207 H SER 25 H SER 25 -10.726 -2.025 10.833 208 HA SER 25 HA SER 25 -12.896 -3.852 10.540 209 HB2 SER 25 2HB SER 25 -12.202 -2.288 8.735 210 HB3 SER 25 3HB SER 25 -10.686 -3.167 8.544 211 HG SER 25 HG SER 25 -13.292 -4.257 8.167 212 H ASP 26 H ASP 26 -9.343 -4.211 10.568 213 HA ASP 26 HA ASP 26 -9.506 -6.771 11.797 214 HB2 ASP 26 2HB ASP 26 -9.969 -7.407 9.388 215 HB3 ASP 26 3HB ASP 26 -8.356 -6.832 8.973 216 HA PRO 27 HA PRO 27 -5.440 -4.860 12.836 217 HB2 PRO 27 2HB PRO 27 -5.269 -5.781 15.383 218 HB3 PRO 27 3HB PRO 27 -6.385 -4.470 14.952 219 HG2 PRO 27 2HG PRO 27 -6.983 -7.389 15.331 220 HG3 PRO 27 3HG PRO 27 -7.872 -5.975 15.943 221 HD2 PRO 27 2HD PRO 27 -8.621 -7.355 13.688 222 HD3 PRO 27 3HD PRO 27 -8.970 -5.631 13.935 223 H ASN 28 H ASN 28 -6.312 -8.059 12.239 224 HA ASN 28 HA ASN 28 -3.906 -9.411 13.099 225 HB2 ASN 28 2HB ASN 28 -6.228 -10.418 13.003 226 HB3 ASN 28 3HB ASN 28 -6.136 -10.378 11.249 227 HD21 ASN 28 1HD2 ASN 28 -6.513 -12.631 13.003 228 HD22 ASN 28 2HD2 ASN 28 -5.221 -13.725 12.687 229 H VAL 29 H VAL 29 -5.193 -8.043 10.099 230 HA VAL 29 HA VAL 29 -3.092 -8.755 8.328 231 HB VAL 29 HB VAL 29 -5.018 -6.375 8.329 232 HG11 VAL 29 1HG1 VAL 29 -3.107 -7.183 6.108 233 HG12 VAL 29 2HG1 VAL 29 -3.042 -5.696 7.053 234 HG13 VAL 29 3HG1 VAL 29 -4.393 -5.982 5.958 235 HG21 VAL 29 3HG2 VAL 29 -4.998 -8.911 6.656 236 HG22 VAL 29 1HG2 VAL 29 -6.186 -7.608 6.544 237 HG23 VAL 29 2HG2 VAL 29 -6.072 -8.579 8.011 238 H LYS 30 H LYS 30 -1.091 -7.787 7.929 239 HA LYS 30 HA LYS 30 0.130 -6.288 10.042 240 HB2 LYS 30 2HB LYS 30 1.182 -7.149 7.320 241 HB3 LYS 30 3HB LYS 30 2.174 -6.316 8.510 242 HG2 LYS 30 2HG LYS 30 0.840 -9.008 8.909 243 HG3 LYS 30 3HG LYS 30 2.536 -8.765 8.504 244 HD2 LYS 30 2HD LYS 30 1.207 -7.735 11.033 245 HD3 LYS 30 3HD LYS 30 2.135 -9.227 10.923 246 HE2 LYS 30 2HE LYS 30 4.142 -7.922 10.265 247 HE3 LYS 30 3HE LYS 30 3.207 -6.429 10.414 248 HZ1 LYS 30 3HZ LYS 30 2.846 -6.946 12.754 249 HZ2 LYS 30 1HZ LYS 30 4.494 -6.836 12.400 250 HZ3 LYS 30 2HZ LYS 30 3.776 -8.349 12.608 251 H THR 31 H THR 31 -1.040 -4.407 10.145 252 HA THR 31 HA THR 31 -1.015 -2.480 7.927 253 HB THR 31 HB THR 31 -2.536 -1.186 9.483 254 HG1 THR 31 HG1 THR 31 -2.900 -3.522 11.007 255 HG21 THR 31 3HG2 THR 31 -4.482 -2.695 9.222 256 HG22 THR 31 1HG2 THR 31 -3.393 -4.032 8.833 257 HG23 THR 31 2HG2 THR 31 -3.507 -2.636 7.752 258 H VAL 32 H VAL 32 1.051 -1.738 7.880 259 HA VAL 32 HA VAL 32 2.306 -0.683 10.354 260 HB VAL 32 HB VAL 32 3.670 -2.271 8.120 261 HG11 VAL 32 1HG1 VAL 32 5.166 -0.581 9.098 262 HG12 VAL 32 2HG1 VAL 32 5.688 -2.207 9.539 263 HG13 VAL 32 3HG1 VAL 32 4.837 -1.205 10.716 264 HG21 VAL 32 3HG2 VAL 32 4.018 -4.067 9.799 265 HG22 VAL 32 1HG2 VAL 32 2.302 -3.766 9.503 266 HG23 VAL 32 2HG2 VAL 32 3.065 -3.148 10.968 267 H ARG 33 H ARG 33 2.518 1.479 10.080 268 HA ARG 33 HA ARG 33 3.016 2.740 7.497 269 HB2 ARG 33 2HB ARG 33 1.618 3.830 9.307 270 HB3 ARG 33 3HB ARG 33 3.055 3.978 10.301 271 HG2 ARG 33 2HG ARG 33 3.412 5.208 7.628 272 HG3 ARG 33 3HG ARG 33 2.063 5.907 8.514 273 HD2 ARG 33 2HD ARG 33 4.025 7.233 8.937 274 HD3 ARG 33 3HD ARG 33 3.618 6.372 10.416 275 HE ARG 33 HE ARG 33 5.527 5.036 10.167 276 HH11 ARG 33 1HH1 ARG 33 5.380 7.435 7.566 277 HH12 ARG 33 2HH1 ARG 33 7.053 7.227 7.141 278 HH21 ARG 33 1HH2 ARG 33 7.691 4.794 9.576 279 HH22 ARG 33 2HH2 ARG 33 8.351 5.742 8.273 280 H THR 34 H THR 34 5.012 2.176 6.719 281 HA THR 34 HA THR 34 7.422 2.923 8.161 282 HB THR 34 HB THR 34 6.783 0.009 7.517 283 HG1 THR 34 HG1 THR 34 6.821 1.448 9.761 284 HG21 THR 34 3HG2 THR 34 9.107 -0.574 8.103 285 HG22 THR 34 1HG2 THR 34 9.514 1.144 8.186 286 HG23 THR 34 2HG2 THR 34 9.051 0.419 6.647 287 H ASP 35 H ASP 35 8.516 4.048 6.674 288 HA ASP 35 HA ASP 35 8.355 3.403 3.806 289 HB2 ASP 35 2HB ASP 35 9.467 5.593 3.454 290 HB3 ASP 35 3HB ASP 35 8.011 5.754 4.434 291 H ASP 36 H ASP 36 10.220 2.485 6.373 292 HA ASP 36 HA ASP 36 12.811 2.300 5.211 293 HB2 ASP 36 2HB ASP 36 11.587 0.519 7.367 294 HB3 ASP 36 3HB ASP 36 13.297 0.667 7.001 295 H LYS 37 H LYS 37 12.742 1.472 3.212 296 HA LYS 37 HA LYS 37 11.120 -0.405 2.051 297 HB2 LYS 37 2HB LYS 37 13.126 -0.682 0.368 298 HB3 LYS 37 3HB LYS 37 12.346 0.884 0.542 299 HG2 LYS 37 2HG LYS 37 14.148 1.576 2.123 300 HG3 LYS 37 3HG LYS 37 14.970 0.047 1.820 301 HD2 LYS 37 2HD LYS 37 15.596 0.660 -0.353 302 HD3 LYS 37 3HD LYS 37 14.276 1.819 -0.528 303 HE2 LYS 37 2HE LYS 37 16.524 2.896 -0.335 304 HE3 LYS 37 3HE LYS 37 15.395 3.409 0.920 305 HZ1 LYS 37 3HZ LYS 37 16.481 1.792 2.416 306 HZ2 LYS 37 1HZ LYS 37 17.522 3.011 1.880 307 HZ3 LYS 37 2HZ LYS 37 17.624 1.466 1.212 308 H GLU 38 H GLU 38 14.189 -1.066 3.650 309 HA GLU 38 HA GLU 38 14.249 -3.882 3.017 310 HB2 GLU 38 2HB GLU 38 16.270 -3.995 4.449 311 HB3 GLU 38 3HB GLU 38 16.376 -2.723 3.249 312 HG2 GLU 38 2HG GLU 38 15.696 -2.258 6.160 313 HG3 GLU 38 3HG GLU 38 17.317 -2.124 5.488 314 H LYS 39 H LYS 39 13.163 -1.958 5.789 315 HA LYS 39 HA LYS 39 12.848 -4.101 7.648 316 HB2 LYS 39 2HB LYS 39 12.901 -1.833 8.480 317 HB3 LYS 39 3HB LYS 39 11.514 -1.371 7.499 318 HG2 LYS 39 2HG LYS 39 10.026 -2.736 8.858 319 HG3 LYS 39 3HG LYS 39 11.389 -3.391 9.770 320 HD2 LYS 39 2HD LYS 39 11.835 -1.214 10.783 321 HD3 LYS 39 3HD LYS 39 10.638 -0.438 9.744 322 HE2 LYS 39 2HE LYS 39 9.964 -2.567 11.803 323 HE3 LYS 39 3HE LYS 39 9.847 -0.832 12.089 324 HZ1 LYS 39 3HZ LYS 39 8.365 -2.313 9.989 325 HZ2 LYS 39 1HZ LYS 39 8.235 -0.661 10.320 326 HZ3 LYS 39 2HZ LYS 39 7.723 -1.794 11.460 327 H VAL 40 H VAL 40 10.612 -2.544 5.377 328 HA VAL 40 HA VAL 40 8.254 -3.894 5.987 329 HB VAL 40 HB VAL 40 9.150 -2.786 3.284 330 HG11 VAL 40 1HG1 VAL 40 7.327 -4.393 2.914 331 HG12 VAL 40 2HG1 VAL 40 6.743 -2.751 2.654 332 HG13 VAL 40 3HG1 VAL 40 6.341 -3.602 4.148 333 HG21 VAL 40 3HG2 VAL 40 7.795 -0.817 3.868 334 HG22 VAL 40 1HG2 VAL 40 9.047 -1.093 5.079 335 HG23 VAL 40 2HG2 VAL 40 7.375 -1.545 5.421 336 H LYS 41 H LYS 41 10.931 -4.839 3.878 337 HA LYS 41 HA LYS 41 9.815 -7.024 2.526 338 HB2 LYS 41 2HB LYS 41 12.693 -6.493 3.369 339 HB3 LYS 41 3HB LYS 41 12.220 -7.766 2.245 340 HG2 LYS 41 2HG LYS 41 11.350 -6.106 0.669 341 HG3 LYS 41 3HG LYS 41 11.731 -4.807 1.800 342 HD2 LYS 41 2HD LYS 41 14.127 -5.252 1.582 343 HD3 LYS 41 3HD LYS 41 13.805 -6.667 0.573 344 HE2 LYS 41 2HE LYS 41 14.505 -4.741 -0.790 345 HE3 LYS 41 3HE LYS 41 12.847 -5.213 -1.175 346 HZ1 LYS 41 3HZ LYS 41 13.091 -2.822 -0.997 347 HZ2 LYS 41 1HZ LYS 41 13.645 -2.966 0.592 348 HZ3 LYS 41 2HZ LYS 41 12.054 -3.401 0.203 349 H GLU 42 H GLU 42 11.206 -6.820 5.733 350 HA GLU 42 HA GLU 42 11.362 -9.638 6.285 351 HB2 GLU 42 2HB GLU 42 12.751 -7.833 7.380 352 HB3 GLU 42 3HB GLU 42 11.312 -7.290 8.234 353 HG2 GLU 42 2HG GLU 42 11.159 -9.511 9.334 354 HG3 GLU 42 3HG GLU 42 12.635 -10.003 8.499 355 H GLU 43 H GLU 43 9.048 -7.054 6.900 356 HA GLU 43 HA GLU 43 7.234 -8.598 8.528 357 HB2 GLU 43 2HB GLU 43 6.819 -5.906 7.169 358 HB3 GLU 43 3HB GLU 43 5.843 -6.575 8.476 359 HG2 GLU 43 2HG GLU 43 7.754 -6.474 10.012 360 HG3 GLU 43 3HG GLU 43 8.797 -5.903 8.708 361 H ILE 44 H ILE 44 7.606 -7.899 5.152 362 HA ILE 44 HA ILE 44 5.139 -8.609 4.040 363 HB ILE 44 HB ILE 44 7.994 -8.492 3.037 364 HG12 ILE 44 2HG1 ILE 44 5.425 -7.175 2.037 365 HG13 ILE 44 3HG1 ILE 44 6.653 -6.418 3.046 366 HG21 ILE 44 1HG2 ILE 44 5.830 -9.750 1.335 367 HG22 ILE 44 2HG2 ILE 44 7.255 -10.565 1.979 368 HG23 ILE 44 3HG2 ILE 44 7.439 -9.285 0.779 369 HD11 ILE 44 3HD1 ILE 44 8.272 -6.694 1.175 370 HD12 ILE 44 1HD1 ILE 44 6.904 -5.640 0.808 371 HD13 ILE 44 2HD1 ILE 44 6.942 -7.283 0.171 372 H GLU 45 H GLU 45 8.041 -10.553 4.729 373 HA GLU 45 HA GLU 45 7.279 -13.060 3.827 374 HB2 GLU 45 2HB GLU 45 9.571 -12.539 4.544 375 HB3 GLU 45 3HB GLU 45 9.033 -12.313 6.206 376 HG2 GLU 45 2HG GLU 45 8.347 -14.735 6.242 377 HG3 GLU 45 3HG GLU 45 9.072 -14.918 4.646 378 H LYS 46 H LYS 46 6.834 -11.579 7.007 379 HA LYS 46 HA LYS 46 5.628 -13.731 8.376 380 HB2 LYS 46 2HB LYS 46 5.319 -10.741 8.908 381 HB3 LYS 46 3HB LYS 46 5.008 -12.035 10.062 382 HG2 LYS 46 2HG LYS 46 7.380 -12.630 10.112 383 HG3 LYS 46 3HG LYS 46 7.733 -11.432 8.860 384 HD2 LYS 46 2HD LYS 46 6.979 -9.621 10.414 385 HD3 LYS 46 3HD LYS 46 6.697 -10.836 11.665 386 HE2 LYS 46 2HE LYS 46 9.102 -11.414 11.641 387 HE3 LYS 46 3HE LYS 46 9.380 -10.194 10.392 388 HZ1 LYS 46 3HZ LYS 46 8.701 -8.482 11.917 389 HZ2 LYS 46 1HZ LYS 46 9.912 -9.412 12.638 390 HZ3 LYS 46 2HZ LYS 46 8.305 -9.622 13.102 391 H ALA 47 H ALA 47 4.258 -11.079 6.478 392 HA ALA 47 HA ALA 47 1.531 -11.418 7.203 393 HB1 ALA 47 3HB ALA 47 1.058 -9.911 5.316 394 HB2 ALA 47 1HB ALA 47 2.719 -10.102 4.740 395 HB3 ALA 47 2HB ALA 47 2.405 -9.312 6.286 396 H ARG 48 H ARG 48 3.314 -12.349 4.237 397 HA ARG 48 HA ARG 48 1.099 -13.714 3.073 398 HB2 ARG 48 2HB ARG 48 2.708 -14.502 1.353 399 HB3 ARG 48 3HB ARG 48 2.783 -12.775 1.626 400 HG2 ARG 48 2HG ARG 48 5.024 -13.369 1.360 401 HG3 ARG 48 3HG ARG 48 4.848 -13.268 3.109 402 HD2 ARG 48 2HD ARG 48 4.726 -15.708 3.269 403 HD3 ARG 48 3HD ARG 48 4.761 -15.863 1.512 404 HE ARG 48 HE ARG 48 6.987 -15.338 3.299 405 HH11 ARG 48 1HH1 ARG 48 5.940 -15.298 -0.079 406 HH12 ARG 48 2HH1 ARG 48 7.570 -15.360 -0.675 407 HH21 ARG 48 1HH2 ARG 48 9.067 -15.463 2.470 408 HH22 ARG 48 2HH2 ARG 48 9.314 -15.448 0.751 409 H LYS 49 H LYS 49 3.610 -14.691 5.283 410 HA LYS 49 HA LYS 49 3.338 -17.523 5.060 411 HB2 LYS 49 2HB LYS 49 5.303 -16.400 6.084 412 HB3 LYS 49 3HB LYS 49 4.298 -15.835 7.415 413 HG2 LYS 49 2HG LYS 49 3.899 -18.195 8.091 414 HG3 LYS 49 3HG LYS 49 4.947 -18.739 6.772 415 HD2 LYS 49 2HD LYS 49 6.872 -17.595 7.789 416 HD3 LYS 49 3HD LYS 49 5.835 -16.919 9.048 417 HE2 LYS 49 2HE LYS 49 5.346 -19.258 9.817 418 HE3 LYS 49 3HE LYS 49 6.524 -19.845 8.640 419 HZ1 LYS 49 3HZ LYS 49 8.225 -18.554 9.752 420 HZ2 LYS 49 1HZ LYS 49 7.491 -19.622 10.836 421 HZ3 LYS 49 2HZ LYS 49 7.101 -17.978 10.875 422 H GLN 50 H GLN 50 1.819 -15.079 7.167 423 HA GLN 50 HA GLN 50 0.169 -17.000 8.574 424 HB2 GLN 50 2HB GLN 50 -0.639 -15.194 9.876 425 HB3 GLN 50 3HB GLN 50 1.025 -14.757 9.524 426 HG2 GLN 50 2HG GLN 50 0.121 -13.294 7.650 427 HG3 GLN 50 3HG GLN 50 -1.490 -13.602 8.286 428 HE21 GLN 50 1HE2 GLN 50 -0.178 -11.064 8.030 429 HE22 GLN 50 2HE2 GLN 50 -0.062 -10.401 9.619 430 H GLY 51 H GLY 51 0.001 -15.490 5.543 431 HA2 GLY 51 2HA GLY 51 -1.442 -16.285 3.862 432 HA3 GLY 51 3HA GLY 51 -2.647 -16.684 5.074 433 H ARG 52 H ARG 52 -1.744 -13.683 5.967 434 HA ARG 52 HA ARG 52 -4.050 -12.463 4.562 435 HB2 ARG 52 2HB ARG 52 -2.777 -11.776 7.257 436 HB3 ARG 52 3HB ARG 52 -4.146 -10.927 6.539 437 HG2 ARG 52 2HG ARG 52 -5.390 -13.145 6.542 438 HG3 ARG 52 3HG ARG 52 -4.066 -13.794 7.509 439 HD2 ARG 52 2HD ARG 52 -4.524 -12.179 9.280 440 HD3 ARG 52 3HD ARG 52 -5.785 -11.418 8.299 441 HE ARG 52 HE ARG 52 -6.057 -14.266 8.973 442 HH11 ARG 52 1HH1 ARG 52 -7.160 -10.976 9.533 443 HH12 ARG 52 2HH1 ARG 52 -8.612 -11.471 10.342 444 HH21 ARG 52 1HH2 ARG 52 -7.976 -14.895 10.061 445 HH22 ARG 52 2HH2 ARG 52 -9.069 -13.681 10.640 446 HA PRO 53 HA PRO 53 -1.468 -9.478 2.508 447 HB2 PRO 53 2HB PRO 53 -2.971 -7.149 2.604 448 HB3 PRO 53 3HB PRO 53 -3.358 -8.522 1.553 449 HG2 PRO 53 2HG PRO 53 -4.530 -7.825 4.226 450 HG3 PRO 53 3HG PRO 53 -5.357 -8.340 2.734 451 HD2 PRO 53 2HD PRO 53 -4.887 -10.087 4.728 452 HD3 PRO 53 3HD PRO 53 -4.784 -10.585 3.025 453 H ILE 54 H ILE 54 -0.468 -7.261 2.687 454 HA ILE 54 HA ILE 54 -0.036 -6.347 5.464 455 HB ILE 54 HB ILE 54 1.955 -7.589 4.897 456 HG12 ILE 54 2HG1 ILE 54 2.599 -4.626 4.611 457 HG13 ILE 54 3HG1 ILE 54 2.264 -5.439 6.133 458 HG21 ILE 54 1HG2 ILE 54 2.238 -5.959 2.360 459 HG22 ILE 54 2HG2 ILE 54 1.785 -7.660 2.454 460 HG23 ILE 54 3HG2 ILE 54 3.400 -7.149 2.955 461 HD11 ILE 54 3HD1 ILE 54 4.627 -5.101 5.856 462 HD12 ILE 54 1HD1 ILE 54 4.614 -5.958 4.315 463 HD13 ILE 54 2HD1 ILE 54 4.267 -6.827 5.812 464 H VAL 55 H VAL 55 -0.827 -4.371 5.628 465 HA VAL 55 HA VAL 55 -1.098 -2.644 3.260 466 HB VAL 55 HB VAL 55 -2.410 -2.160 5.976 467 HG11 VAL 55 1HG1 VAL 55 -3.994 -0.795 4.665 468 HG12 VAL 55 2HG1 VAL 55 -3.125 -1.192 3.178 469 HG13 VAL 55 3HG1 VAL 55 -2.336 -0.233 4.433 470 HG21 VAL 55 3HG2 VAL 55 -4.453 -3.248 5.144 471 HG22 VAL 55 1HG2 VAL 55 -3.113 -4.392 5.196 472 HG23 VAL 55 2HG2 VAL 55 -3.624 -3.707 3.656 473 H ILE 56 H ILE 56 0.632 -1.325 3.020 474 HA ILE 56 HA ILE 56 2.072 -0.316 5.397 475 HB ILE 56 HB ILE 56 2.936 -0.469 2.467 476 HG12 ILE 56 2HG1 ILE 56 2.872 -2.668 3.674 477 HG13 ILE 56 3HG1 ILE 56 4.506 -2.209 3.210 478 HG21 ILE 56 1HG2 ILE 56 5.180 0.255 3.239 479 HG22 ILE 56 2HG2 ILE 56 4.536 0.523 4.860 480 HG23 ILE 56 3HG2 ILE 56 3.961 1.502 3.511 481 HD11 ILE 56 3HD1 ILE 56 3.305 -2.000 5.977 482 HD12 ILE 56 1HD1 ILE 56 4.931 -1.467 5.535 483 HD13 ILE 56 2HD1 ILE 56 4.500 -3.171 5.424 484 H PHE 57 H PHE 57 1.686 1.736 6.019 485 HA PHE 57 HA PHE 57 0.349 3.605 4.174 486 HB2 PHE 57 2HB PHE 57 0.652 3.519 7.193 487 HB3 PHE 57 3HB PHE 57 0.207 5.024 6.388 488 HD1 PHE 57 HD2 PHE 57 -0.815 1.420 6.652 489 HD2 PHE 57 HD1 PHE 57 -2.057 5.439 5.844 490 HE1 PHE 57 HE2 PHE 57 -3.152 0.677 6.498 491 HE2 PHE 57 HE1 PHE 57 -4.387 4.680 5.700 492 HZ PHE 57 HZ PHE 57 -4.930 2.303 5.994 493 H ILE 58 H ILE 58 1.260 5.370 3.397 494 HA ILE 58 HA ILE 58 4.033 6.129 4.018 495 HB ILE 58 HB ILE 58 3.051 5.187 1.263 496 HG12 ILE 58 2HG1 ILE 58 3.684 3.310 2.773 497 HG13 ILE 58 3HG1 ILE 58 4.773 3.435 1.400 498 HG21 ILE 58 1HG2 ILE 58 5.733 6.409 1.979 499 HG22 ILE 58 2HG2 ILE 58 4.486 7.128 0.959 500 HG23 ILE 58 3HG2 ILE 58 5.330 5.675 0.425 501 HD11 ILE 58 3HD1 ILE 58 6.437 4.527 2.832 502 HD12 ILE 58 1HD1 ILE 58 5.977 2.931 3.422 503 HD13 ILE 58 2HD1 ILE 58 5.338 4.373 4.206 504 H ARG 59 H ARG 59 4.424 8.309 3.529 505 HA ARG 59 HA ARG 59 2.168 9.921 2.560 506 HB2 ARG 59 2HB ARG 59 3.523 10.459 4.679 507 HB3 ARG 59 3HB ARG 59 4.837 10.933 3.607 508 HG2 ARG 59 2HG ARG 59 3.448 12.693 2.624 509 HG3 ARG 59 3HG ARG 59 2.065 12.168 3.588 510 HD2 ARG 59 2HD ARG 59 3.304 12.752 5.668 511 HD3 ARG 59 3HD ARG 59 4.658 13.326 4.682 512 HE ARG 59 HE ARG 59 2.685 14.793 3.689 513 HH11 ARG 59 1HH1 ARG 59 3.470 14.174 7.074 514 HH12 ARG 59 2HH1 ARG 59 2.844 15.703 7.605 515 HH21 ARG 59 1HH2 ARG 59 1.843 16.739 4.407 516 HH22 ARG 59 2HH2 ARG 59 1.914 17.156 6.091 517 H GLY 60 H GLY 60 2.511 11.540 0.883 518 HA2 GLY 60 2HA GLY 60 3.150 10.445 -1.538 519 HA3 GLY 60 3HA GLY 60 3.037 12.173 -1.262 520 H ALA 61 H ALA 61 5.375 12.419 0.414 521 HA ALA 61 HA ALA 61 7.430 12.728 -1.549 522 HB1 ALA 61 3HB ALA 61 7.214 14.221 0.389 523 HB2 ALA 61 1HB ALA 61 8.817 13.497 0.345 524 HB3 ALA 61 2HB ALA 61 7.604 12.888 1.477 525 H TYR 62 H TYR 62 6.803 10.416 0.982 526 HA TYR 62 HA TYR 62 9.288 8.990 0.861 527 HB2 TYR 62 2HB TYR 62 6.664 8.306 2.264 528 HB3 TYR 62 3HB TYR 62 8.182 7.440 2.487 529 HD1 TYR 62 HD1 TYR 62 6.450 10.671 3.094 530 HD2 TYR 62 HD2 TYR 62 9.939 8.350 3.904 531 HE1 TYR 62 HE1 TYR 62 7.105 12.269 4.842 532 HE2 TYR 62 HE2 TYR 62 10.587 9.944 5.651 533 HH TYR 62 HH TYR 62 10.214 12.212 6.324 534 H GLU 63 H GLU 63 6.292 8.792 -0.845 535 HA GLU 63 HA GLU 63 5.902 6.116 -1.338 536 HB2 GLU 63 2HB GLU 63 4.325 7.926 -1.936 537 HB3 GLU 63 3HB GLU 63 5.366 8.399 -3.280 538 HG2 GLU 63 2HG GLU 63 5.029 6.075 -4.232 539 HG3 GLU 63 3HG GLU 63 3.858 5.785 -2.948 540 H GLU 64 H GLU 64 8.249 8.232 -2.902 541 HA GLU 64 HA GLU 64 8.977 6.705 -5.104 542 HB2 GLU 64 2HB GLU 64 9.824 8.975 -4.735 543 HB3 GLU 64 3HB GLU 64 10.740 8.433 -3.333 544 HG2 GLU 64 2HG GLU 64 12.204 8.735 -5.285 545 HG3 GLU 64 3HG GLU 64 12.172 7.057 -4.757 546 H VAL 65 H VAL 65 10.114 6.435 -1.753 547 HA VAL 65 HA VAL 65 12.172 4.554 -2.085 548 HB VAL 65 HB VAL 65 10.446 4.965 0.397 549 HG11 VAL 65 1HG1 VAL 65 12.431 4.231 1.668 550 HG12 VAL 65 2HG1 VAL 65 13.268 3.890 0.151 551 HG13 VAL 65 3HG1 VAL 65 11.826 2.971 0.588 552 HG21 VAL 65 3HG2 VAL 65 12.084 6.648 1.141 553 HG22 VAL 65 1HG2 VAL 65 11.325 7.137 -0.376 554 HG23 VAL 65 2HG2 VAL 65 12.966 6.484 -0.380 555 H VAL 66 H VAL 66 8.701 4.151 -1.850 556 HA VAL 66 HA VAL 66 8.451 1.461 -1.083 557 HB VAL 66 HB VAL 66 6.566 3.092 -2.843 558 HG11 VAL 66 1HG1 VAL 66 4.776 1.541 -2.113 559 HG12 VAL 66 2HG1 VAL 66 5.969 0.563 -1.258 560 HG13 VAL 66 3HG1 VAL 66 6.037 0.696 -3.015 561 HG21 VAL 66 3HG2 VAL 66 5.349 3.593 -0.753 562 HG22 VAL 66 1HG2 VAL 66 7.009 4.189 -0.692 563 HG23 VAL 66 2HG2 VAL 66 6.569 2.715 0.173 564 H ARG 67 H ARG 67 9.162 2.849 -4.249 565 HA ARG 67 HA ARG 67 8.404 0.724 -5.928 566 HB2 ARG 67 2HB ARG 67 8.996 3.036 -6.676 567 HB3 ARG 67 3HB ARG 67 10.693 2.675 -6.397 568 HG2 ARG 67 2HG ARG 67 10.796 1.167 -8.222 569 HG3 ARG 67 3HG ARG 67 9.037 0.998 -8.296 570 HD2 ARG 67 2HD ARG 67 9.953 2.371 -10.163 571 HD3 ARG 67 3HD ARG 67 8.802 3.255 -9.166 572 HE ARG 67 HE ARG 67 10.808 4.284 -8.056 573 HH11 ARG 67 1HH1 ARG 67 11.037 3.171 -11.388 574 HH12 ARG 67 2HH1 ARG 67 12.311 4.284 -11.784 575 HH21 ARG 67 1HH2 ARG 67 12.434 5.728 -8.591 576 HH22 ARG 67 2HH2 ARG 67 13.107 5.737 -10.198 577 H ASP 68 H ASP 68 11.293 1.140 -3.987 578 HA ASP 68 HA ASP 68 12.863 -1.006 -5.017 579 HB2 ASP 68 2HB ASP 68 13.777 0.859 -3.629 580 HB3 ASP 68 3HB ASP 68 12.870 0.269 -2.238 581 H ILE 69 H ILE 69 10.425 -0.789 -2.436 582 HA ILE 69 HA ILE 69 10.581 -3.424 -1.384 583 HB ILE 69 HB ILE 69 8.051 -1.700 -1.494 584 HG12 ILE 69 2HG1 ILE 69 10.199 -1.629 0.672 585 HG13 ILE 69 3HG1 ILE 69 9.978 -0.389 -0.556 586 HG21 ILE 69 1HG2 ILE 69 8.884 -3.845 0.496 587 HG22 ILE 69 2HG2 ILE 69 7.675 -4.032 -0.775 588 HG23 ILE 69 3HG2 ILE 69 7.389 -2.906 0.550 589 HD11 ILE 69 3HD1 ILE 69 7.991 -1.127 1.592 590 HD12 ILE 69 1HD1 ILE 69 7.753 0.100 0.343 591 HD13 ILE 69 2HD1 ILE 69 9.023 0.303 1.550 592 H VAL 70 H VAL 70 8.712 -1.945 -3.981 593 HA VAL 70 HA VAL 70 6.836 -3.897 -4.589 594 HB VAL 70 HB VAL 70 8.159 -1.794 -6.367 595 HG11 VAL 70 1HG1 VAL 70 5.689 -3.443 -7.020 596 HG12 VAL 70 2HG1 VAL 70 7.250 -3.531 -7.840 597 HG13 VAL 70 3HG1 VAL 70 6.281 -2.063 -7.949 598 HG21 VAL 70 3HG2 VAL 70 6.876 -0.888 -4.466 599 HG22 VAL 70 1HG2 VAL 70 5.453 -1.806 -4.966 600 HG23 VAL 70 2HG2 VAL 70 6.076 -0.508 -5.990 601 H GLU 71 H GLU 71 10.171 -3.526 -5.804 602 HA GLU 71 HA GLU 71 10.166 -5.529 -7.779 603 HB2 GLU 71 2HB GLU 71 12.524 -4.671 -6.051 604 HB3 GLU 71 3HB GLU 71 12.632 -5.581 -7.554 605 HG2 GLU 71 2HG GLU 71 11.593 -3.618 -8.738 606 HG3 GLU 71 3HG GLU 71 11.722 -2.708 -7.229 607 H TYR 72 H TYR 72 11.151 -5.695 -4.384 608 HA TYR 72 HA TYR 72 11.860 -8.421 -4.250 609 HB2 TYR 72 2HB TYR 72 12.574 -6.805 -2.548 610 HB3 TYR 72 3HB TYR 72 10.910 -6.488 -2.088 611 HD1 TYR 72 HD1 TYR 72 13.722 -8.898 -1.788 612 HD2 TYR 72 HD2 TYR 72 9.689 -8.056 -0.624 613 HE1 TYR 72 HE1 TYR 72 13.869 -10.589 -0.003 614 HE2 TYR 72 HE2 TYR 72 9.842 -9.741 1.145 615 HH TYR 72 HH TYR 72 11.161 -11.713 1.724 616 H ALA 73 H ALA 73 8.781 -6.750 -3.715 617 HA ALA 73 HA ALA 73 7.372 -8.932 -2.589 618 HB1 ALA 73 3HB ALA 73 5.363 -7.577 -2.977 619 HB2 ALA 73 1HB ALA 73 6.288 -6.483 -4.009 620 HB3 ALA 73 2HB ALA 73 6.668 -6.607 -2.289 621 H GLN 74 H GLN 74 7.560 -7.692 -5.958 622 HA GLN 74 HA GLN 74 5.905 -9.740 -7.089 623 HB2 GLN 74 2HB GLN 74 7.941 -7.936 -8.459 624 HB3 GLN 74 3HB GLN 74 6.768 -8.952 -9.295 625 HG2 GLN 74 2HG GLN 74 4.935 -7.658 -8.126 626 HG3 GLN 74 3HG GLN 74 6.176 -6.578 -7.504 627 HE21 GLN 74 1HE2 GLN 74 7.296 -5.211 -9.004 628 HE22 GLN 74 2HE2 GLN 74 6.611 -4.844 -10.545 629 H LYS 75 H LYS 75 9.354 -9.538 -6.390 630 HA LYS 75 HA LYS 75 10.226 -11.909 -7.662 631 HB2 LYS 75 2HB LYS 75 11.180 -10.468 -5.163 632 HB3 LYS 75 3HB LYS 75 11.930 -11.968 -5.685 633 HG2 LYS 75 2HG LYS 75 11.804 -9.420 -7.330 634 HG3 LYS 75 3HG LYS 75 13.192 -9.955 -6.385 635 HD2 LYS 75 2HD LYS 75 12.010 -11.331 -8.827 636 HD3 LYS 75 3HD LYS 75 13.562 -10.509 -8.724 637 HE2 LYS 75 2HE LYS 75 12.786 -13.097 -7.341 638 HE3 LYS 75 3HE LYS 75 13.927 -12.913 -8.669 639 HZ1 LYS 75 3HZ LYS 75 15.098 -13.160 -6.614 640 HZ2 LYS 75 1HZ LYS 75 14.260 -11.877 -5.907 641 HZ3 LYS 75 2HZ LYS 75 15.335 -11.587 -7.178 642 H GLU 76 H GLU 76 8.777 -11.342 -4.454 643 HA GLU 76 HA GLU 76 8.674 -14.144 -3.727 644 HB2 GLU 76 2HB GLU 76 7.315 -11.724 -2.453 645 HB3 GLU 76 3HB GLU 76 7.386 -13.331 -1.744 646 HG2 GLU 76 2HG GLU 76 9.700 -11.435 -2.216 647 HG3 GLU 76 3HG GLU 76 9.014 -11.910 -0.666 648 H GLY 77 H GLY 77 7.052 -12.641 -6.091 649 HA2 GLY 77 2HA GLY 77 5.342 -13.358 -7.425 650 HA3 GLY 77 3HA GLY 77 5.142 -14.735 -6.354 651 H LEU 78 H LEU 78 4.975 -11.464 -5.191 652 HA LEU 78 HA LEU 78 2.282 -11.959 -4.169 653 HB2 LEU 78 2HB LEU 78 4.193 -9.654 -3.598 654 HB3 LEU 78 3HB LEU 78 2.713 -10.012 -2.719 655 HG LEU 78 HG LEU 78 5.177 -11.801 -2.774 656 HD11 LEU 78 1HD1 LEU 78 5.577 -11.080 -0.483 657 HD12 LEU 78 2HD1 LEU 78 4.213 -9.962 -0.574 658 HD13 LEU 78 3HD1 LEU 78 5.628 -9.719 -1.599 659 HD21 LEU 78 3HD2 LEU 78 3.106 -13.073 -2.428 660 HD22 LEU 78 1HD2 LEU 78 2.684 -12.031 -1.068 661 HD23 LEU 78 2HD2 LEU 78 4.114 -13.068 -0.983 662 H ARG 79 H ARG 79 0.529 -10.812 -4.704 663 HA ARG 79 HA ARG 79 0.360 -9.259 -7.107 664 HB2 ARG 79 2HB ARG 79 -1.388 -10.842 -5.884 665 HB3 ARG 79 3HB ARG 79 -1.763 -9.440 -4.908 666 HG2 ARG 79 2HG ARG 79 -2.063 -9.550 -7.924 667 HG3 ARG 79 3HG ARG 79 -3.353 -9.920 -6.789 668 HD2 ARG 79 2HD ARG 79 -3.800 -7.707 -7.459 669 HD3 ARG 79 3HD ARG 79 -3.010 -7.513 -5.897 670 HE ARG 79 HE ARG 79 -1.390 -6.316 -6.942 671 HH11 ARG 79 1HH1 ARG 79 -2.823 -8.356 -9.444 672 HH12 ARG 79 2HH1 ARG 79 -1.857 -7.670 -10.707 673 HH21 ARG 79 1HH2 ARG 79 -0.124 -5.488 -8.635 674 HH22 ARG 79 2HH2 ARG 79 -0.351 -6.068 -10.251 675 H VAL 80 H VAL 80 1.242 -7.131 -7.096 676 HA VAL 80 HA VAL 80 1.268 -5.671 -4.511 677 HB VAL 80 HB VAL 80 2.980 -5.128 -6.998 678 HG11 VAL 80 1HG1 VAL 80 3.170 -3.969 -4.183 679 HG12 VAL 80 2HG1 VAL 80 2.624 -3.107 -5.623 680 HG13 VAL 80 3HG1 VAL 80 4.297 -3.650 -5.506 681 HG21 VAL 80 3HG2 VAL 80 3.721 -6.545 -4.414 682 HG22 VAL 80 1HG2 VAL 80 4.846 -6.118 -5.707 683 HG23 VAL 80 2HG2 VAL 80 3.562 -7.290 -6.004 684 H LEU 81 H LEU 81 -0.077 -4.076 -4.311 685 HA LEU 81 HA LEU 81 -1.342 -2.760 -6.628 686 HB2 LEU 81 2HB LEU 81 -2.754 -4.631 -5.757 687 HB3 LEU 81 3HB LEU 81 -2.696 -3.920 -4.160 688 HG LEU 81 HG LEU 81 -3.993 -1.970 -4.969 689 HD11 LEU 81 1HD1 LEU 81 -3.252 -1.916 -7.268 690 HD12 LEU 81 2HD1 LEU 81 -5.009 -2.007 -7.198 691 HD13 LEU 81 3HD1 LEU 81 -4.068 -3.447 -7.598 692 HD21 LEU 81 3HD2 LEU 81 -6.153 -3.126 -5.274 693 HD22 LEU 81 1HD2 LEU 81 -5.199 -3.876 -3.995 694 HD23 LEU 81 2HD2 LEU 81 -5.301 -4.643 -5.581 695 H VAL 82 H VAL 82 -0.691 -0.703 -6.384 696 HA VAL 82 HA VAL 82 -0.192 0.399 -3.689 697 HB VAL 82 HB VAL 82 0.900 2.314 -4.947 698 HG11 VAL 82 1HG1 VAL 82 2.947 1.049 -5.547 699 HG12 VAL 82 2HG1 VAL 82 2.032 -0.460 -5.521 700 HG13 VAL 82 3HG1 VAL 82 2.251 0.465 -4.034 701 HG21 VAL 82 3HG2 VAL 82 0.445 0.545 -7.383 702 HG22 VAL 82 1HG2 VAL 82 1.469 1.981 -7.340 703 HG23 VAL 82 2HG2 VAL 82 -0.268 2.132 -7.093 704 H ILE 83 H ILE 83 -1.728 1.509 -2.763 705 HA ILE 83 HA ILE 83 -3.989 2.667 -4.263 706 HB ILE 83 HB ILE 83 -3.641 2.316 -1.235 707 HG12 ILE 83 2HG1 ILE 83 -5.210 0.492 -3.116 708 HG13 ILE 83 3HG1 ILE 83 -3.604 0.119 -2.500 709 HG21 ILE 83 1HG2 ILE 83 -6.157 2.884 -2.858 710 HG22 ILE 83 2HG2 ILE 83 -5.310 4.038 -1.828 711 HG23 ILE 83 3HG2 ILE 83 -6.096 2.631 -1.112 712 HD11 ILE 83 3HD1 ILE 83 -5.251 -1.051 -1.237 713 HD12 ILE 83 1HD1 ILE 83 -6.115 0.443 -0.874 714 HD13 ILE 83 2HD1 ILE 83 -4.501 0.168 -0.210 715 H LYS 84 H LYS 84 -3.606 4.784 -4.789 716 HA LYS 84 HA LYS 84 -2.158 6.550 -2.916 717 HB2 LYS 84 2HB LYS 84 -1.061 7.581 -5.016 718 HB3 LYS 84 3HB LYS 84 -0.464 6.013 -4.493 719 HG2 LYS 84 2HG LYS 84 -1.932 4.939 -6.240 720 HG3 LYS 84 3HG LYS 84 -2.331 6.549 -6.828 721 HD2 LYS 84 2HD LYS 84 0.501 5.436 -6.714 722 HD3 LYS 84 3HD LYS 84 -0.532 5.336 -8.132 723 HE2 LYS 84 2HE LYS 84 0.776 7.203 -8.606 724 HE3 LYS 84 3HE LYS 84 -0.680 7.936 -7.918 725 HZ1 LYS 84 3HZ LYS 84 1.801 7.355 -6.383 726 HZ2 LYS 84 1HZ LYS 84 0.460 8.213 -5.836 727 HZ3 LYS 84 2HZ LYS 84 1.439 8.859 -7.053 728 H VAL 85 H VAL 85 -3.023 8.464 -2.632 729 HA VAL 85 HA VAL 85 -5.610 9.071 -3.793 730 HB VAL 85 HB VAL 85 -4.002 10.356 -1.532 731 HG11 VAL 85 1HG1 VAL 85 -5.992 11.686 -0.955 732 HG12 VAL 85 2HG1 VAL 85 -6.823 11.076 -2.388 733 HG13 VAL 85 3HG1 VAL 85 -5.394 12.096 -2.566 734 HG21 VAL 85 3HG2 VAL 85 -6.515 8.637 -1.434 735 HG22 VAL 85 1HG2 VAL 85 -5.704 9.354 -0.035 736 HG23 VAL 85 2HG2 VAL 85 -4.887 8.117 -0.993 737 H ALA 86 H ALA 86 -5.715 10.154 -5.600 738 HA ALA 86 HA ALA 86 -3.537 11.664 -6.726 739 HB1 ALA 86 3HB ALA 86 -6.337 11.157 -7.789 740 HB2 ALA 86 1HB ALA 86 -4.913 10.167 -8.116 741 HB3 ALA 86 2HB ALA 86 -4.986 11.829 -8.704 742 H GLN 87 H GLN 87 -3.478 13.827 -7.175 743 HA GLN 87 HA GLN 87 -5.692 15.600 -6.965 744 HB2 GLN 87 2HB GLN 87 -4.799 17.080 -5.147 745 HB3 GLN 87 3HB GLN 87 -5.319 15.505 -4.572 746 HG2 GLN 87 2HG GLN 87 -2.937 14.773 -4.508 747 HG3 GLN 87 3HG GLN 87 -2.448 16.396 -4.994 748 HE21 GLN 87 1HE2 GLN 87 -1.802 14.914 -2.586 749 HE22 GLN 87 2HE2 GLN 87 -2.330 15.882 -1.258 750 H ASP 88 H ASP 88 -2.134 15.346 -6.919 751 HA ASP 88 HA ASP 88 -1.570 17.700 -8.404 752 HB2 ASP 88 2HB ASP 88 0.119 15.145 -8.342 753 HB3 ASP 88 3HB ASP 88 0.681 16.777 -8.714 754 H GLN 89 H GLN 89 -2.201 14.349 -9.202 755 HA GLN 89 HA GLN 89 -2.471 13.101 -11.008 756 HB2 GLN 89 2HB GLN 89 -3.211 15.712 -12.333 757 HB3 GLN 89 3HB GLN 89 -3.294 14.166 -13.164 758 HG2 GLN 89 2HG GLN 89 -4.935 13.368 -11.487 759 HG3 GLN 89 3HG GLN 89 -4.885 14.948 -10.703 760 HE21 GLN 89 1HE2 GLN 89 -7.128 13.525 -12.021 761 HE22 GLN 89 2HE2 GLN 89 -7.721 14.605 -13.235 762 H GLU 90 H GLU 90 -0.969 16.015 -12.464 763 HA GLU 90 HA GLU 90 0.534 14.534 -14.356 764 HB2 GLU 90 2HB GLU 90 0.898 17.436 -13.478 765 HB3 GLU 90 3HB GLU 90 1.505 16.716 -14.970 766 HG2 GLU 90 2HG GLU 90 -0.832 16.291 -15.702 767 HG3 GLU 90 3HG GLU 90 -1.415 17.055 -14.228 768 H LEU 91 H LEU 91 1.622 16.259 -11.383 769 HA LEU 91 HA LEU 91 4.352 15.403 -11.580 770 HB2 LEU 91 2HB LEU 91 3.712 17.398 -10.260 771 HB3 LEU 91 3HB LEU 91 2.783 16.389 -9.157 772 HG LEU 91 HG LEU 91 4.891 15.253 -8.434 773 HD11 LEU 91 1HD1 LEU 91 7.095 16.165 -9.052 774 HD12 LEU 91 2HD1 LEU 91 6.328 17.247 -10.214 775 HD13 LEU 91 3HD1 LEU 91 6.245 15.499 -10.446 776 HD21 LEU 91 3HD2 LEU 91 4.961 18.272 -8.125 777 HD22 LEU 91 1HD2 LEU 91 5.814 17.109 -7.105 778 HD23 LEU 91 2HD2 LEU 91 4.053 17.139 -7.122 779 H LEU 92 H LEU 92 1.495 14.240 -9.903 780 HA LEU 92 HA LEU 92 2.545 12.102 -8.412 781 HB2 LEU 92 2HB LEU 92 0.230 13.179 -8.276 782 HB3 LEU 92 3HB LEU 92 -0.196 12.272 -9.713 783 HG LEU 92 HG LEU 92 0.511 10.164 -8.269 784 HD11 LEU 92 1HD1 LEU 92 1.475 11.377 -6.399 785 HD12 LEU 92 2HD1 LEU 92 0.097 10.417 -5.867 786 HD13 LEU 92 3HD1 LEU 92 -0.075 12.164 -6.072 787 HD21 LEU 92 3HD2 LEU 92 -1.783 9.892 -7.477 788 HD22 LEU 92 1HD2 LEU 92 -1.756 10.556 -9.110 789 HD23 LEU 92 2HD2 LEU 92 -2.097 11.610 -7.735 790 H GLU 93 H GLU 93 1.793 12.457 -11.776 791 HA GLU 93 HA GLU 93 1.382 9.765 -12.564 792 HB2 GLU 93 2HB GLU 93 0.594 11.939 -13.697 793 HB3 GLU 93 3HB GLU 93 2.205 12.077 -14.366 794 HG2 GLU 93 2HG GLU 93 0.472 9.642 -14.849 795 HG3 GLU 93 3HG GLU 93 0.319 11.092 -15.834 796 H ARG 94 H ARG 94 4.230 11.686 -12.051 797 HA ARG 94 HA ARG 94 6.093 10.457 -13.732 798 HB2 ARG 94 2HB ARG 94 6.395 12.581 -12.400 799 HB3 ARG 94 3HB ARG 94 6.602 11.600 -10.954 800 HG2 ARG 94 2HG ARG 94 8.762 12.339 -11.798 801 HG3 ARG 94 3HG ARG 94 8.634 10.582 -11.934 802 HD2 ARG 94 2HD ARG 94 9.683 11.639 -13.931 803 HD3 ARG 94 3HD ARG 94 8.204 10.765 -14.330 804 HE ARG 94 HE ARG 94 7.090 12.820 -14.698 805 HH11 ARG 94 1HH1 ARG 94 10.500 13.342 -13.969 806 HH12 ARG 94 2HH1 ARG 94 10.508 14.958 -14.596 807 HH21 ARG 94 1HH2 ARG 94 7.129 14.930 -15.528 808 HH22 ARG 94 2HH2 ARG 94 8.598 15.858 -15.476 809 H PHE 95 H PHE 95 5.294 9.680 -10.331 810 HA PHE 95 HA PHE 95 6.890 7.275 -10.249 811 HB2 PHE 95 2HB PHE 95 6.404 8.679 -8.210 812 HB3 PHE 95 3HB PHE 95 4.713 8.194 -8.304 813 HD1 PHE 95 HD2 PHE 95 8.176 6.908 -7.786 814 HD2 PHE 95 HD1 PHE 95 4.001 6.066 -7.391 815 HE1 PHE 95 HE2 PHE 95 8.695 4.886 -6.504 816 HE2 PHE 95 HE1 PHE 95 4.540 4.035 -6.109 817 HZ PHE 95 HZ PHE 95 6.887 3.442 -5.665 818 H TYR 96 H TYR 96 3.470 8.076 -10.629 819 HA TYR 96 HA TYR 96 2.199 5.623 -10.531 820 HB2 TYR 96 2HB TYR 96 0.936 7.646 -10.563 821 HB3 TYR 96 3HB TYR 96 1.657 8.168 -12.071 822 HD1 TYR 96 HD1 TYR 96 -0.851 5.931 -10.560 823 HD2 TYR 96 HD2 TYR 96 0.726 7.446 -14.230 824 HE1 TYR 96 HE1 TYR 96 -2.782 5.043 -11.756 825 HE2 TYR 96 HE2 TYR 96 -1.213 6.548 -15.441 826 HH TYR 96 HH TYR 96 -4.017 5.433 -13.862 827 H GLU 97 H GLU 97 3.934 7.088 -13.205 828 HA GLU 97 HA GLU 97 3.063 5.364 -15.305 829 HB2 GLU 97 2HB GLU 97 3.882 7.632 -15.742 830 HB3 GLU 97 3HB GLU 97 5.457 7.232 -15.060 831 HG2 GLU 97 2HG GLU 97 5.211 5.319 -17.063 832 HG3 GLU 97 3HG GLU 97 4.379 6.695 -17.780 833 H GLN 98 H GLN 98 5.967 5.608 -13.300 834 HA GLN 98 HA GLN 98 7.536 3.579 -14.395 835 HB2 GLN 98 2HB GLN 98 7.363 4.672 -11.561 836 HB3 GLN 98 3HB GLN 98 8.634 3.570 -12.088 837 HG2 GLN 98 2HG GLN 98 8.122 6.293 -13.322 838 HG3 GLN 98 3HG GLN 98 9.302 5.979 -12.056 839 HE21 GLN 98 1HE2 GLN 98 8.528 5.479 -15.432 840 HE22 GLN 98 2HE2 GLN 98 10.111 4.983 -15.918 841 H LEU 99 H LEU 99 4.934 3.413 -12.029 842 HA LEU 99 HA LEU 99 5.157 0.681 -11.251 843 HB2 LEU 99 2HB LEU 99 2.765 2.561 -11.332 844 HB3 LEU 99 3HB LEU 99 2.780 1.021 -10.487 845 HG LEU 99 HG LEU 99 4.755 3.219 -9.784 846 HD11 LEU 99 1HD1 LEU 99 3.225 3.911 -7.969 847 HD12 LEU 99 2HD1 LEU 99 1.974 2.860 -8.634 848 HD13 LEU 99 3HD1 LEU 99 2.562 4.230 -9.569 849 HD21 LEU 99 3HD2 LEU 99 5.275 0.964 -8.975 850 HD22 LEU 99 1HD2 LEU 99 3.685 0.853 -8.216 851 HD23 LEU 99 2HD2 LEU 99 4.864 2.032 -7.634 852 H LYS 100 H LYS 100 3.077 2.350 -13.603 853 HA LYS 100 HA LYS 100 1.633 0.032 -14.456 854 HB2 LYS 100 2HB LYS 100 1.864 2.870 -15.537 855 HB3 LYS 100 3HB LYS 100 0.785 1.675 -16.251 856 HG2 LYS 100 2HG LYS 100 0.666 2.523 -13.335 857 HG3 LYS 100 3HG LYS 100 -0.313 3.259 -14.611 858 HD2 LYS 100 2HD LYS 100 -0.382 0.326 -13.786 859 HD3 LYS 100 3HD LYS 100 -1.589 1.543 -13.374 860 HE2 LYS 100 2HE LYS 100 -2.187 1.804 -15.737 861 HE3 LYS 100 3HE LYS 100 -0.918 0.669 -16.204 862 HZ1 LYS 100 3HZ LYS 100 -3.292 0.022 -14.549 863 HZ2 LYS 100 1HZ LYS 100 -2.077 -1.063 -14.987 864 HZ3 LYS 100 2HZ LYS 100 -3.077 -0.392 -16.171 865 H LYS 101 H LYS 101 4.529 1.579 -15.547 866 HA LYS 101 HA LYS 101 4.676 0.313 -18.155 867 HB2 LYS 101 2HB LYS 101 5.579 2.575 -17.779 868 HB3 LYS 101 3HB LYS 101 6.670 1.975 -16.537 869 HG2 LYS 101 2HG LYS 101 7.959 0.743 -18.198 870 HG3 LYS 101 3HG LYS 101 6.817 1.174 -19.471 871 HD2 LYS 101 2HD LYS 101 8.506 3.165 -17.900 872 HD3 LYS 101 3HD LYS 101 8.898 2.568 -19.513 873 HE2 LYS 101 2HE LYS 101 6.828 3.574 -20.401 874 HE3 LYS 101 3HE LYS 101 6.404 4.147 -18.785 875 HZ1 LYS 101 3HZ LYS 101 8.345 5.558 -18.796 876 HZ2 LYS 101 1HZ LYS 101 7.404 5.876 -20.163 877 HZ3 LYS 101 2HZ LYS 101 8.819 4.966 -20.309 878 H ASP 102 H ASP 102 6.075 -0.105 -14.926 879 HA ASP 102 HA ASP 102 7.893 -2.208 -15.498 880 HB2 ASP 102 2HB ASP 102 7.976 -0.845 -13.423 881 HB3 ASP 102 3HB ASP 102 6.441 -1.523 -12.892 882 H GLY 103 H GLY 103 4.646 -2.297 -14.026 883 HA2 GLY 103 2HA GLY 103 3.102 -3.848 -15.410 884 HA3 GLY 103 3HA GLY 103 4.224 -5.096 -14.880 885 H VAL 104 H VAL 104 3.410 -2.393 -12.858 886 HA VAL 104 HA VAL 104 2.178 -4.134 -10.828 887 HB VAL 104 HB VAL 104 3.258 -1.263 -10.618 888 HG11 VAL 104 1HG1 VAL 104 1.560 -1.715 -8.883 889 HG12 VAL 104 2HG1 VAL 104 3.167 -1.581 -8.167 890 HG13 VAL 104 3HG1 VAL 104 2.431 -3.171 -8.389 891 HG21 VAL 104 3HG2 VAL 104 4.543 -3.874 -9.741 892 HG22 VAL 104 1HG2 VAL 104 5.219 -2.251 -9.540 893 HG23 VAL 104 2HG2 VAL 104 5.011 -2.921 -11.159 894 H ASP 105 H ASP 105 0.124 -3.712 -9.994 895 HA ASP 105 HA ASP 105 -1.648 -2.106 -11.632 896 HB2 ASP 105 2HB ASP 105 -2.224 -4.433 -10.573 897 HB3 ASP 105 3HB ASP 105 -2.490 -3.538 -9.092 898 H VAL 106 H VAL 106 -2.794 -0.287 -10.929 899 HA VAL 106 HA VAL 106 -1.938 0.992 -8.402 900 HB VAL 106 HB VAL 106 -2.413 2.441 -11.055 901 HG11 VAL 106 1HG1 VAL 106 -1.522 4.425 -9.855 902 HG12 VAL 106 2HG1 VAL 106 -1.471 3.485 -8.364 903 HG13 VAL 106 3HG1 VAL 106 -3.019 3.822 -9.142 904 HG21 VAL 106 3HG2 VAL 106 0.242 1.941 -9.661 905 HG22 VAL 106 1HG2 VAL 106 -0.007 2.913 -11.116 906 HG23 VAL 106 2HG2 VAL 106 -0.301 1.172 -11.153 907 H ARG 107 H ARG 107 -3.553 1.932 -7.237 908 HA ARG 107 HA ARG 107 -6.242 2.341 -8.404 909 HB2 ARG 107 2HB ARG 107 -5.440 1.990 -5.468 910 HB3 ARG 107 3HB ARG 107 -7.073 2.310 -6.039 911 HG2 ARG 107 2HG ARG 107 -5.445 -0.165 -6.634 912 HG3 ARG 107 3HG ARG 107 -6.749 -0.050 -5.455 913 HD2 ARG 107 2HD ARG 107 -8.338 -0.384 -7.049 914 HD3 ARG 107 3HD ARG 107 -7.646 0.839 -8.114 915 HE ARG 107 HE ARG 107 -5.969 -1.028 -8.693 916 HH11 ARG 107 1HH1 ARG 107 -9.368 -1.573 -7.988 917 HH12 ARG 107 2HH1 ARG 107 -9.452 -2.994 -8.968 918 HH21 ARG 107 1HH2 ARG 107 -6.134 -2.885 -9.977 919 HH22 ARG 107 2HH2 ARG 107 -7.632 -3.733 -10.092 920 H VAL 108 H VAL 108 -6.107 4.476 -9.136 921 HA VAL 108 HA VAL 108 -5.300 6.550 -7.203 922 HB VAL 108 HB VAL 108 -5.854 8.209 -9.063 923 HG11 VAL 108 1HG1 VAL 108 -3.673 6.173 -9.689 924 HG12 VAL 108 2HG1 VAL 108 -3.537 7.535 -8.577 925 HG13 VAL 108 3HG1 VAL 108 -3.748 7.829 -10.302 926 HG21 VAL 108 3HG2 VAL 108 -5.996 7.384 -11.406 927 HG22 VAL 108 1HG2 VAL 108 -7.359 6.817 -10.439 928 HG23 VAL 108 2HG2 VAL 108 -6.035 5.718 -10.819 929 H THR 109 H THR 109 -6.743 7.157 -5.787 930 HA THR 109 HA THR 109 -9.599 6.509 -6.197 931 HB THR 109 HB THR 109 -9.710 6.750 -3.680 932 HG1 THR 109 HG1 THR 109 -7.396 6.565 -2.784 933 HG21 THR 109 3HG2 THR 109 -8.505 4.641 -3.186 934 HG22 THR 109 1HG2 THR 109 -7.663 4.753 -4.731 935 HG23 THR 109 2HG2 THR 109 -9.415 4.519 -4.694 936 H ASP 110 H ASP 110 -7.372 9.101 -5.387 937 HA ASP 110 HA ASP 110 -7.398 11.321 -5.602 938 HB2 ASP 110 2HB ASP 110 -8.703 10.990 -7.701 939 HB3 ASP 110 3HB ASP 110 -10.189 11.095 -6.776 940 H ASN 111 H ASN 111 -10.784 10.601 -4.693 941 HA ASN 111 HA ASN 111 -10.670 12.386 -2.401 942 HB2 ASN 111 2HB ASN 111 -12.821 10.357 -3.153 943 HB3 ASN 111 3HB ASN 111 -12.972 11.636 -1.953 944 HD21 ASN 111 1HD2 ASN 111 -11.550 13.622 -3.723 945 HD22 ASN 111 2HD2 ASN 111 -12.708 14.032 -4.933 946 H GLU 112 H GLU 112 -10.183 11.792 -0.328 947 HA GLU 112 HA GLU 112 -9.217 9.227 0.404 948 HB2 GLU 112 2HB GLU 112 -9.454 10.133 2.820 949 HB3 GLU 112 3HB GLU 112 -8.374 10.981 1.722 950 HG2 GLU 112 2HG GLU 112 -9.581 12.604 3.023 951 HG3 GLU 112 3HG GLU 112 -10.097 12.708 1.349 952 H ASP 113 H ASP 113 -12.400 10.614 0.400 953 HA ASP 113 HA ASP 113 -13.885 8.825 1.940 954 HB2 ASP 113 2HB ASP 113 -14.891 10.856 1.130 955 HB3 ASP 113 3HB ASP 113 -14.533 10.463 -0.543 956 H GLU 114 H GLU 114 -13.018 8.729 -1.514 957 HA GLU 114 HA GLU 114 -14.214 6.215 -2.081 958 HB2 GLU 114 2HB GLU 114 -13.754 7.837 -3.864 959 HB3 GLU 114 3HB GLU 114 -12.023 7.729 -3.565 960 HG2 GLU 114 2HG GLU 114 -12.660 6.481 -5.580 961 HG3 GLU 114 3HG GLU 114 -12.011 5.399 -4.352 962 H ALA 115 H ALA 115 -10.896 7.192 -1.229 963 HA ALA 115 HA ALA 115 -9.592 4.722 -1.497 964 HB1 ALA 115 3HB ALA 115 -8.984 6.966 0.451 965 HB2 ALA 115 1HB ALA 115 -8.401 6.852 -1.211 966 HB3 ALA 115 2HB ALA 115 -7.872 5.674 -0.008 967 H LYS 116 H LYS 116 -11.386 6.133 1.185 968 HA LYS 116 HA LYS 116 -10.826 4.361 3.284 969 HB2 LYS 116 2HB LYS 116 -11.810 6.704 3.270 970 HB3 LYS 116 3HB LYS 116 -13.340 5.999 2.779 971 HG2 LYS 116 2HG LYS 116 -13.526 4.834 4.913 972 HG3 LYS 116 3HG LYS 116 -11.918 5.396 5.399 973 HD2 LYS 116 2HD LYS 116 -14.299 7.185 4.775 974 HD3 LYS 116 3HD LYS 116 -13.722 6.804 6.399 975 HE2 LYS 116 2HE LYS 116 -11.628 7.989 5.976 976 HE3 LYS 116 3HE LYS 116 -12.055 8.225 4.284 977 HZ1 LYS 116 3HZ LYS 116 -12.453 10.247 5.416 978 HZ2 LYS 116 1HZ LYS 116 -13.320 9.480 6.652 979 HZ3 LYS 116 2HZ LYS 116 -13.971 9.571 5.104 980 H LYS 117 H LYS 117 -13.317 4.345 0.754 981 HA LYS 117 HA LYS 117 -14.851 2.107 1.607 982 HB2 LYS 117 2HB LYS 117 -14.385 2.975 -1.285 983 HB3 LYS 117 3HB LYS 117 -15.750 2.053 -0.666 984 HG2 LYS 117 2HG LYS 117 -16.523 4.046 0.581 985 HG3 LYS 117 3HG LYS 117 -15.140 4.952 -0.032 986 HD2 LYS 117 2HD LYS 117 -16.082 4.277 -2.409 987 HD3 LYS 117 3HD LYS 117 -17.585 3.978 -1.531 988 HE2 LYS 117 2HE LYS 117 -16.073 6.600 -1.739 989 HE3 LYS 117 3HE LYS 117 -17.632 6.213 -2.462 990 HZ1 LYS 117 3HZ LYS 117 -17.083 6.405 0.446 991 HZ2 LYS 117 1HZ LYS 117 -18.582 6.068 -0.261 992 HZ3 LYS 117 2HZ LYS 117 -17.854 7.577 -0.495 993 H ARG 118 H ARG 118 -12.170 2.482 -0.700 994 HA ARG 118 HA ARG 118 -12.101 -0.111 -1.749 995 HB2 ARG 118 2HB ARG 118 -9.859 1.954 -1.566 996 HB3 ARG 118 3HB ARG 118 -9.797 0.512 -2.571 997 HG2 ARG 118 2HG ARG 118 -11.847 2.723 -2.863 998 HG3 ARG 118 3HG ARG 118 -10.380 2.583 -3.829 999 HD2 ARG 118 2HD ARG 118 -11.183 0.452 -4.767 1000 HD3 ARG 118 3HD ARG 118 -12.615 0.528 -3.736 1001 HE ARG 118 HE ARG 118 -13.501 2.231 -5.052 1002 HH11 ARG 118 1HH1 ARG 118 -10.350 1.318 -6.321 1003 HH12 ARG 118 2HH1 ARG 118 -10.616 2.106 -7.844 1004 HH21 ARG 118 1HH2 ARG 118 -13.843 3.186 -7.050 1005 HH22 ARG 118 2HH2 ARG 118 -12.592 3.162 -8.253 1006 H LEU 119 H LEU 119 -10.366 1.295 1.006 1007 HA LEU 119 HA LEU 119 -8.462 -0.700 1.496 1008 HB2 LEU 119 2HB LEU 119 -9.852 1.121 3.506 1009 HB3 LEU 119 3HB LEU 119 -8.393 0.195 3.837 1010 HG LEU 119 HG LEU 119 -8.665 2.501 1.885 1011 HD11 LEU 119 1HD1 LEU 119 -8.572 3.191 4.222 1012 HD12 LEU 119 2HD1 LEU 119 -7.123 3.676 3.349 1013 HD13 LEU 119 3HD1 LEU 119 -7.068 2.292 4.441 1014 HD21 LEU 119 3HD2 LEU 119 -6.240 0.772 2.415 1015 HD22 LEU 119 1HD2 LEU 119 -6.251 2.267 1.474 1016 HD23 LEU 119 2HD2 LEU 119 -7.163 0.871 0.911 1017 H LYS 120 H LYS 120 -11.678 -0.268 2.920 1018 HA LYS 120 HA LYS 120 -11.724 -2.571 4.550 1019 HB2 LYS 120 2HB LYS 120 -13.260 -0.676 4.894 1020 HB3 LYS 120 3HB LYS 120 -14.005 -0.959 3.321 1021 HG2 LYS 120 2HG LYS 120 -14.737 -3.235 4.176 1022 HG3 LYS 120 3HG LYS 120 -14.165 -2.745 5.775 1023 HD2 LYS 120 2HD LYS 120 -15.803 -0.934 5.862 1024 HD3 LYS 120 3HD LYS 120 -16.269 -1.218 4.182 1025 HE2 LYS 120 2HE LYS 120 -17.124 -3.464 4.824 1026 HE3 LYS 120 3HE LYS 120 -16.708 -3.123 6.504 1027 HZ1 LYS 120 3HZ LYS 120 -18.252 -1.254 6.457 1028 HZ2 LYS 120 1HZ LYS 120 -19.033 -2.709 6.097 1029 HZ3 LYS 120 2HZ LYS 120 -18.669 -1.618 4.862 1030 H GLU 121 H GLU 121 -12.811 -1.975 1.223 1031 HA GLU 121 HA GLU 121 -14.121 -4.399 0.673 1032 HB2 GLU 121 2HB GLU 121 -12.821 -2.298 -1.087 1033 HB3 GLU 121 3HB GLU 121 -13.598 -3.719 -1.789 1034 HG2 GLU 121 2HG GLU 121 -15.731 -3.121 -0.861 1035 HG3 GLU 121 3HG GLU 121 -15.016 -1.847 0.122 1036 H LEU 122 H LEU 122 -10.722 -3.498 0.300 1037 HA LEU 122 HA LEU 122 -9.954 -5.914 -1.054 1038 HB2 LEU 122 2HB LEU 122 -8.186 -3.882 0.381 1039 HB3 LEU 122 3HB LEU 122 -7.629 -5.137 -0.718 1040 HG LEU 122 HG LEU 122 -9.316 -2.715 -1.455 1041 HD11 LEU 122 1HD1 LEU 122 -7.392 -2.018 -2.790 1042 HD12 LEU 122 2HD1 LEU 122 -6.479 -3.418 -2.218 1043 HD13 LEU 122 3HD1 LEU 122 -6.986 -2.167 -1.082 1044 HD21 LEU 122 3HD2 LEU 122 -9.191 -3.420 -3.795 1045 HD22 LEU 122 1HD2 LEU 122 -10.055 -4.608 -2.820 1046 HD23 LEU 122 2HD2 LEU 122 -8.392 -4.919 -3.320 1047 H LEU 123 H LEU 123 -10.052 -4.841 2.329 1048 HA LEU 123 HA LEU 123 -8.773 -7.106 3.496 1049 HB2 LEU 123 2HB LEU 123 -10.528 -4.901 4.519 1050 HB3 LEU 123 3HB LEU 123 -10.481 -6.353 5.504 1051 HG LEU 123 HG LEU 123 -8.031 -6.137 5.750 1052 HD11 LEU 123 1HD1 LEU 123 -8.243 -3.559 4.173 1053 HD12 LEU 123 2HD1 LEU 123 -7.452 -5.041 3.636 1054 HD13 LEU 123 3HD1 LEU 123 -6.809 -4.152 5.015 1055 HD21 LEU 123 3HD2 LEU 123 -8.048 -4.138 7.215 1056 HD22 LEU 123 1HD2 LEU 123 -9.482 -5.144 7.431 1057 HD23 LEU 123 2HD2 LEU 123 -9.591 -3.646 6.504 1058 H GLU 124 H GLU 124 -12.130 -6.476 2.598 1059 HA GLU 124 HA GLU 124 -13.335 -8.830 3.616 1060 HB2 GLU 124 2HB GLU 124 -14.140 -7.024 1.292 1061 HB3 GLU 124 3HB GLU 124 -15.171 -8.300 1.936 1062 HG2 GLU 124 2HG GLU 124 -15.303 -7.174 4.097 1063 HG3 GLU 124 3HG GLU 124 -14.164 -5.942 3.564 1064 H LYS 125 H LYS 125 -11.421 -8.248 0.760 1065 HA LYS 125 HA LYS 125 -12.098 -10.901 -0.390 1066 HB2 LYS 125 2HB LYS 125 -11.043 -8.431 -1.835 1067 HB3 LYS 125 3HB LYS 125 -11.545 -9.947 -2.583 1068 HG2 LYS 125 2HG LYS 125 -13.867 -9.543 -1.863 1069 HG3 LYS 125 3HG LYS 125 -13.359 -8.043 -1.078 1070 HD2 LYS 125 2HD LYS 125 -12.572 -7.226 -3.345 1071 HD3 LYS 125 3HD LYS 125 -13.322 -8.661 -4.053 1072 HE2 LYS 125 2HE LYS 125 -15.514 -7.942 -3.105 1073 HE3 LYS 125 3HE LYS 125 -14.738 -6.479 -2.490 1074 HZ1 LYS 125 3HZ LYS 125 -15.017 -7.273 -5.334 1075 HZ2 LYS 125 1HZ LYS 125 -14.153 -5.923 -4.796 1076 HZ3 LYS 125 2HZ LYS 125 -15.823 -6.011 -4.553 1077 H VAL 126 H VAL 126 -9.885 -9.894 1.578 1078 HA VAL 126 HA VAL 126 -7.751 -10.242 2.176 1079 HB VAL 126 HB VAL 126 -8.563 -12.648 1.738 1080 HG11 VAL 126 1HG1 VAL 126 -7.376 -14.014 0.070 1081 HG12 VAL 126 2HG1 VAL 126 -6.624 -12.559 -0.588 1082 HG13 VAL 126 3HG1 VAL 126 -8.371 -12.774 -0.698 1083 HG21 VAL 126 3HG2 VAL 126 -6.674 -12.140 3.213 1084 HG22 VAL 126 1HG2 VAL 126 -5.574 -12.154 1.832 1085 HG23 VAL 126 2HG2 VAL 126 -6.387 -13.639 2.330 1086 H GLY 127 H GLY 127 -8.299 -8.759 -0.405 1087 HA2 GLY 127 2HA GLY 127 -6.290 -7.309 -1.028 1088 HA3 GLY 127 3HA GLY 127 -5.676 -8.794 -1.741 1089 H SER 128 H SER 128 -6.445 -9.489 -3.661 1090 HA SER 128 HA SER 128 -7.481 -9.586 -5.660 1091 HB2 SER 128 2HB SER 128 -9.760 -8.070 -4.330 1092 HB3 SER 128 3HB SER 128 -9.865 -8.930 -5.869 1093 HG SER 128 HG SER 128 -9.318 -10.027 -3.320 1094 H LEU 129 H LEU 129 -8.763 -7.928 -7.334 1095 HA LEU 129 HA LEU 129 -7.856 -5.198 -7.222 1096 HB2 LEU 129 2HB LEU 129 -6.388 -5.217 -9.154 1097 HB3 LEU 129 3HB LEU 129 -5.752 -6.287 -7.925 1098 HG LEU 129 HG LEU 129 -7.265 -7.303 -10.377 1099 HD11 LEU 129 1HD1 LEU 129 -5.081 -7.822 -11.399 1100 HD12 LEU 129 2HD1 LEU 129 -4.252 -7.046 -10.047 1101 HD13 LEU 129 3HD1 LEU 129 -5.263 -6.089 -11.129 1102 HD21 LEU 129 3HD2 LEU 129 -5.417 -8.777 -8.458 1103 HD22 LEU 129 1HD2 LEU 129 -6.205 -9.469 -9.882 1104 HD23 LEU 129 2HD2 LEU 129 -7.174 -8.921 -8.517 1105 H GLU 130 H GLU 130 -10.027 -7.517 -8.340 1106 HA GLU 130 HA GLU 130 -10.799 -6.099 -10.773 1107 HB2 GLU 130 2HB GLU 130 -10.956 -8.626 -10.471 1108 HB3 GLU 130 3HB GLU 130 -12.329 -8.347 -9.405 1109 HG2 GLU 130 2HG GLU 130 -13.514 -7.196 -11.279 1110 HG3 GLU 130 3HG GLU 130 -12.158 -7.567 -12.340 1111 H HIS 131 H HIS 131 -11.025 -4.055 -9.611 1112 HA HIS 131 HA HIS 131 -13.749 -3.346 -9.278 1113 HB2 HIS 131 2HB HIS 131 -13.277 -4.216 -6.934 1114 HB3 HIS 131 3HB HIS 131 -12.045 -2.969 -6.760 1115 HD1 HIS 131 HD1 HIS 131 -15.737 -3.486 -6.796 1116 HD2 HIS 131 HD2 HIS 131 -13.086 -0.321 -6.430 1117 HE1 HIS 131 HE1 HIS 131 -17.111 -1.544 -6.037 1118 HE2 HIS 131 HE2 HIS 131 -15.446 0.271 -5.583 1119 H HIS 132 H HIS 132 -13.210 -1.988 -10.986 1120 HA HIS 132 HA HIS 132 -11.156 0.109 -10.649 1121 HB2 HIS 132 2HB HIS 132 -12.805 -0.577 -13.128 1122 HB3 HIS 132 3HB HIS 132 -11.412 0.500 -13.061 1123 HD1 HIS 132 HD1 HIS 132 -12.363 -3.080 -13.300 1124 HD2 HIS 132 HD2 HIS 132 -8.888 -0.846 -12.836 1125 HE1 HIS 132 HE1 HIS 132 -10.478 -4.673 -13.729 1126 HE2 HIS 132 HE2 HIS 132 -8.405 -3.271 -13.581 1127 H HIS 133 H HIS 133 -14.593 -0.430 -11.103 1128 HA HIS 133 HA HIS 133 -16.443 0.728 -10.630 1129 HB2 HIS 133 2HB HIS 133 -15.319 1.863 -8.734 1130 HB3 HIS 133 3HB HIS 133 -14.687 3.084 -9.828 1131 HD1 HIS 133 HD1 HIS 133 -15.961 5.181 -9.705 1132 HD2 HIS 133 HD2 HIS 133 -18.372 1.912 -8.863 1133 HE1 HIS 133 HE1 HIS 133 -18.206 6.139 -9.136 1134 HE2 HIS 133 HE2 HIS 133 -19.688 4.140 -8.825 1135 H HIS 134 H HIS 134 -14.017 2.585 -12.472 1136 HA HIS 134 HA HIS 134 -15.939 2.663 -14.703 1137 HB2 HIS 134 2HB HIS 134 -15.998 4.932 -13.688 1138 HB3 HIS 134 3HB HIS 134 -14.247 5.059 -13.823 1139 HD1 HIS 134 HD1 HIS 134 -13.619 6.500 -15.749 1140 HD2 HIS 134 HD2 HIS 134 -17.112 4.401 -16.533 1141 HE1 HIS 134 HE1 HIS 134 -14.293 7.166 -18.070 1142 HE2 HIS 134 HE2 HIS 134 -16.491 6.011 -18.445 1143 H HIS 135 H HIS 135 -14.997 1.583 -16.303 1144 HA HIS 135 HA HIS 135 -12.204 1.071 -16.579 1145 HB2 HIS 135 2HB HIS 135 -13.808 -0.481 -17.563 1146 HB3 HIS 135 3HB HIS 135 -14.525 0.791 -18.547 1147 HD1 HIS 135 HD1 HIS 135 -13.498 1.178 -20.838 1148 HD2 HIS 135 HD2 HIS 135 -11.179 -1.337 -18.484 1149 HE1 HIS 135 HE1 HIS 135 -11.703 0.305 -22.353 1150 HE2 HIS 135 HE2 HIS 135 -10.205 -1.049 -20.862 1151 H HIS 136 H HIS 136 -10.669 2.245 -17.559 1152 HA HIS 136 HA HIS 136 -11.380 4.579 -19.243 1153 HB2 HIS 136 2HB HIS 136 -8.951 4.097 -17.454 1154 HB3 HIS 136 3HB HIS 136 -8.979 5.353 -18.688 1155 HD1 HIS 136 HD1 HIS 136 -9.771 7.559 -17.926 1156 HD2 HIS 136 HD2 HIS 136 -11.194 4.514 -15.485 1157 HE1 HIS 136 HE1 HIS 136 -11.001 8.703 -16.075 1158 HE2 HIS 136 HE2 HIS 136 -11.651 6.861 -14.502 Start of MODEL 9 1 H1 MET 1 1H MET 1 -3.300 -15.866 -1.029 2 H2 MET 1 2H MET 1 -4.061 -14.393 -1.332 3 H3 MET 1 3H MET 1 -4.913 -15.643 -0.574 4 HA MET 1 HA MET 1 -4.244 -13.928 0.995 5 HB2 MET 1 2HB MET 1 -2.878 -16.635 1.332 6 HB3 MET 1 3HB MET 1 -3.067 -15.472 2.638 7 HG2 MET 1 2HG MET 1 -5.537 -15.623 2.358 8 HG3 MET 1 3HG MET 1 -5.287 -16.877 1.142 9 HE1 MET 1 3HE MET 1 -6.657 -18.892 4.244 10 HE2 MET 1 1HE MET 1 -6.857 -18.608 2.517 11 HE3 MET 1 2HE MET 1 -7.159 -17.304 3.667 12 H GLY 2 H GLY 2 -2.343 -13.218 2.405 13 HA2 GLY 2 2HA GLY 2 -0.347 -12.103 2.621 14 HA3 GLY 2 3HA GLY 2 0.314 -13.170 1.390 15 H THR 3 H THR 3 -2.409 -10.926 1.054 16 HA THR 3 HA THR 3 -1.476 -9.891 -1.425 17 HB THR 3 HB THR 3 -3.653 -8.672 0.339 18 HG1 THR 3 HG1 THR 3 -4.586 -10.348 -1.581 19 HG21 THR 3 3HG2 THR 3 -3.308 -8.700 -2.688 20 HG22 THR 3 1HG2 THR 3 -3.051 -7.304 -1.637 21 HG23 THR 3 2HG2 THR 3 -4.668 -7.990 -1.818 22 H VAL 4 H VAL 4 -0.437 -7.933 -1.882 23 HA VAL 4 HA VAL 4 0.599 -6.375 0.425 24 HB VAL 4 HB VAL 4 1.647 -6.472 -2.457 25 HG11 VAL 4 1HG1 VAL 4 3.607 -5.241 -1.587 26 HG12 VAL 4 2HG1 VAL 4 2.846 -5.137 0.001 27 HG13 VAL 4 3HG1 VAL 4 2.120 -4.311 -1.379 28 HG21 VAL 4 3HG2 VAL 4 2.803 -7.765 0.040 29 HG22 VAL 4 1HG2 VAL 4 3.554 -7.756 -1.559 30 HG23 VAL 4 2HG2 VAL 4 2.030 -8.611 -1.303 31 H VAL 5 H VAL 5 -0.579 -4.596 0.784 32 HA VAL 5 HA VAL 5 -1.566 -3.001 -1.499 33 HB VAL 5 HB VAL 5 -3.559 -2.323 -0.032 34 HG11 VAL 5 1HG1 VAL 5 -4.918 -4.276 -0.688 35 HG12 VAL 5 2HG1 VAL 5 -3.446 -5.211 -0.967 36 HG13 VAL 5 3HG1 VAL 5 -3.802 -3.808 -1.975 37 HG21 VAL 5 3HG2 VAL 5 -2.805 -4.818 1.541 38 HG22 VAL 5 1HG2 VAL 5 -4.305 -3.899 1.725 39 HG23 VAL 5 2HG2 VAL 5 -2.759 -3.162 2.147 40 H ILE 6 H ILE 6 -0.659 -1.078 -1.511 41 HA ILE 6 HA ILE 6 0.734 -0.091 0.913 42 HB ILE 6 HB ILE 6 1.246 0.707 -1.994 43 HG12 ILE 6 2HG1 ILE 6 1.719 -1.722 -1.726 44 HG13 ILE 6 3HG1 ILE 6 3.184 -0.805 -2.039 45 HG21 ILE 6 1HG2 ILE 6 2.031 2.360 -0.374 46 HG22 ILE 6 2HG2 ILE 6 3.400 1.569 -1.153 47 HG23 ILE 6 3HG2 ILE 6 2.945 1.118 0.491 48 HD11 ILE 6 3HD1 ILE 6 3.762 -0.946 0.346 49 HD12 ILE 6 1HD1 ILE 6 3.560 -2.531 -0.400 50 HD13 ILE 6 2HD1 ILE 6 2.289 -1.880 0.632 51 H VAL 7 H VAL 7 -0.639 1.358 1.917 52 HA VAL 7 HA VAL 7 -2.385 3.104 0.357 53 HB VAL 7 HB VAL 7 -2.058 2.915 3.392 54 HG11 VAL 7 1HG1 VAL 7 -4.173 4.212 3.510 55 HG12 VAL 7 2HG1 VAL 7 -4.160 4.396 1.755 56 HG13 VAL 7 3HG1 VAL 7 -2.889 5.139 2.729 57 HG21 VAL 7 3HG2 VAL 7 -4.199 1.697 3.357 58 HG22 VAL 7 1HG2 VAL 7 -2.966 0.846 2.423 59 HG23 VAL 7 2HG2 VAL 7 -4.220 1.769 1.592 60 H VAL 8 H VAL 8 -1.391 4.712 -0.544 61 HA VAL 8 HA VAL 8 0.572 6.385 0.886 62 HB VAL 8 HB VAL 8 0.028 6.305 -2.120 63 HG11 VAL 8 1HG1 VAL 8 2.182 7.445 -2.347 64 HG12 VAL 8 2HG1 VAL 8 2.387 7.445 -0.595 65 HG13 VAL 8 3HG1 VAL 8 1.082 8.381 -1.330 66 HG21 VAL 8 3HG2 VAL 8 2.216 4.814 -0.652 67 HG22 VAL 8 1HG2 VAL 8 2.012 4.904 -2.402 68 HG23 VAL 8 2HG2 VAL 8 0.801 4.086 -1.411 69 H SER 9 H SER 9 0.148 8.587 1.018 70 HA SER 9 HA SER 9 -2.207 9.792 -0.221 71 HB2 SER 9 2HB SER 9 -1.934 9.657 2.824 72 HB3 SER 9 3HB SER 9 -3.133 10.613 1.955 73 HG SER 9 HG SER 9 -3.358 8.158 1.051 74 H ASN 10 H ASN 10 -2.297 12.186 0.475 75 HA ASN 10 HA ASN 10 0.408 13.328 0.481 76 HB2 ASN 10 2HB ASN 10 -2.313 14.636 0.008 77 HB3 ASN 10 3HB ASN 10 -0.777 15.496 -0.024 78 HD21 ASN 10 1HD2 ASN 10 -0.773 16.108 -2.141 79 HD22 ASN 10 2HD2 ASN 10 -0.760 15.007 -3.468 80 H ASP 11 H ASP 11 -2.708 13.840 2.176 81 HA ASP 11 HA ASP 11 -1.498 15.311 4.342 82 HB2 ASP 11 2HB ASP 11 -4.314 14.235 3.936 83 HB3 ASP 11 3HB ASP 11 -3.834 15.133 5.368 84 H GLU 12 H GLU 12 -1.263 14.694 6.433 85 HA GLU 12 HA GLU 12 -0.483 12.024 7.053 86 HB2 GLU 12 2HB GLU 12 -1.027 14.347 8.965 87 HB3 GLU 12 3HB GLU 12 -0.066 12.912 9.321 88 HG2 GLU 12 2HG GLU 12 1.622 13.583 7.715 89 HG3 GLU 12 3HG GLU 12 0.634 14.945 7.194 90 H ARG 13 H ARG 13 -3.338 13.969 7.654 91 HA ARG 13 HA ARG 13 -4.556 12.292 9.620 92 HB2 ARG 13 2HB ARG 13 -5.599 14.628 7.984 93 HB3 ARG 13 3HB ARG 13 -6.663 13.698 9.031 94 HG2 ARG 13 2HG ARG 13 -5.916 15.737 10.162 95 HG3 ARG 13 3HG ARG 13 -5.320 14.303 10.993 96 HD2 ARG 13 2HD ARG 13 -3.104 14.617 9.947 97 HD3 ARG 13 3HD ARG 13 -3.696 16.054 9.113 98 HE ARG 13 HE ARG 13 -4.118 16.480 11.815 99 HH11 ARG 13 1HH1 ARG 13 -1.332 15.931 9.715 100 HH12 ARG 13 2HH1 ARG 13 -0.246 16.834 10.712 101 HH21 ARG 13 1HH2 ARG 13 -2.691 17.656 13.096 102 HH22 ARG 13 2HH2 ARG 13 -1.026 17.814 12.634 103 H ILE 14 H ILE 14 -4.615 12.370 6.117 104 HA ILE 14 HA ILE 14 -6.915 10.696 5.798 105 HB ILE 14 HB ILE 14 -4.614 11.179 3.843 106 HG12 ILE 14 2HG1 ILE 14 -5.651 13.295 4.281 107 HG13 ILE 14 3HG1 ILE 14 -6.308 12.761 2.745 108 HG21 ILE 14 1HG2 ILE 14 -6.144 10.397 2.068 109 HG22 ILE 14 2HG2 ILE 14 -7.370 10.016 3.278 110 HG23 ILE 14 3HG2 ILE 14 -5.849 9.124 3.256 111 HD11 ILE 14 3HD1 ILE 14 -8.035 13.769 4.055 112 HD12 ILE 14 1HD1 ILE 14 -7.698 12.718 5.429 113 HD13 ILE 14 2HD1 ILE 14 -8.376 12.043 3.942 114 H LEU 15 H LEU 15 -3.404 10.107 6.046 115 HA LEU 15 HA LEU 15 -3.491 7.293 5.771 116 HB2 LEU 15 2HB LEU 15 -1.545 9.097 7.238 117 HB3 LEU 15 3HB LEU 15 -1.310 7.358 7.119 118 HG LEU 15 HG LEU 15 -1.460 9.244 4.736 119 HD11 LEU 15 1HD1 LEU 15 0.944 8.915 4.529 120 HD12 LEU 15 2HD1 LEU 15 0.962 7.924 5.990 121 HD13 LEU 15 3HD1 LEU 15 0.548 9.638 6.086 122 HD21 LEU 15 3HD2 LEU 15 -0.772 6.280 4.872 123 HD22 LEU 15 1HD2 LEU 15 -0.664 7.301 3.434 124 HD23 LEU 15 2HD2 LEU 15 -2.233 6.984 4.171 125 H GLU 16 H GLU 16 -3.810 9.390 8.644 126 HA GLU 16 HA GLU 16 -3.873 7.328 10.600 127 HB2 GLU 16 2HB GLU 16 -3.371 9.664 11.206 128 HB3 GLU 16 3HB GLU 16 -4.985 10.168 10.708 129 HG2 GLU 16 2HG GLU 16 -5.968 8.753 12.500 130 HG3 GLU 16 3HG GLU 16 -4.343 8.298 13.014 131 H GLU 17 H GLU 17 -6.451 9.189 9.026 132 HA GLU 17 HA GLU 17 -8.682 8.088 10.341 133 HB2 GLU 17 2HB GLU 17 -8.698 10.220 9.117 134 HB3 GLU 17 3HB GLU 17 -8.403 9.385 7.596 135 HG2 GLU 17 2HG GLU 17 -10.600 8.321 7.741 136 HG3 GLU 17 3HG GLU 17 -10.891 9.098 9.297 137 H LEU 18 H LEU 18 -7.215 7.305 7.187 138 HA LEU 18 HA LEU 18 -8.930 5.118 6.547 139 HB2 LEU 18 2HB LEU 18 -6.349 6.188 5.408 140 HB3 LEU 18 3HB LEU 18 -6.888 4.598 4.910 141 HG LEU 18 HG LEU 18 -8.951 5.526 3.962 142 HD11 LEU 18 1HD1 LEU 18 -8.001 8.262 4.835 143 HD12 LEU 18 2HD1 LEU 18 -9.379 7.377 5.493 144 HD13 LEU 18 3HD1 LEU 18 -9.404 7.922 3.817 145 HD21 LEU 18 3HD2 LEU 18 -7.984 6.780 2.085 146 HD22 LEU 18 1HD2 LEU 18 -6.966 5.409 2.530 147 HD23 LEU 18 2HD2 LEU 18 -6.503 7.044 3.011 148 H LEU 19 H LEU 19 -5.955 5.381 8.401 149 HA LEU 19 HA LEU 19 -5.151 2.684 8.496 150 HB2 LEU 19 2HB LEU 19 -3.726 4.478 9.345 151 HB3 LEU 19 3HB LEU 19 -4.911 4.878 10.576 152 HG LEU 19 HG LEU 19 -4.491 2.590 11.610 153 HD11 LEU 19 1HD1 LEU 19 -2.158 2.512 9.686 154 HD12 LEU 19 2HD1 LEU 19 -3.561 1.439 9.689 155 HD13 LEU 19 3HD1 LEU 19 -2.433 1.408 11.038 156 HD21 LEU 19 3HD2 LEU 19 -2.434 3.241 12.731 157 HD22 LEU 19 1HD2 LEU 19 -3.515 4.620 12.548 158 HD23 LEU 19 2HD2 LEU 19 -2.111 4.456 11.490 159 H GLU 20 H GLU 20 -7.331 4.538 10.561 160 HA GLU 20 HA GLU 20 -7.945 2.513 12.432 161 HB2 GLU 20 2HB GLU 20 -9.619 4.942 11.650 162 HB3 GLU 20 3HB GLU 20 -9.747 4.025 13.153 163 HG2 GLU 20 2HG GLU 20 -7.458 4.700 13.783 164 HG3 GLU 20 3HG GLU 20 -7.296 5.581 12.265 165 H VAL 21 H VAL 21 -9.286 3.349 9.312 166 HA VAL 21 HA VAL 21 -11.623 1.765 9.294 167 HB VAL 21 HB VAL 21 -9.818 2.626 6.983 168 HG11 VAL 21 1HG1 VAL 21 -11.754 2.238 5.484 169 HG12 VAL 21 2HG1 VAL 21 -12.653 1.539 6.833 170 HG13 VAL 21 3HG1 VAL 21 -11.198 0.740 6.238 171 HG21 VAL 21 3HG2 VAL 21 -11.456 4.439 6.656 172 HG22 VAL 21 1HG2 VAL 21 -10.748 4.506 8.269 173 HG23 VAL 21 2HG2 VAL 21 -12.378 3.868 8.048 174 H VAL 22 H VAL 22 -8.233 1.018 8.459 175 HA VAL 22 HA VAL 22 -8.710 -1.643 7.512 176 HB VAL 22 HB VAL 22 -6.055 -0.496 8.519 177 HG11 VAL 22 1HG1 VAL 22 -6.634 -2.813 6.628 178 HG12 VAL 22 2HG1 VAL 22 -6.027 -2.942 8.280 179 HG13 VAL 22 3HG1 VAL 22 -5.029 -2.198 7.029 180 HG21 VAL 22 3HG2 VAL 22 -6.989 0.972 6.775 181 HG22 VAL 22 1HG2 VAL 22 -7.188 -0.406 5.696 182 HG23 VAL 22 2HG2 VAL 22 -5.571 0.117 6.171 183 H LEU 23 H LEU 23 -7.482 -0.259 10.548 184 HA LEU 23 HA LEU 23 -6.956 -2.562 12.018 185 HB2 LEU 23 2HB LEU 23 -7.864 0.187 12.946 186 HB3 LEU 23 3HB LEU 23 -7.270 -1.052 14.036 187 HG LEU 23 HG LEU 23 -5.634 0.205 11.799 188 HD11 LEU 23 1HD1 LEU 23 -5.498 0.713 14.789 189 HD12 LEU 23 2HD1 LEU 23 -6.115 1.830 13.567 190 HD13 LEU 23 3HD1 LEU 23 -4.412 1.381 13.566 191 HD21 LEU 23 3HD2 LEU 23 -4.919 -2.092 12.281 192 HD22 LEU 23 1HD2 LEU 23 -4.785 -1.712 14.002 193 HD23 LEU 23 2HD2 LEU 23 -3.713 -0.936 12.831 194 H LYS 24 H LYS 24 -10.033 -0.802 11.690 195 HA LYS 24 HA LYS 24 -11.401 -2.494 13.616 196 HB2 LYS 24 2HB LYS 24 -13.349 -1.135 13.265 197 HB3 LYS 24 3HB LYS 24 -11.966 -0.050 13.318 198 HG2 LYS 24 2HG LYS 24 -12.016 0.138 10.841 199 HG3 LYS 24 3HG LYS 24 -13.400 -0.958 10.793 200 HD2 LYS 24 2HD LYS 24 -14.176 1.350 10.582 201 HD3 LYS 24 3HD LYS 24 -14.733 0.677 12.114 202 HE2 LYS 24 2HE LYS 24 -12.805 1.842 13.240 203 HE3 LYS 24 3HE LYS 24 -12.427 2.602 11.691 204 HZ1 LYS 24 3HZ LYS 24 -14.638 3.611 11.699 205 HZ2 LYS 24 1HZ LYS 24 -13.764 4.064 13.075 206 HZ3 LYS 24 2HZ LYS 24 -14.982 2.899 13.190 207 H SER 25 H SER 25 -10.828 -2.503 10.186 208 HA SER 25 HA SER 25 -13.117 -4.099 9.451 209 HB2 SER 25 2HB SER 25 -11.950 -2.533 7.857 210 HB3 SER 25 3HB SER 25 -10.584 -3.646 7.817 211 HG SER 25 HG SER 25 -11.849 -5.164 6.822 212 H ASP 26 H ASP 26 -9.768 -4.703 10.367 213 HA ASP 26 HA ASP 26 -10.287 -7.479 10.885 214 HB2 ASP 26 2HB ASP 26 -9.848 -7.345 8.334 215 HB3 ASP 26 3HB ASP 26 -8.188 -6.920 8.740 216 HA PRO 27 HA PRO 27 -7.078 -6.218 13.814 217 HB2 PRO 27 2HB PRO 27 -7.068 -8.392 15.422 218 HB3 PRO 27 3HB PRO 27 -8.499 -7.347 15.304 219 HG2 PRO 27 2HG PRO 27 -7.984 -9.968 13.922 220 HG3 PRO 27 3HG PRO 27 -9.437 -9.427 14.796 221 HD2 PRO 27 2HD PRO 27 -9.209 -9.290 12.065 222 HD3 PRO 27 3HD PRO 27 -10.208 -8.166 13.011 223 H ASN 28 H ASN 28 -6.683 -9.078 11.785 224 HA ASN 28 HA ASN 28 -3.860 -9.391 12.626 225 HB2 ASN 28 2HB ASN 28 -3.923 -11.651 11.623 226 HB3 ASN 28 3HB ASN 28 -5.152 -11.452 12.863 227 HD21 ASN 28 1HD2 ASN 28 -4.626 -11.607 9.373 228 HD22 ASN 28 2HD2 ASN 28 -6.243 -12.067 8.970 229 H VAL 29 H VAL 29 -5.765 -8.250 9.950 230 HA VAL 29 HA VAL 29 -3.731 -8.369 7.947 231 HB VAL 29 HB VAL 29 -6.102 -6.471 8.304 232 HG11 VAL 29 1HG1 VAL 29 -5.669 -5.624 6.011 233 HG12 VAL 29 2HG1 VAL 29 -4.153 -6.529 5.968 234 HG13 VAL 29 3HG1 VAL 29 -4.357 -5.204 7.116 235 HG21 VAL 29 3HG2 VAL 29 -5.564 -8.647 6.255 236 HG22 VAL 29 1HG2 VAL 29 -7.030 -7.671 6.366 237 HG23 VAL 29 2HG2 VAL 29 -6.622 -8.808 7.654 238 H LYS 30 H LYS 30 -1.748 -7.573 8.242 239 HA LYS 30 HA LYS 30 -1.241 -6.001 10.594 240 HB2 LYS 30 2HB LYS 30 0.154 -7.974 10.034 241 HB3 LYS 30 3HB LYS 30 0.722 -7.162 8.577 242 HG2 LYS 30 2HG LYS 30 2.382 -7.051 10.411 243 HG3 LYS 30 3HG LYS 30 1.835 -5.445 9.915 244 HD2 LYS 30 2HD LYS 30 0.191 -5.528 11.871 245 HD3 LYS 30 3HD LYS 30 1.013 -6.994 12.403 246 HE2 LYS 30 2HE LYS 30 3.106 -5.736 12.673 247 HE3 LYS 30 3HE LYS 30 2.315 -4.276 12.067 248 HZ1 LYS 30 3HZ LYS 30 2.452 -4.362 14.512 249 HZ2 LYS 30 1HZ LYS 30 1.478 -5.739 14.517 250 HZ3 LYS 30 2HZ LYS 30 0.859 -4.271 13.961 251 H THR 31 H THR 31 -1.406 -3.883 10.548 252 HA THR 31 HA THR 31 -0.698 -2.262 8.224 253 HB THR 31 HB THR 31 -1.489 -0.347 9.643 254 HG1 THR 31 HG1 THR 31 -0.989 -1.697 11.682 255 HG21 THR 31 3HG2 THR 31 -3.451 -2.662 9.506 256 HG22 THR 31 1HG2 THR 31 -3.107 -1.522 8.202 257 HG23 THR 31 2HG2 THR 31 -3.874 -0.958 9.688 258 H VAL 32 H VAL 32 1.367 -1.706 7.959 259 HA VAL 32 HA VAL 32 3.067 -1.026 10.295 260 HB VAL 32 HB VAL 32 4.064 -2.141 7.618 261 HG11 VAL 32 1HG1 VAL 32 5.703 -0.708 8.780 262 HG12 VAL 32 2HG1 VAL 32 6.233 -2.389 8.755 263 HG13 VAL 32 3HG1 VAL 32 5.557 -1.702 10.232 264 HG21 VAL 32 3HG2 VAL 32 4.531 -4.260 8.790 265 HG22 VAL 32 1HG2 VAL 32 2.806 -3.887 8.799 266 HG23 VAL 32 2HG2 VAL 32 3.771 -3.624 10.252 267 H ARG 33 H ARG 33 3.156 1.208 10.313 268 HA ARG 33 HA ARG 33 3.418 2.691 7.800 269 HB2 ARG 33 2HB ARG 33 2.028 3.746 9.549 270 HB3 ARG 33 3HB ARG 33 3.376 3.698 10.685 271 HG2 ARG 33 2HG ARG 33 4.665 5.202 9.185 272 HG3 ARG 33 3HG ARG 33 3.284 5.282 8.099 273 HD2 ARG 33 2HD ARG 33 1.984 6.497 9.713 274 HD3 ARG 33 3HD ARG 33 3.185 6.199 10.984 275 HE ARG 33 HE ARG 33 4.376 7.499 8.758 276 HH11 ARG 33 1HH1 ARG 33 2.327 8.248 11.509 277 HH12 ARG 33 2HH1 ARG 33 2.844 9.902 11.590 278 HH21 ARG 33 1HH2 ARG 33 5.114 9.615 8.927 279 HH22 ARG 33 2HH2 ARG 33 4.428 10.673 10.118 280 H THR 34 H THR 34 5.370 2.209 6.941 281 HA THR 34 HA THR 34 7.791 3.095 8.269 282 HB THR 34 HB THR 34 7.444 0.153 7.502 283 HG1 THR 34 HG1 THR 34 7.438 1.560 9.888 284 HG21 THR 34 3HG2 THR 34 9.787 -0.175 8.207 285 HG22 THR 34 1HG2 THR 34 9.970 1.557 8.458 286 HG23 THR 34 2HG2 THR 34 9.701 0.925 6.829 287 H ASP 35 H ASP 35 9.202 3.844 6.832 288 HA ASP 35 HA ASP 35 8.788 3.447 3.929 289 HB2 ASP 35 2HB ASP 35 10.113 5.566 3.703 290 HB3 ASP 35 3HB ASP 35 8.621 5.768 4.612 291 H ASP 36 H ASP 36 10.909 2.764 6.558 292 HA ASP 36 HA ASP 36 13.421 2.545 5.333 293 HB2 ASP 36 2HB ASP 36 12.351 0.772 7.582 294 HB3 ASP 36 3HB ASP 36 14.046 1.060 7.191 295 H LYS 37 H LYS 37 13.659 1.463 3.475 296 HA LYS 37 HA LYS 37 11.942 -0.474 2.434 297 HB2 LYS 37 2HB LYS 37 13.616 -0.730 0.636 298 HB3 LYS 37 3HB LYS 37 13.305 0.952 1.034 299 HG2 LYS 37 2HG LYS 37 15.432 0.840 2.486 300 HG3 LYS 37 3HG LYS 37 15.769 -0.680 1.661 301 HD2 LYS 37 2HD LYS 37 15.540 2.083 0.425 302 HD3 LYS 37 3HD LYS 37 16.980 1.073 0.530 303 HE2 LYS 37 2HE LYS 37 15.853 -0.579 -0.986 304 HE3 LYS 37 3HE LYS 37 14.510 0.561 -1.154 305 HZ1 LYS 37 3HZ LYS 37 15.946 2.137 -2.172 306 HZ2 LYS 37 1HZ LYS 37 16.177 0.667 -2.971 307 HZ3 LYS 37 2HZ LYS 37 17.325 1.216 -1.855 308 H GLU 38 H GLU 38 14.922 -0.873 4.266 309 HA GLU 38 HA GLU 38 15.330 -3.632 3.892 310 HB2 GLU 38 2HB GLU 38 16.679 -3.546 5.978 311 HB3 GLU 38 3HB GLU 38 17.073 -2.227 4.881 312 HG2 GLU 38 2HG GLU 38 15.811 -0.649 6.225 313 HG3 GLU 38 3HG GLU 38 15.235 -1.944 7.274 314 H LYS 39 H LYS 39 13.310 -1.847 6.229 315 HA LYS 39 HA LYS 39 12.522 -4.211 7.668 316 HB2 LYS 39 2HB LYS 39 12.718 -2.070 8.860 317 HB3 LYS 39 3HB LYS 39 11.451 -1.368 7.854 318 HG2 LYS 39 2HG LYS 39 9.791 -2.897 8.778 319 HG3 LYS 39 3HG LYS 39 11.038 -3.768 9.674 320 HD2 LYS 39 2HD LYS 39 11.442 -1.760 11.067 321 HD3 LYS 39 3HD LYS 39 10.204 -0.880 10.161 322 HE2 LYS 39 2HE LYS 39 9.372 -1.762 12.340 323 HE3 LYS 39 3HE LYS 39 8.476 -2.400 10.959 324 HZ1 LYS 39 3HZ LYS 39 10.680 -3.843 12.340 325 HZ2 LYS 39 1HZ LYS 39 9.684 -4.453 11.117 326 HZ3 LYS 39 2HZ LYS 39 9.038 -4.099 12.638 327 H VAL 40 H VAL 40 11.069 -2.137 5.167 328 HA VAL 40 HA VAL 40 8.420 -3.126 5.355 329 HB VAL 40 HB VAL 40 9.813 -1.883 2.929 330 HG11 VAL 40 1HG1 VAL 40 7.789 -3.079 2.231 331 HG12 VAL 40 2HG1 VAL 40 7.525 -1.339 2.131 332 HG13 VAL 40 3HG1 VAL 40 6.842 -2.259 3.473 333 HG21 VAL 40 3HG2 VAL 40 8.738 0.231 3.636 334 HG22 VAL 40 1HG2 VAL 40 9.826 -0.380 4.882 335 HG23 VAL 40 2HG2 VAL 40 8.084 -0.573 5.065 336 H LYS 41 H LYS 41 11.194 -4.091 3.316 337 HA LYS 41 HA LYS 41 9.969 -6.213 1.903 338 HB2 LYS 41 2HB LYS 41 12.883 -5.866 2.720 339 HB3 LYS 41 3HB LYS 41 12.305 -7.077 1.573 340 HG2 LYS 41 2HG LYS 41 11.500 -5.286 0.078 341 HG3 LYS 41 3HG LYS 41 12.089 -4.072 1.219 342 HD2 LYS 41 2HD LYS 41 14.409 -4.981 0.913 343 HD3 LYS 41 3HD LYS 41 13.779 -6.096 -0.304 344 HE2 LYS 41 2HE LYS 41 13.050 -4.148 -1.668 345 HE3 LYS 41 3HE LYS 41 13.745 -3.063 -0.462 346 HZ1 LYS 41 3HZ LYS 41 15.924 -4.085 -0.897 347 HZ2 LYS 41 1HZ LYS 41 15.268 -3.362 -2.275 348 HZ3 LYS 41 2HZ LYS 41 15.231 -5.038 -2.115 349 H GLU 42 H GLU 42 11.565 -6.076 5.053 350 HA GLU 42 HA GLU 42 11.551 -8.817 5.687 351 HB2 GLU 42 2HB GLU 42 12.791 -6.948 6.925 352 HB3 GLU 42 3HB GLU 42 11.258 -6.528 7.679 353 HG2 GLU 42 2HG GLU 42 11.197 -8.970 8.504 354 HG3 GLU 42 3HG GLU 42 12.887 -9.048 8.020 355 H GLU 43 H GLU 43 9.164 -6.248 6.240 356 HA GLU 43 HA GLU 43 7.280 -7.773 7.701 357 HB2 GLU 43 2HB GLU 43 6.860 -5.223 6.072 358 HB3 GLU 43 3HB GLU 43 5.722 -5.883 7.234 359 HG2 GLU 43 2HG GLU 43 8.468 -4.776 7.862 360 HG3 GLU 43 3HG GLU 43 6.922 -3.996 8.180 361 H ILE 44 H ILE 44 7.758 -7.216 4.238 362 HA ILE 44 HA ILE 44 5.361 -8.248 3.202 363 HB ILE 44 HB ILE 44 8.183 -8.186 2.034 364 HG12 ILE 44 2HG1 ILE 44 5.709 -6.531 1.344 365 HG13 ILE 44 3HG1 ILE 44 7.050 -5.976 2.335 366 HG21 ILE 44 1HG2 ILE 44 7.010 -10.069 0.977 367 HG22 ILE 44 2HG2 ILE 44 7.240 -8.754 -0.175 368 HG23 ILE 44 3HG2 ILE 44 5.659 -9.010 0.566 369 HD11 ILE 44 3HD1 ILE 44 7.188 -5.097 0.074 370 HD12 ILE 44 1HD1 ILE 44 7.224 -6.736 -0.584 371 HD13 ILE 44 2HD1 ILE 44 8.554 -6.152 0.423 372 H GLU 45 H GLU 45 8.476 -9.884 3.914 373 HA GLU 45 HA GLU 45 7.684 -12.507 3.197 374 HB2 GLU 45 2HB GLU 45 10.052 -11.963 3.362 375 HB3 GLU 45 3HB GLU 45 9.892 -11.568 5.076 376 HG2 GLU 45 2HG GLU 45 9.325 -13.912 5.571 377 HG3 GLU 45 3HG GLU 45 9.440 -14.304 3.860 378 H LYS 46 H LYS 46 7.714 -10.813 6.318 379 HA LYS 46 HA LYS 46 7.016 -13.025 7.944 380 HB2 LYS 46 2HB LYS 46 6.821 -10.024 8.399 381 HB3 LYS 46 3HB LYS 46 6.520 -11.218 9.663 382 HG2 LYS 46 2HG LYS 46 8.779 -11.933 9.714 383 HG3 LYS 46 3HG LYS 46 9.130 -11.227 8.132 384 HD2 LYS 46 2HD LYS 46 10.183 -9.889 9.860 385 HD3 LYS 46 3HD LYS 46 8.897 -8.962 9.093 386 HE2 LYS 46 2HE LYS 46 7.433 -9.406 11.028 387 HE3 LYS 46 3HE LYS 46 8.725 -10.349 11.780 388 HZ1 LYS 46 3HZ LYS 46 8.746 -8.145 12.672 389 HZ2 LYS 46 1HZ LYS 46 8.802 -7.453 11.129 390 HZ3 LYS 46 2HZ LYS 46 10.119 -8.337 11.705 391 H ALA 47 H ALA 47 5.079 -10.616 6.252 392 HA ALA 47 HA ALA 47 2.567 -11.242 7.454 393 HB1 ALA 47 3HB ALA 47 1.592 -9.914 5.638 394 HB2 ALA 47 1HB ALA 47 3.150 -9.904 4.795 395 HB3 ALA 47 2HB ALA 47 2.981 -9.094 6.351 396 H ARG 48 H ARG 48 4.155 -12.268 4.394 397 HA ARG 48 HA ARG 48 1.933 -13.876 3.556 398 HB2 ARG 48 2HB ARG 48 3.384 -14.671 1.721 399 HB3 ARG 48 3HB ARG 48 3.356 -12.926 1.864 400 HG2 ARG 48 2HG ARG 48 5.573 -13.394 1.346 401 HG3 ARG 48 3HG ARG 48 5.608 -13.150 3.087 402 HD2 ARG 48 2HD ARG 48 5.767 -15.556 3.461 403 HD3 ARG 48 3HD ARG 48 5.541 -15.877 1.739 404 HE ARG 48 HE ARG 48 7.763 -14.236 1.965 405 HH11 ARG 48 1HH1 ARG 48 6.885 -17.469 3.054 406 HH12 ARG 48 2HH1 ARG 48 8.516 -18.049 3.005 407 HH21 ARG 48 1HH2 ARG 48 9.868 -15.031 1.828 408 HH22 ARG 48 2HH2 ARG 48 10.210 -16.663 2.307 409 H LYS 49 H LYS 49 4.734 -14.478 5.499 410 HA LYS 49 HA LYS 49 4.792 -17.312 5.467 411 HB2 LYS 49 2HB LYS 49 6.517 -15.549 6.427 412 HB3 LYS 49 3HB LYS 49 5.586 -15.665 7.908 413 HG2 LYS 49 2HG LYS 49 6.859 -18.057 6.549 414 HG3 LYS 49 3HG LYS 49 7.700 -17.084 7.744 415 HD2 LYS 49 2HD LYS 49 5.082 -18.504 8.340 416 HD3 LYS 49 3HD LYS 49 6.652 -19.275 8.551 417 HE2 LYS 49 2HE LYS 49 5.909 -18.424 10.685 418 HE3 LYS 49 3HE LYS 49 7.286 -17.467 10.148 419 HZ1 LYS 49 3HZ LYS 49 4.447 -16.637 9.863 420 HZ2 LYS 49 1HZ LYS 49 5.808 -15.704 9.502 421 HZ3 LYS 49 2HZ LYS 49 5.478 -16.132 11.100 422 H GLN 50 H GLN 50 3.035 -14.945 7.424 423 HA GLN 50 HA GLN 50 1.475 -16.883 8.894 424 HB2 GLN 50 2HB GLN 50 1.061 -13.889 8.447 425 HB3 GLN 50 3HB GLN 50 0.135 -14.871 9.572 426 HG2 GLN 50 2HG GLN 50 3.121 -14.391 9.748 427 HG3 GLN 50 3HG GLN 50 1.898 -13.530 10.680 428 HE21 GLN 50 1HE2 GLN 50 0.782 -14.669 12.346 429 HE22 GLN 50 2HE2 GLN 50 1.403 -16.140 13.001 430 H GLY 51 H GLY 51 1.151 -15.029 5.920 431 HA2 GLY 51 2HA GLY 51 -0.207 -15.561 4.066 432 HA3 GLY 51 3HA GLY 51 -1.305 -16.448 5.112 433 H ARG 52 H ARG 52 -0.417 -13.491 6.464 434 HA ARG 52 HA ARG 52 -3.073 -12.365 6.024 435 HB2 ARG 52 2HB ARG 52 -2.409 -10.692 7.743 436 HB3 ARG 52 3HB ARG 52 -2.224 -12.349 8.304 437 HG2 ARG 52 2HG ARG 52 0.216 -12.217 7.883 438 HG3 ARG 52 3HG ARG 52 0.024 -10.539 7.368 439 HD2 ARG 52 2HD ARG 52 0.838 -10.787 9.716 440 HD3 ARG 52 3HD ARG 52 -0.668 -9.875 9.593 441 HE ARG 52 HE ARG 52 -1.699 -12.208 10.114 442 HH11 ARG 52 1HH1 ARG 52 1.222 -10.906 11.603 443 HH12 ARG 52 2HH1 ARG 52 0.996 -11.804 13.075 444 HH21 ARG 52 1HH2 ARG 52 -1.966 -13.378 11.999 445 HH22 ARG 52 2HH2 ARG 52 -0.822 -13.210 13.296 446 HA PRO 53 HA PRO 53 -1.720 -9.252 2.991 447 HB2 PRO 53 2HB PRO 53 -3.893 -7.550 4.184 448 HB3 PRO 53 3HB PRO 53 -3.660 -8.068 2.497 449 HG2 PRO 53 2HG PRO 53 -5.584 -9.151 3.976 450 HG3 PRO 53 3HG PRO 53 -4.642 -10.151 2.846 451 HD2 PRO 53 2HD PRO 53 -4.344 -9.898 5.840 452 HD3 PRO 53 3HD PRO 53 -4.334 -11.362 4.824 453 H ILE 54 H ILE 54 -0.278 -7.604 3.073 454 HA ILE 54 HA ILE 54 0.332 -6.350 5.674 455 HB ILE 54 HB ILE 54 2.133 -7.749 4.652 456 HG12 ILE 54 2HG1 ILE 54 3.995 -6.042 4.834 457 HG13 ILE 54 3HG1 ILE 54 2.762 -4.788 4.906 458 HG21 ILE 54 1HG2 ILE 54 2.210 -5.735 2.397 459 HG22 ILE 54 2HG2 ILE 54 1.697 -7.419 2.276 460 HG23 ILE 54 3HG2 ILE 54 3.377 -7.034 2.660 461 HD11 ILE 54 3HD1 ILE 54 3.643 -5.398 7.110 462 HD12 ILE 54 1HD1 ILE 54 3.058 -7.045 6.890 463 HD13 ILE 54 2HD1 ILE 54 1.910 -5.704 6.989 464 H VAL 55 H VAL 55 0.111 -4.154 5.861 465 HA VAL 55 HA VAL 55 -0.662 -2.605 3.459 466 HB VAL 55 HB VAL 55 -1.822 -2.033 6.220 467 HG11 VAL 55 1HG1 VAL 55 -3.574 -0.877 4.935 468 HG12 VAL 55 2HG1 VAL 55 -2.792 -1.341 3.420 469 HG13 VAL 55 3HG1 VAL 55 -1.977 -0.241 4.536 470 HG21 VAL 55 3HG2 VAL 55 -3.075 -3.851 4.133 471 HG22 VAL 55 1HG2 VAL 55 -3.867 -3.264 5.598 472 HG23 VAL 55 2HG2 VAL 55 -2.473 -4.340 5.717 473 H ILE 56 H ILE 56 0.971 -1.217 3.074 474 HA ILE 56 HA ILE 56 2.524 -0.078 5.299 475 HB ILE 56 HB ILE 56 3.066 -0.234 2.309 476 HG12 ILE 56 2HG1 ILE 56 5.216 -1.298 3.106 477 HG13 ILE 56 3HG1 ILE 56 4.622 -1.187 4.754 478 HG21 ILE 56 1HG2 ILE 56 4.645 1.440 4.296 479 HG22 ILE 56 2HG2 ILE 56 3.706 2.052 2.932 480 HG23 ILE 56 3HG2 ILE 56 5.150 1.079 2.643 481 HD11 ILE 56 3HD1 ILE 56 3.405 -2.821 2.540 482 HD12 ILE 56 1HD1 ILE 56 2.821 -2.732 4.203 483 HD13 ILE 56 2HD1 ILE 56 4.409 -3.423 3.859 484 H PHE 57 H PHE 57 1.871 1.758 6.106 485 HA PHE 57 HA PHE 57 0.371 3.749 4.546 486 HB2 PHE 57 2HB PHE 57 0.809 3.242 7.504 487 HB3 PHE 57 3HB PHE 57 0.264 4.834 6.963 488 HD1 PHE 57 HD2 PHE 57 -0.616 1.220 7.058 489 HD2 PHE 57 HD1 PHE 57 -1.987 5.189 6.251 490 HE1 PHE 57 HE2 PHE 57 -2.930 0.400 6.894 491 HE2 PHE 57 HE1 PHE 57 -4.289 4.362 6.100 492 HZ PHE 57 HZ PHE 57 -4.756 1.970 6.394 493 H ILE 58 H ILE 58 1.399 5.388 3.674 494 HA ILE 58 HA ILE 58 3.769 6.662 4.807 495 HB ILE 58 HB ILE 58 4.998 6.434 2.540 496 HG12 ILE 58 2HG1 ILE 58 3.104 4.064 2.184 497 HG13 ILE 58 3HG1 ILE 58 2.991 5.581 1.298 498 HG21 ILE 58 1HG2 ILE 58 5.852 5.291 4.521 499 HG22 ILE 58 2HG2 ILE 58 6.085 4.298 3.082 500 HG23 ILE 58 3HG2 ILE 58 4.787 3.917 4.215 501 HD11 ILE 58 3HD1 ILE 58 5.224 5.157 0.366 502 HD12 ILE 58 1HD1 ILE 58 4.023 3.943 -0.063 503 HD13 ILE 58 2HD1 ILE 58 5.228 3.585 1.170 504 H ARG 59 H ARG 59 4.355 8.597 3.587 505 HA ARG 59 HA ARG 59 2.174 9.825 2.059 506 HB2 ARG 59 2HB ARG 59 3.482 11.003 3.988 507 HB3 ARG 59 3HB ARG 59 4.803 11.166 2.835 508 HG2 ARG 59 2HG ARG 59 3.262 12.428 1.318 509 HG3 ARG 59 3HG ARG 59 2.003 12.310 2.548 510 HD2 ARG 59 2HD ARG 59 4.655 13.761 2.797 511 HD3 ARG 59 3HD ARG 59 3.058 14.495 2.655 512 HE ARG 59 HE ARG 59 3.030 12.858 4.905 513 HH11 ARG 59 1HH1 ARG 59 4.647 15.828 3.883 514 HH12 ARG 59 2HH1 ARG 59 4.816 16.419 5.507 515 HH21 ARG 59 1HH2 ARG 59 3.344 13.613 7.005 516 HH22 ARG 59 2HH2 ARG 59 4.079 15.163 7.267 517 H GLY 60 H GLY 60 2.850 11.058 0.036 518 HA2 GLY 60 2HA GLY 60 3.826 9.357 -1.941 519 HA3 GLY 60 3HA GLY 60 3.629 11.087 -2.110 520 H ALA 61 H ALA 61 5.650 11.574 0.064 521 HA ALA 61 HA ALA 61 8.016 11.743 -1.513 522 HB1 ALA 61 3HB ALA 61 7.680 12.037 1.494 523 HB2 ALA 61 1HB ALA 61 7.519 13.325 0.300 524 HB3 ALA 61 2HB ALA 61 9.086 12.557 0.554 525 H TYR 62 H TYR 62 6.982 9.620 1.106 526 HA TYR 62 HA TYR 62 9.351 8.034 1.289 527 HB2 TYR 62 2HB TYR 62 6.511 7.492 2.245 528 HB3 TYR 62 3HB TYR 62 7.921 6.543 2.703 529 HD1 TYR 62 HD2 TYR 62 9.972 8.323 3.493 530 HD2 TYR 62 HD1 TYR 62 5.762 8.847 4.018 531 HE1 TYR 62 HE2 TYR 62 10.389 9.775 5.428 532 HE2 TYR 62 HE1 TYR 62 6.186 10.293 5.960 533 HH TYR 62 HH TYR 62 9.285 11.522 6.703 534 H GLU 63 H GLU 63 6.423 7.894 -0.606 535 HA GLU 63 HA GLU 63 6.367 5.210 -1.366 536 HB2 GLU 63 2HB GLU 63 4.548 6.945 -1.715 537 HB3 GLU 63 3HB GLU 63 5.449 7.506 -3.118 538 HG2 GLU 63 2HG GLU 63 5.328 4.998 -3.892 539 HG3 GLU 63 3HG GLU 63 4.033 4.877 -2.698 540 H GLU 64 H GLU 64 8.373 7.807 -2.548 541 HA GLU 64 HA GLU 64 9.218 6.904 -5.030 542 HB2 GLU 64 2HB GLU 64 9.787 9.096 -4.113 543 HB3 GLU 64 3HB GLU 64 10.762 8.357 -2.849 544 HG2 GLU 64 2HG GLU 64 12.182 9.327 -4.581 545 HG3 GLU 64 3HG GLU 64 12.373 7.578 -4.525 546 H VAL 65 H VAL 65 10.204 5.850 -1.831 547 HA VAL 65 HA VAL 65 12.454 4.254 -2.581 548 HB VAL 65 HB VAL 65 10.775 4.000 -0.046 549 HG11 VAL 65 1HG1 VAL 65 13.693 3.365 -0.536 550 HG12 VAL 65 2HG1 VAL 65 12.384 2.189 -0.387 551 HG13 VAL 65 3HG1 VAL 65 12.831 3.192 0.995 552 HG21 VAL 65 3HG2 VAL 65 13.087 5.923 -0.509 553 HG22 VAL 65 1HG2 VAL 65 12.254 5.657 1.027 554 HG23 VAL 65 2HG2 VAL 65 11.389 6.372 -0.336 555 H VAL 66 H VAL 66 9.004 3.732 -2.284 556 HA VAL 66 HA VAL 66 8.915 0.948 -1.878 557 HB VAL 66 HB VAL 66 6.781 2.824 -2.977 558 HG11 VAL 66 1HG1 VAL 66 5.103 1.080 -2.378 559 HG12 VAL 66 2HG1 VAL 66 6.417 -0.045 -2.027 560 HG13 VAL 66 3HG1 VAL 66 6.183 0.545 -3.671 561 HG21 VAL 66 3HG2 VAL 66 7.268 1.697 -0.204 562 HG22 VAL 66 1HG2 VAL 66 5.883 2.692 -0.670 563 HG23 VAL 66 2HG2 VAL 66 7.513 3.370 -0.717 564 H ARG 67 H ARG 67 9.111 2.829 -4.859 565 HA ARG 67 HA ARG 67 8.344 0.929 -6.746 566 HB2 ARG 67 2HB ARG 67 8.921 3.339 -7.200 567 HB3 ARG 67 3HB ARG 67 10.625 2.921 -7.065 568 HG2 ARG 67 2HG ARG 67 10.393 1.392 -9.016 569 HG3 ARG 67 3HG ARG 67 8.689 1.841 -9.150 570 HD2 ARG 67 2HD ARG 67 10.020 3.084 -10.780 571 HD3 ARG 67 3HD ARG 67 9.357 4.197 -9.579 572 HE ARG 67 HE ARG 67 12.149 3.191 -9.449 573 HH11 ARG 67 1HH1 ARG 67 9.900 5.899 -9.361 574 HH12 ARG 67 2HH1 ARG 67 11.128 7.062 -8.979 575 HH21 ARG 67 1HH2 ARG 67 13.747 4.751 -8.954 576 HH22 ARG 67 2HH2 ARG 67 13.291 6.414 -8.753 577 H ASP 68 H ASP 68 11.405 1.203 -4.995 578 HA ASP 68 HA ASP 68 12.810 -0.946 -6.292 579 HB2 ASP 68 2HB ASP 68 14.003 0.861 -5.056 580 HB3 ASP 68 3HB ASP 68 13.255 0.343 -3.552 581 H ILE 69 H ILE 69 10.935 -0.594 -3.298 582 HA ILE 69 HA ILE 69 11.459 -3.061 -2.071 583 HB ILE 69 HB ILE 69 8.973 -1.309 -1.768 584 HG12 ILE 69 2HG1 ILE 69 11.571 -1.241 -0.151 585 HG13 ILE 69 3HG1 ILE 69 11.110 -0.060 -1.371 586 HG21 ILE 69 1HG2 ILE 69 8.721 -2.337 0.455 587 HG22 ILE 69 2HG2 ILE 69 10.108 -3.377 0.148 588 HG23 ILE 69 3HG2 ILE 69 8.643 -3.559 -0.816 589 HD11 ILE 69 3HD1 ILE 69 9.186 0.597 -0.010 590 HD12 ILE 69 1HD1 ILE 69 10.712 0.800 0.848 591 HD13 ILE 69 2HD1 ILE 69 9.666 -0.567 1.227 592 H VAL 70 H VAL 70 9.031 -2.124 -4.432 593 HA VAL 70 HA VAL 70 7.235 -4.270 -4.272 594 HB VAL 70 HB VAL 70 7.931 -2.465 -6.643 595 HG11 VAL 70 1HG1 VAL 70 5.600 -4.390 -6.349 596 HG12 VAL 70 2HG1 VAL 70 6.927 -4.520 -7.507 597 HG13 VAL 70 3HG1 VAL 70 5.772 -3.193 -7.633 598 HG21 VAL 70 3HG2 VAL 70 5.843 -1.271 -6.061 599 HG22 VAL 70 1HG2 VAL 70 6.970 -1.272 -4.703 600 HG23 VAL 70 2HG2 VAL 70 5.590 -2.368 -4.700 601 H GLU 71 H GLU 71 10.311 -3.929 -6.006 602 HA GLU 71 HA GLU 71 10.267 -6.139 -7.693 603 HB2 GLU 71 2HB GLU 71 12.077 -4.523 -7.839 604 HB3 GLU 71 3HB GLU 71 12.606 -4.882 -6.198 605 HG2 GLU 71 2HG GLU 71 13.174 -7.213 -6.969 606 HG3 GLU 71 3HG GLU 71 12.776 -6.719 -8.607 607 H TYR 72 H TYR 72 11.273 -5.966 -4.257 608 HA TYR 72 HA TYR 72 11.977 -8.662 -3.887 609 HB2 TYR 72 2HB TYR 72 12.544 -6.958 -2.214 610 HB3 TYR 72 3HB TYR 72 10.843 -6.669 -1.872 611 HD1 TYR 72 HD1 TYR 72 13.648 -9.065 -1.419 612 HD2 TYR 72 HD2 TYR 72 9.593 -8.177 -0.405 613 HE1 TYR 72 HE1 TYR 72 13.704 -10.789 0.338 614 HE2 TYR 72 HE2 TYR 72 9.634 -9.905 1.332 615 HH TYR 72 HH TYR 72 12.554 -11.368 2.392 616 H ALA 73 H ALA 73 8.846 -7.020 -3.439 617 HA ALA 73 HA ALA 73 7.345 -9.225 -2.533 618 HB1 ALA 73 3HB ALA 73 6.581 -6.907 -2.307 619 HB2 ALA 73 1HB ALA 73 5.373 -7.882 -3.142 620 HB3 ALA 73 2HB ALA 73 6.406 -6.782 -4.058 621 H GLN 74 H GLN 74 8.214 -8.162 -5.787 622 HA GLN 74 HA GLN 74 6.541 -9.936 -7.274 623 HB2 GLN 74 2HB GLN 74 9.158 -8.578 -8.062 624 HB3 GLN 74 3HB GLN 74 8.134 -9.470 -9.182 625 HG2 GLN 74 2HG GLN 74 6.311 -7.837 -8.819 626 HG3 GLN 74 3HG GLN 74 7.340 -6.944 -7.697 627 HE21 GLN 74 1HE2 GLN 74 7.244 -5.046 -9.034 628 HE22 GLN 74 2HE2 GLN 74 8.117 -4.944 -10.516 629 H LYS 75 H LYS 75 9.797 -10.198 -5.882 630 HA LYS 75 HA LYS 75 10.501 -12.735 -7.008 631 HB2 LYS 75 2HB LYS 75 11.507 -11.649 -4.334 632 HB3 LYS 75 3HB LYS 75 12.291 -12.849 -5.352 633 HG2 LYS 75 2HG LYS 75 11.995 -9.894 -5.882 634 HG3 LYS 75 3HG LYS 75 13.482 -10.769 -5.535 635 HD2 LYS 75 2HD LYS 75 13.159 -12.003 -7.738 636 HD3 LYS 75 3HD LYS 75 11.790 -10.934 -8.063 637 HE2 LYS 75 2HE LYS 75 13.356 -8.978 -7.858 638 HE3 LYS 75 3HE LYS 75 14.697 -10.116 -7.721 639 HZ1 LYS 75 3HZ LYS 75 14.020 -11.005 -9.921 640 HZ2 LYS 75 1HZ LYS 75 14.513 -9.386 -9.977 641 HZ3 LYS 75 2HZ LYS 75 12.872 -9.774 -10.035 642 H GLU 76 H GLU 76 8.882 -11.709 -4.053 643 HA GLU 76 HA GLU 76 8.448 -14.254 -2.874 644 HB2 GLU 76 2HB GLU 76 6.882 -11.651 -2.543 645 HB3 GLU 76 3HB GLU 76 6.752 -13.052 -1.485 646 HG2 GLU 76 2HG GLU 76 9.183 -11.289 -1.855 647 HG3 GLU 76 3HG GLU 76 8.115 -11.329 -0.458 648 H GLY 77 H GLY 77 6.919 -12.544 -5.467 649 HA2 GLY 77 2HA GLY 77 5.378 -13.242 -7.018 650 HA3 GLY 77 3HA GLY 77 5.256 -14.782 -6.182 651 H LEU 78 H LEU 78 4.779 -11.771 -4.528 652 HA LEU 78 HA LEU 78 2.013 -12.457 -3.882 653 HB2 LEU 78 2HB LEU 78 3.787 -10.200 -2.856 654 HB3 LEU 78 3HB LEU 78 2.205 -10.630 -2.219 655 HG LEU 78 HG LEU 78 4.707 -12.358 -2.078 656 HD11 LEU 78 1HD1 LEU 78 4.805 -10.434 -0.579 657 HD12 LEU 78 2HD1 LEU 78 4.648 -11.938 0.319 658 HD13 LEU 78 3HD1 LEU 78 3.247 -10.879 0.126 659 HD21 LEU 78 3HD2 LEU 78 2.724 -13.770 -2.287 660 HD22 LEU 78 1HD2 LEU 78 1.936 -12.907 -0.964 661 HD23 LEU 78 2HD2 LEU 78 3.383 -13.874 -0.657 662 H ARG 79 H ARG 79 0.275 -11.046 -4.216 663 HA ARG 79 HA ARG 79 0.312 -9.504 -6.627 664 HB2 ARG 79 2HB ARG 79 -1.665 -10.900 -5.350 665 HB3 ARG 79 3HB ARG 79 -2.036 -9.302 -4.726 666 HG2 ARG 79 2HG ARG 79 -1.886 -10.069 -7.656 667 HG3 ARG 79 3HG ARG 79 -3.369 -9.887 -6.731 668 HD2 ARG 79 2HD ARG 79 -3.095 -7.517 -6.574 669 HD3 ARG 79 3HD ARG 79 -1.409 -7.602 -7.098 670 HE ARG 79 HE ARG 79 -3.495 -8.480 -8.971 671 HH11 ARG 79 1HH1 ARG 79 -1.068 -6.053 -8.140 672 HH12 ARG 79 2HH1 ARG 79 -1.091 -5.345 -9.719 673 HH21 ARG 79 1HH2 ARG 79 -3.475 -7.526 -11.028 674 HH22 ARG 79 2HH2 ARG 79 -2.443 -6.169 -11.348 675 H VAL 80 H VAL 80 1.052 -7.425 -6.704 676 HA VAL 80 HA VAL 80 1.151 -5.835 -4.214 677 HB VAL 80 HB VAL 80 2.721 -5.278 -6.778 678 HG11 VAL 80 1HG1 VAL 80 3.053 -4.252 -3.934 679 HG12 VAL 80 2HG1 VAL 80 2.429 -3.335 -5.307 680 HG13 VAL 80 3HG1 VAL 80 4.112 -3.863 -5.291 681 HG21 VAL 80 3HG2 VAL 80 3.395 -7.484 -5.926 682 HG22 VAL 80 1HG2 VAL 80 3.672 -6.800 -4.323 683 HG23 VAL 80 2HG2 VAL 80 4.685 -6.305 -5.682 684 H LEU 81 H LEU 81 -0.226 -4.227 -4.050 685 HA LEU 81 HA LEU 81 -1.446 -2.956 -6.408 686 HB2 LEU 81 2HB LEU 81 -2.797 -4.934 -5.209 687 HB3 LEU 81 3HB LEU 81 -3.111 -3.722 -3.982 688 HG LEU 81 HG LEU 81 -4.144 -2.268 -5.789 689 HD11 LEU 81 1HD1 LEU 81 -3.815 -4.766 -7.470 690 HD12 LEU 81 2HD1 LEU 81 -3.010 -3.212 -7.719 691 HD13 LEU 81 3HD1 LEU 81 -4.757 -3.338 -7.917 692 HD21 LEU 81 3HD2 LEU 81 -6.254 -3.513 -5.898 693 HD22 LEU 81 1HD2 LEU 81 -5.550 -3.616 -4.285 694 HD23 LEU 81 2HD2 LEU 81 -5.432 -4.990 -5.388 695 H VAL 82 H VAL 82 -0.742 -0.877 -6.135 696 HA VAL 82 HA VAL 82 -0.341 0.190 -3.410 697 HB VAL 82 HB VAL 82 0.540 1.371 -6.089 698 HG11 VAL 82 1HG1 VAL 82 1.346 2.150 -3.267 699 HG12 VAL 82 2HG1 VAL 82 0.321 3.089 -4.352 700 HG13 VAL 82 3HG1 VAL 82 2.021 2.830 -4.750 701 HG21 VAL 82 3HG2 VAL 82 1.659 -0.788 -5.682 702 HG22 VAL 82 1HG2 VAL 82 2.199 -0.221 -4.100 703 HG23 VAL 82 2HG2 VAL 82 2.804 0.550 -5.568 704 H ILE 83 H ILE 83 -2.076 1.228 -2.598 705 HA ILE 83 HA ILE 83 -4.011 2.570 -4.385 706 HB ILE 83 HB ILE 83 -4.265 1.730 -1.456 707 HG12 ILE 83 2HG1 ILE 83 -5.501 0.448 -3.943 708 HG13 ILE 83 3HG1 ILE 83 -4.090 -0.178 -3.101 709 HG21 ILE 83 1HG2 ILE 83 -6.680 2.216 -1.705 710 HG22 ILE 83 2HG2 ILE 83 -6.388 2.822 -3.336 711 HG23 ILE 83 3HG2 ILE 83 -5.699 3.664 -1.948 712 HD11 ILE 83 3HD1 ILE 83 -6.861 0.049 -1.922 713 HD12 ILE 83 1HD1 ILE 83 -5.428 -0.603 -1.118 714 HD13 ILE 83 2HD1 ILE 83 -6.090 -1.415 -2.535 715 H LYS 84 H LYS 84 -3.642 4.669 -4.628 716 HA LYS 84 HA LYS 84 -2.270 6.250 -2.527 717 HB2 LYS 84 2HB LYS 84 -0.627 5.667 -4.187 718 HB3 LYS 84 3HB LYS 84 -1.726 6.021 -5.516 719 HG2 LYS 84 2HG LYS 84 -1.506 8.379 -5.207 720 HG3 LYS 84 3HG LYS 84 -0.738 8.180 -3.631 721 HD2 LYS 84 2HD LYS 84 0.877 8.824 -5.381 722 HD3 LYS 84 3HD LYS 84 1.248 7.256 -4.668 723 HE2 LYS 84 2HE LYS 84 0.101 6.191 -6.679 724 HE3 LYS 84 3HE LYS 84 0.020 7.804 -7.385 725 HZ1 LYS 84 3HZ LYS 84 1.976 6.613 -8.170 726 HZ2 LYS 84 1HZ LYS 84 2.517 6.389 -6.584 727 HZ3 LYS 84 2HZ LYS 84 2.446 7.945 -7.236 728 H VAL 85 H VAL 85 -3.143 8.215 -2.128 729 HA VAL 85 HA VAL 85 -5.589 8.982 -3.500 730 HB VAL 85 HB VAL 85 -4.216 10.222 -1.066 731 HG11 VAL 85 1HG1 VAL 85 -5.543 11.934 -2.224 732 HG12 VAL 85 2HG1 VAL 85 -6.325 11.480 -0.711 733 HG13 VAL 85 3HG1 VAL 85 -6.949 10.865 -2.242 734 HG21 VAL 85 3HG2 VAL 85 -6.660 8.420 -1.264 735 HG22 VAL 85 1HG2 VAL 85 -6.063 9.170 0.222 736 HG23 VAL 85 2HG2 VAL 85 -5.079 7.968 -0.616 737 H ALA 86 H ALA 86 -5.431 10.058 -5.302 738 HA ALA 86 HA ALA 86 -3.134 11.729 -5.978 739 HB1 ALA 86 3HB ALA 86 -5.493 10.817 -7.648 740 HB2 ALA 86 1HB ALA 86 -3.900 10.059 -7.599 741 HB3 ALA 86 2HB ALA 86 -4.080 11.691 -8.249 742 H GLN 87 H GLN 87 -3.564 13.526 -4.622 743 HA GLN 87 HA GLN 87 -6.015 15.044 -4.931 744 HB2 GLN 87 2HB GLN 87 -3.438 15.688 -3.457 745 HB3 GLN 87 3HB GLN 87 -4.901 16.671 -3.400 746 HG2 GLN 87 2HG GLN 87 -6.095 14.644 -2.443 747 HG3 GLN 87 3HG GLN 87 -4.510 13.874 -2.302 748 HE21 GLN 87 1HE2 GLN 87 -6.322 14.543 -0.174 749 HE22 GLN 87 2HE2 GLN 87 -5.507 15.637 0.870 750 H ASP 88 H ASP 88 -5.583 15.110 -7.369 751 HA ASP 88 HA ASP 88 -5.300 16.342 -9.251 752 HB2 ASP 88 2HB ASP 88 -6.539 17.953 -7.713 753 HB3 ASP 88 3HB ASP 88 -4.993 18.709 -7.357 754 H GLN 89 H GLN 89 -2.894 15.202 -8.010 755 HA GLN 89 HA GLN 89 -0.707 17.062 -8.255 756 HB2 GLN 89 2HB GLN 89 -0.807 14.057 -7.811 757 HB3 GLN 89 3HB GLN 89 0.688 14.982 -7.839 758 HG2 GLN 89 2HG GLN 89 -1.579 15.469 -5.883 759 HG3 GLN 89 3HG GLN 89 -0.170 14.462 -5.545 760 HE21 GLN 89 1HE2 GLN 89 -1.090 16.934 -4.229 761 HE22 GLN 89 2HE2 GLN 89 0.234 18.037 -4.321 762 H GLU 90 H GLU 90 0.315 17.577 -10.036 763 HA GLU 90 HA GLU 90 -0.130 16.402 -12.629 764 HB2 GLU 90 2HB GLU 90 1.960 18.477 -11.826 765 HB3 GLU 90 3HB GLU 90 1.315 18.192 -13.441 766 HG2 GLU 90 2HG GLU 90 -0.831 19.097 -12.835 767 HG3 GLU 90 3HG GLU 90 -0.391 19.149 -11.128 768 H LEU 91 H LEU 91 2.548 16.653 -10.339 769 HA LEU 91 HA LEU 91 4.579 15.286 -11.709 770 HB2 LEU 91 2HB LEU 91 4.576 16.777 -9.510 771 HB3 LEU 91 3HB LEU 91 4.380 15.250 -8.680 772 HG LEU 91 HG LEU 91 6.727 15.904 -10.518 773 HD11 LEU 91 1HD1 LEU 91 6.623 16.048 -7.490 774 HD12 LEU 91 2HD1 LEU 91 6.784 17.404 -8.609 775 HD13 LEU 91 3HD1 LEU 91 8.075 16.215 -8.482 776 HD21 LEU 91 3HD2 LEU 91 6.424 13.506 -10.328 777 HD22 LEU 91 1HD2 LEU 91 6.360 13.610 -8.568 778 HD23 LEU 91 2HD2 LEU 91 7.856 13.989 -9.426 779 H LEU 92 H LEU 92 1.801 14.153 -9.999 780 HA LEU 92 HA LEU 92 2.485 11.687 -8.961 781 HB2 LEU 92 2HB LEU 92 0.321 12.845 -8.644 782 HB3 LEU 92 3HB LEU 92 -0.100 12.532 -10.309 783 HG LEU 92 HG LEU 92 0.314 9.946 -9.387 784 HD11 LEU 92 1HD1 LEU 92 -0.858 11.475 -7.046 785 HD12 LEU 92 2HD1 LEU 92 0.697 10.636 -7.091 786 HD13 LEU 92 3HD1 LEU 92 -0.800 9.718 -7.213 787 HD21 LEU 92 3HD2 LEU 92 -2.130 9.715 -9.345 788 HD22 LEU 92 1HD2 LEU 92 -1.603 10.682 -10.724 789 HD23 LEU 92 2HD2 LEU 92 -2.309 11.470 -9.312 790 H GLU 93 H GLU 93 1.432 12.524 -12.255 791 HA GLU 93 HA GLU 93 0.918 9.910 -13.202 792 HB2 GLU 93 2HB GLU 93 1.545 12.432 -14.799 793 HB3 GLU 93 3HB GLU 93 0.809 10.965 -15.444 794 HG2 GLU 93 2HG GLU 93 -1.148 11.293 -13.965 795 HG3 GLU 93 3HG GLU 93 -0.416 12.772 -13.334 796 H ARG 94 H ARG 94 3.876 11.765 -13.017 797 HA ARG 94 HA ARG 94 5.407 10.355 -14.963 798 HB2 ARG 94 2HB ARG 94 6.092 12.573 -14.151 799 HB3 ARG 94 3HB ARG 94 6.293 11.952 -12.517 800 HG2 ARG 94 2HG ARG 94 8.178 10.551 -13.268 801 HG3 ARG 94 3HG ARG 94 7.958 11.125 -14.922 802 HD2 ARG 94 2HD ARG 94 8.545 13.402 -14.251 803 HD3 ARG 94 3HD ARG 94 8.648 12.907 -12.558 804 HE ARG 94 HE ARG 94 10.427 11.275 -13.846 805 HH11 ARG 94 1HH1 ARG 94 10.099 14.784 -13.604 806 HH12 ARG 94 2HH1 ARG 94 11.799 15.072 -13.776 807 HH21 ARG 94 1HH2 ARG 94 12.656 11.683 -14.068 808 HH22 ARG 94 2HH2 ARG 94 13.246 13.318 -14.037 809 H PHE 95 H PHE 95 5.221 10.085 -11.398 810 HA PHE 95 HA PHE 95 6.922 7.781 -11.204 811 HB2 PHE 95 2HB PHE 95 6.641 9.426 -9.341 812 HB3 PHE 95 3HB PHE 95 4.958 8.940 -9.163 813 HD1 PHE 95 HD2 PHE 95 8.470 7.709 -8.884 814 HD2 PHE 95 HD1 PHE 95 4.379 7.032 -7.775 815 HE1 PHE 95 HE2 PHE 95 9.179 5.923 -7.355 816 HE2 PHE 95 HE1 PHE 95 5.119 5.235 -6.265 817 HZ PHE 95 HZ PHE 95 7.504 4.679 -6.046 818 H TYR 96 H TYR 96 3.455 8.336 -11.175 819 HA TYR 96 HA TYR 96 2.410 5.858 -10.496 820 HB2 TYR 96 2HB TYR 96 0.977 7.781 -10.541 821 HB3 TYR 96 3HB TYR 96 1.375 8.146 -12.211 822 HD1 TYR 96 HD1 TYR 96 -0.415 5.664 -10.064 823 HD2 TYR 96 HD2 TYR 96 -0.037 7.355 -13.969 824 HE1 TYR 96 HE1 TYR 96 -2.440 4.492 -10.762 825 HE2 TYR 96 HE2 TYR 96 -2.064 6.165 -14.685 826 HH TYR 96 HH TYR 96 -4.259 4.799 -12.598 827 H GLU 97 H GLU 97 3.470 7.081 -13.646 828 HA GLU 97 HA GLU 97 2.365 4.975 -15.237 829 HB2 GLU 97 2HB GLU 97 2.792 7.250 -16.123 830 HB3 GLU 97 3HB GLU 97 4.524 7.021 -15.898 831 HG2 GLU 97 2HG GLU 97 4.440 5.145 -17.554 832 HG3 GLU 97 3HG GLU 97 2.736 5.506 -17.826 833 H GLN 98 H GLN 98 5.395 5.547 -13.578 834 HA GLN 98 HA GLN 98 7.067 3.747 -14.968 835 HB2 GLN 98 2HB GLN 98 7.213 4.858 -12.143 836 HB3 GLN 98 3HB GLN 98 8.510 3.911 -12.877 837 HG2 GLN 98 2HG GLN 98 7.488 6.620 -13.754 838 HG3 GLN 98 3HG GLN 98 9.058 6.251 -13.054 839 HE21 GLN 98 1HE2 GLN 98 7.105 6.126 -15.936 840 HE22 GLN 98 2HE2 GLN 98 8.381 5.722 -17.031 841 H LEU 99 H LEU 99 5.074 3.284 -12.034 842 HA LEU 99 HA LEU 99 5.840 0.556 -11.589 843 HB2 LEU 99 2HB LEU 99 3.432 2.136 -10.606 844 HB3 LEU 99 3HB LEU 99 3.708 0.460 -10.167 845 HG LEU 99 HG LEU 99 5.888 1.163 -9.081 846 HD11 LEU 99 1HD1 LEU 99 4.865 3.962 -9.588 847 HD12 LEU 99 2HD1 LEU 99 6.313 3.227 -10.280 848 HD13 LEU 99 3HD1 LEU 99 6.230 3.540 -8.547 849 HD21 LEU 99 3HD2 LEU 99 3.880 0.790 -7.734 850 HD22 LEU 99 1HD2 LEU 99 3.374 2.462 -7.986 851 HD23 LEU 99 2HD2 LEU 99 4.838 2.109 -7.064 852 H LYS 100 H LYS 100 3.191 2.157 -13.281 853 HA LYS 100 HA LYS 100 1.658 -0.142 -13.918 854 HB2 LYS 100 2HB LYS 100 1.732 2.677 -15.056 855 HB3 LYS 100 3HB LYS 100 0.575 1.476 -15.608 856 HG2 LYS 100 2HG LYS 100 0.685 1.917 -12.653 857 HG3 LYS 100 3HG LYS 100 0.074 3.260 -13.613 858 HD2 LYS 100 2HD LYS 100 -1.723 1.764 -12.769 859 HD3 LYS 100 3HD LYS 100 -1.705 1.898 -14.524 860 HE2 LYS 100 2HE LYS 100 -0.497 -0.317 -14.589 861 HE3 LYS 100 3HE LYS 100 -0.745 -0.437 -12.848 862 HZ1 LYS 100 3HZ LYS 100 -2.443 -1.642 -14.099 863 HZ2 LYS 100 1HZ LYS 100 -2.910 -0.215 -14.875 864 HZ3 LYS 100 2HZ LYS 100 -3.132 -0.381 -13.209 865 H LYS 101 H LYS 101 4.398 1.374 -15.419 866 HA LYS 101 HA LYS 101 4.125 0.077 -18.011 867 HB2 LYS 101 2HB LYS 101 4.994 2.435 -17.684 868 HB3 LYS 101 3HB LYS 101 6.416 1.760 -16.903 869 HG2 LYS 101 2HG LYS 101 7.037 0.627 -19.006 870 HG3 LYS 101 3HG LYS 101 5.591 1.285 -19.786 871 HD2 LYS 101 2HD LYS 101 6.455 3.605 -19.305 872 HD3 LYS 101 3HD LYS 101 7.934 2.879 -18.667 873 HE2 LYS 101 2HE LYS 101 8.400 1.887 -20.868 874 HE3 LYS 101 3HE LYS 101 6.904 2.582 -21.499 875 HZ1 LYS 101 3HZ LYS 101 9.212 4.130 -20.452 876 HZ2 LYS 101 1HZ LYS 101 7.782 4.786 -21.069 877 HZ3 LYS 101 2HZ LYS 101 8.826 3.928 -22.085 878 H ASP 102 H ASP 102 6.030 -0.213 -15.052 879 HA ASP 102 HA ASP 102 7.808 -2.282 -15.864 880 HB2 ASP 102 2HB ASP 102 8.241 -0.976 -13.832 881 HB3 ASP 102 3HB ASP 102 6.731 -1.516 -13.111 882 H GLY 103 H GLY 103 4.648 -2.328 -14.211 883 HA2 GLY 103 2HA GLY 103 3.262 -4.115 -15.589 884 HA3 GLY 103 3HA GLY 103 4.276 -5.202 -14.649 885 H VAL 104 H VAL 104 4.067 -2.865 -12.556 886 HA VAL 104 HA VAL 104 2.183 -4.297 -10.907 887 HB VAL 104 HB VAL 104 3.962 -1.878 -10.320 888 HG11 VAL 104 1HG1 VAL 104 2.126 -1.969 -8.691 889 HG12 VAL 104 2HG1 VAL 104 3.648 -2.426 -7.920 890 HG13 VAL 104 3HG1 VAL 104 2.473 -3.669 -8.361 891 HG21 VAL 104 3HG2 VAL 104 4.407 -4.818 -9.702 892 HG22 VAL 104 1HG2 VAL 104 5.499 -3.488 -9.315 893 HG23 VAL 104 2HG2 VAL 104 5.198 -3.914 -10.998 894 H ASP 105 H ASP 105 0.230 -3.620 -10.179 895 HA ASP 105 HA ASP 105 -0.996 -1.295 -11.416 896 HB2 ASP 105 2HB ASP 105 -2.019 -3.808 -10.176 897 HB3 ASP 105 3HB ASP 105 -3.020 -2.386 -9.882 898 H VAL 106 H VAL 106 -0.180 0.460 -10.423 899 HA VAL 106 HA VAL 106 -0.961 0.957 -7.646 900 HB VAL 106 HB VAL 106 1.078 2.072 -8.140 901 HG11 VAL 106 1HG1 VAL 106 1.096 1.914 -10.563 902 HG12 VAL 106 2HG1 VAL 106 1.503 3.552 -10.046 903 HG13 VAL 106 3HG1 VAL 106 -0.107 3.198 -10.676 904 HG21 VAL 106 3HG2 VAL 106 0.612 4.469 -7.892 905 HG22 VAL 106 1HG2 VAL 106 -0.489 3.508 -6.900 906 HG23 VAL 106 2HG2 VAL 106 -1.052 4.211 -8.419 907 H ARG 107 H ARG 107 -2.987 1.432 -7.254 908 HA ARG 107 HA ARG 107 -4.785 2.544 -9.291 909 HB2 ARG 107 2HB ARG 107 -5.447 1.285 -6.599 910 HB3 ARG 107 3HB ARG 107 -6.593 1.697 -7.865 911 HG2 ARG 107 2HG ARG 107 -4.418 -0.408 -8.143 912 HG3 ARG 107 3HG ARG 107 -6.080 -0.754 -7.675 913 HD2 ARG 107 2HD ARG 107 -5.814 -1.258 -10.016 914 HD3 ARG 107 3HD ARG 107 -6.848 0.166 -9.865 915 HE ARG 107 HE ARG 107 -4.052 0.752 -10.291 916 HH11 ARG 107 1HH1 ARG 107 -7.083 0.063 -11.937 917 HH12 ARG 107 2HH1 ARG 107 -6.607 0.853 -13.405 918 HH21 ARG 107 1HH2 ARG 107 -3.490 1.890 -12.182 919 HH22 ARG 107 2HH2 ARG 107 -4.571 1.886 -13.544 920 H VAL 108 H VAL 108 -4.817 4.719 -9.245 921 HA VAL 108 HA VAL 108 -4.516 6.162 -6.711 922 HB VAL 108 HB VAL 108 -4.436 8.249 -8.149 923 HG11 VAL 108 1HG1 VAL 108 -2.408 7.170 -7.294 924 HG12 VAL 108 2HG1 VAL 108 -2.117 7.882 -8.878 925 HG13 VAL 108 3HG1 VAL 108 -2.329 6.134 -8.722 926 HG21 VAL 108 3HG2 VAL 108 -5.602 7.397 -10.155 927 HG22 VAL 108 1HG2 VAL 108 -4.270 6.285 -10.471 928 HG23 VAL 108 2HG2 VAL 108 -4.009 8.030 -10.569 929 H THR 109 H THR 109 -6.150 6.864 -5.650 930 HA THR 109 HA THR 109 -8.813 7.239 -6.853 931 HB THR 109 HB THR 109 -8.068 7.007 -3.895 932 HG1 THR 109 HG1 THR 109 -7.723 5.072 -5.316 933 HG21 THR 109 3HG2 THR 109 -10.770 6.776 -5.286 934 HG22 THR 109 1HG2 THR 109 -10.230 8.158 -4.322 935 HG23 THR 109 2HG2 THR 109 -10.471 6.586 -3.559 936 H ASP 110 H ASP 110 -9.224 9.301 -7.320 937 HA ASP 110 HA ASP 110 -7.521 11.467 -6.851 938 HB2 ASP 110 2HB ASP 110 -10.491 11.645 -7.554 939 HB3 ASP 110 3HB ASP 110 -9.278 12.899 -7.811 940 H ASN 111 H ASN 111 -10.262 10.329 -5.072 941 HA ASN 111 HA ASN 111 -10.310 12.672 -3.291 942 HB2 ASN 111 2HB ASN 111 -12.384 10.456 -3.441 943 HB3 ASN 111 3HB ASN 111 -12.554 12.032 -2.676 944 HD21 ASN 111 1HD2 ASN 111 -12.741 13.907 -4.073 945 HD22 ASN 111 2HD2 ASN 111 -13.311 13.726 -5.694 946 H GLU 112 H GLU 112 -10.477 12.330 -1.043 947 HA GLU 112 HA GLU 112 -8.510 10.433 -0.057 948 HB2 GLU 112 2HB GLU 112 -10.125 12.485 1.514 949 HB3 GLU 112 3HB GLU 112 -8.556 11.807 1.938 950 HG2 GLU 112 2HG GLU 112 -7.403 13.148 0.389 951 HG3 GLU 112 3HG GLU 112 -8.842 13.429 -0.593 952 H ASP 113 H ASP 113 -11.798 11.393 0.750 953 HA ASP 113 HA ASP 113 -12.414 9.381 2.643 954 HB2 ASP 113 2HB ASP 113 -13.520 11.597 2.578 955 HB3 ASP 113 3HB ASP 113 -14.231 11.220 1.016 956 H GLU 114 H GLU 114 -12.706 9.553 -0.847 957 HA GLU 114 HA GLU 114 -14.406 7.316 -1.267 958 HB2 GLU 114 2HB GLU 114 -13.851 9.096 -2.964 959 HB3 GLU 114 3HB GLU 114 -12.246 8.398 -3.113 960 HG2 GLU 114 2HG GLU 114 -13.573 7.657 -4.972 961 HG3 GLU 114 3HG GLU 114 -13.290 6.273 -3.914 962 H ALA 115 H ALA 115 -10.860 7.654 -1.032 963 HA ALA 115 HA ALA 115 -10.112 5.003 -1.655 964 HB1 ALA 115 3HB ALA 115 -8.525 6.876 -1.646 965 HB2 ALA 115 1HB ALA 115 -7.952 5.553 -0.628 966 HB3 ALA 115 2HB ALA 115 -8.658 6.996 0.110 967 H LYS 116 H LYS 116 -11.157 6.491 1.341 968 HA LYS 116 HA LYS 116 -10.634 4.503 3.242 969 HB2 LYS 116 2HB LYS 116 -11.306 6.699 3.895 970 HB3 LYS 116 3HB LYS 116 -12.751 6.638 2.897 971 HG2 LYS 116 2HG LYS 116 -13.644 4.863 4.481 972 HG3 LYS 116 3HG LYS 116 -12.271 5.223 5.531 973 HD2 LYS 116 2HD LYS 116 -14.388 7.192 4.617 974 HD3 LYS 116 3HD LYS 116 -14.263 6.489 6.233 975 HE2 LYS 116 2HE LYS 116 -12.119 7.627 6.575 976 HE3 LYS 116 3HE LYS 116 -12.179 8.268 4.932 977 HZ1 LYS 116 3HZ LYS 116 -12.889 9.969 6.367 978 HZ2 LYS 116 1HZ LYS 116 -13.957 8.952 7.202 979 HZ3 LYS 116 2HZ LYS 116 -14.287 9.398 5.609 980 H LYS 117 H LYS 117 -13.490 5.039 1.175 981 HA LYS 117 HA LYS 117 -15.090 2.874 2.061 982 HB2 LYS 117 2HB LYS 117 -15.119 4.031 -0.762 983 HB3 LYS 117 3HB LYS 117 -16.457 3.272 0.095 984 HG2 LYS 117 2HG LYS 117 -16.613 5.192 1.611 985 HG3 LYS 117 3HG LYS 117 -15.201 5.927 0.843 986 HD2 LYS 117 2HD LYS 117 -16.547 5.856 -1.356 987 HD3 LYS 117 3HD LYS 117 -17.958 5.485 -0.362 988 HE2 LYS 117 2HE LYS 117 -16.230 7.972 -0.169 989 HE3 LYS 117 3HE LYS 117 -17.844 7.878 -0.873 990 HZ1 LYS 117 3HZ LYS 117 -17.761 8.755 1.432 991 HZ2 LYS 117 1HZ LYS 117 -17.251 7.233 1.957 992 HZ3 LYS 117 2HZ LYS 117 -18.771 7.415 1.247 993 H ARG 118 H ARG 118 -12.775 3.281 -0.549 994 HA ARG 118 HA ARG 118 -13.125 0.861 -1.917 995 HB2 ARG 118 2HB ARG 118 -11.949 3.029 -2.727 996 HB3 ARG 118 3HB ARG 118 -10.533 2.471 -1.840 997 HG2 ARG 118 2HG ARG 118 -10.278 1.867 -4.171 998 HG3 ARG 118 3HG ARG 118 -10.537 0.390 -3.237 999 HD2 ARG 118 2HD ARG 118 -12.977 0.493 -3.880 1000 HD3 ARG 118 3HD ARG 118 -12.587 1.855 -4.935 1001 HE ARG 118 HE ARG 118 -11.124 0.317 -6.188 1002 HH11 ARG 118 1HH1 ARG 118 -13.666 -1.085 -4.202 1003 HH12 ARG 118 2HH1 ARG 118 -13.740 -2.557 -5.121 1004 HH21 ARG 118 1HH2 ARG 118 -11.217 -1.615 -7.388 1005 HH22 ARG 118 2HH2 ARG 118 -12.337 -2.864 -6.941 1006 H LEU 119 H LEU 119 -10.870 1.842 0.673 1007 HA LEU 119 HA LEU 119 -9.327 -0.482 0.887 1008 HB2 LEU 119 2HB LEU 119 -10.127 1.614 2.937 1009 HB3 LEU 119 3HB LEU 119 -9.165 0.223 3.418 1010 HG LEU 119 HG LEU 119 -8.342 2.312 1.364 1011 HD11 LEU 119 1HD1 LEU 119 -7.316 1.803 4.172 1012 HD12 LEU 119 2HD1 LEU 119 -8.323 3.161 3.662 1013 HD13 LEU 119 3HD1 LEU 119 -6.686 2.997 3.032 1014 HD21 LEU 119 3HD2 LEU 119 -7.422 0.105 0.788 1015 HD22 LEU 119 1HD2 LEU 119 -6.779 -0.073 2.425 1016 HD23 LEU 119 2HD2 LEU 119 -6.155 1.186 1.354 1017 H LYS 120 H LYS 120 -12.345 0.418 2.541 1018 HA LYS 120 HA LYS 120 -12.572 -1.793 4.224 1019 HB2 LYS 120 2HB LYS 120 -14.177 0.518 3.599 1020 HB3 LYS 120 3HB LYS 120 -15.247 -0.869 3.470 1021 HG2 LYS 120 2HG LYS 120 -13.521 -0.228 5.869 1022 HG3 LYS 120 3HG LYS 120 -15.234 0.168 5.737 1023 HD2 LYS 120 2HD LYS 120 -15.743 -2.273 5.556 1024 HD3 LYS 120 3HD LYS 120 -14.021 -2.623 5.741 1025 HE2 LYS 120 2HE LYS 120 -14.083 -1.524 7.986 1026 HE3 LYS 120 3HE LYS 120 -15.831 -1.322 7.808 1027 HZ1 LYS 120 3HZ LYS 120 -16.068 -3.714 7.662 1028 HZ2 LYS 120 1HZ LYS 120 -15.247 -3.312 9.083 1029 HZ3 LYS 120 2HZ LYS 120 -14.399 -3.928 7.754 1030 H GLU 121 H GLU 121 -13.966 -1.282 0.974 1031 HA GLU 121 HA GLU 121 -15.458 -3.610 0.638 1032 HB2 GLU 121 2HB GLU 121 -13.829 -2.169 -1.505 1033 HB3 GLU 121 3HB GLU 121 -15.149 -3.296 -1.805 1034 HG2 GLU 121 2HG GLU 121 -16.727 -1.756 -0.701 1035 HG3 GLU 121 3HG GLU 121 -15.408 -0.616 -0.428 1036 H LEU 122 H LEU 122 -12.057 -3.028 -0.130 1037 HA LEU 122 HA LEU 122 -11.477 -5.622 -1.143 1038 HB2 LEU 122 2HB LEU 122 -9.827 -3.217 -0.335 1039 HB3 LEU 122 3HB LEU 122 -9.016 -4.749 -0.610 1040 HG LEU 122 HG LEU 122 -9.975 -4.807 -2.928 1041 HD11 LEU 122 1HD1 LEU 122 -10.860 -1.976 -2.450 1042 HD12 LEU 122 2HD1 LEU 122 -11.917 -3.377 -2.633 1043 HD13 LEU 122 3HD1 LEU 122 -10.904 -2.858 -3.978 1044 HD21 LEU 122 3HD2 LEU 122 -8.266 -2.386 -2.330 1045 HD22 LEU 122 1HD2 LEU 122 -8.424 -3.192 -3.894 1046 HD23 LEU 122 2HD2 LEU 122 -7.690 -4.044 -2.538 1047 H LEU 123 H LEU 123 -11.311 -4.168 2.076 1048 HA LEU 123 HA LEU 123 -9.619 -6.230 3.225 1049 HB2 LEU 123 2HB LEU 123 -10.973 -3.725 4.219 1050 HB3 LEU 123 3HB LEU 123 -10.391 -4.880 5.402 1051 HG LEU 123 HG LEU 123 -8.132 -4.425 4.981 1052 HD11 LEU 123 1HD1 LEU 123 -8.798 -3.293 2.252 1053 HD12 LEU 123 2HD1 LEU 123 -8.054 -4.860 2.576 1054 HD13 LEU 123 3HD1 LEU 123 -7.188 -3.375 2.971 1055 HD21 LEU 123 3HD2 LEU 123 -7.867 -1.992 4.929 1056 HD22 LEU 123 1HD2 LEU 123 -9.244 -2.454 5.929 1057 HD23 LEU 123 2HD2 LEU 123 -9.509 -1.813 4.305 1058 H GLU 124 H GLU 124 -13.034 -5.789 2.830 1059 HA GLU 124 HA GLU 124 -14.060 -7.244 4.995 1060 HB2 GLU 124 2HB GLU 124 -15.171 -6.780 2.203 1061 HB3 GLU 124 3HB GLU 124 -16.081 -7.628 3.447 1062 HG2 GLU 124 2HG GLU 124 -15.073 -4.783 3.691 1063 HG3 GLU 124 3HG GLU 124 -16.703 -5.233 3.220 1064 H LYS 125 H LYS 125 -12.750 -8.391 1.921 1065 HA LYS 125 HA LYS 125 -13.313 -11.182 2.693 1066 HB2 LYS 125 2HB LYS 125 -12.674 -11.816 0.386 1067 HB3 LYS 125 3HB LYS 125 -14.057 -10.741 0.446 1068 HG2 LYS 125 2HG LYS 125 -11.271 -9.728 -0.158 1069 HG3 LYS 125 3HG LYS 125 -12.304 -10.394 -1.418 1070 HD2 LYS 125 2HD LYS 125 -13.114 -8.050 0.341 1071 HD3 LYS 125 3HD LYS 125 -12.294 -7.859 -1.204 1072 HE2 LYS 125 2HE LYS 125 -14.640 -7.500 -1.543 1073 HE3 LYS 125 3HE LYS 125 -14.212 -9.022 -2.314 1074 HZ1 LYS 125 3HZ LYS 125 -15.186 -10.199 -0.432 1075 HZ2 LYS 125 1HZ LYS 125 -16.319 -9.153 -1.116 1076 HZ3 LYS 125 2HZ LYS 125 -15.555 -8.739 0.330 1077 H VAL 126 H VAL 126 -10.607 -9.072 1.663 1078 HA VAL 126 HA VAL 126 -8.732 -10.385 3.348 1079 HB VAL 126 HB VAL 126 -8.767 -12.187 1.722 1080 HG11 VAL 126 1HG1 VAL 126 -9.640 -11.045 -0.251 1081 HG12 VAL 126 2HG1 VAL 126 -8.187 -11.959 -0.656 1082 HG13 VAL 126 3HG1 VAL 126 -8.106 -10.204 -0.475 1083 HG21 VAL 126 3HG2 VAL 126 -6.200 -10.598 1.369 1084 HG22 VAL 126 1HG2 VAL 126 -6.396 -12.327 1.061 1085 HG23 VAL 126 2HG2 VAL 126 -6.571 -11.698 2.697 1086 H GLY 127 H GLY 127 -8.748 -8.606 0.229 1087 HA2 GLY 127 2HA GLY 127 -7.824 -6.142 0.932 1088 HA3 GLY 127 3HA GLY 127 -6.350 -7.113 0.846 1089 H SER 128 H SER 128 -9.211 -7.602 -1.148 1090 HA SER 128 HA SER 128 -8.185 -6.367 -3.519 1091 HB2 SER 128 2HB SER 128 -6.656 -8.322 -3.390 1092 HB3 SER 128 3HB SER 128 -8.037 -9.417 -3.328 1093 HG SER 128 HG SER 128 -8.388 -9.117 -5.393 1094 H LEU 129 H LEU 129 -9.938 -5.871 -4.749 1095 HA LEU 129 HA LEU 129 -12.125 -7.709 -5.159 1096 HB2 LEU 129 2HB LEU 129 -12.868 -6.622 -3.079 1097 HB3 LEU 129 3HB LEU 129 -12.638 -5.033 -3.786 1098 HG LEU 129 HG LEU 129 -14.512 -5.397 -5.341 1099 HD11 LEU 129 1HD1 LEU 129 -14.780 -8.158 -4.118 1100 HD12 LEU 129 2HD1 LEU 129 -14.293 -7.775 -5.772 1101 HD13 LEU 129 3HD1 LEU 129 -15.930 -7.411 -5.235 1102 HD21 LEU 129 3HD2 LEU 129 -16.378 -5.476 -3.742 1103 HD22 LEU 129 1HD2 LEU 129 -15.055 -4.475 -3.142 1104 HD23 LEU 129 2HD2 LEU 129 -15.294 -6.098 -2.493 1105 H GLU 130 H GLU 130 -12.888 -7.534 -7.129 1106 HA GLU 130 HA GLU 130 -13.283 -6.970 -9.232 1107 HB2 GLU 130 2HB GLU 130 -13.558 -4.209 -8.023 1108 HB3 GLU 130 3HB GLU 130 -13.852 -4.511 -9.733 1109 HG2 GLU 130 2HG GLU 130 -15.564 -6.262 -9.007 1110 HG3 GLU 130 3HG GLU 130 -15.379 -5.645 -7.371 1111 H HIS 131 H HIS 131 -11.275 -7.719 -9.922 1112 HA HIS 131 HA HIS 131 -9.222 -5.776 -10.709 1113 HB2 HIS 131 2HB HIS 131 -9.370 -8.804 -10.988 1114 HB3 HIS 131 3HB HIS 131 -8.049 -7.842 -11.644 1115 HD1 HIS 131 HD1 HIS 131 -7.424 -10.015 -9.617 1116 HD2 HIS 131 HD2 HIS 131 -8.195 -6.066 -8.549 1117 HE1 HIS 131 HE1 HIS 131 -6.233 -9.658 -7.438 1118 HE2 HIS 131 HE2 HIS 131 -6.951 -7.366 -6.706 1119 H HIS 132 H HIS 132 -12.154 -6.729 -11.923 1120 HA HIS 132 HA HIS 132 -11.453 -6.738 -14.761 1121 HB2 HIS 132 2HB HIS 132 -13.297 -8.186 -13.822 1122 HB3 HIS 132 3HB HIS 132 -14.210 -6.737 -13.435 1123 HD1 HIS 132 HD1 HIS 132 -13.066 -8.825 -16.364 1124 HD2 HIS 132 HD2 HIS 132 -15.678 -5.695 -15.558 1125 HE1 HIS 132 HE1 HIS 132 -14.425 -8.509 -18.457 1126 HE2 HIS 132 HE2 HIS 132 -15.882 -6.520 -17.984 1127 H HIS 133 H HIS 133 -10.503 -4.518 -13.577 1128 HA HIS 133 HA HIS 133 -11.854 -2.377 -15.098 1129 HB2 HIS 133 2HB HIS 133 -10.501 -2.068 -12.363 1130 HB3 HIS 133 3HB HIS 133 -11.045 -0.727 -13.364 1131 HD1 HIS 133 HD1 HIS 133 -13.531 -0.135 -13.288 1132 HD2 HIS 133 HD2 HIS 133 -12.589 -3.546 -11.104 1133 HE1 HIS 133 HE1 HIS 133 -15.606 -0.725 -12.002 1134 HE2 HIS 133 HE2 HIS 133 -15.047 -2.839 -10.780 1135 H HIS 134 H HIS 134 -9.612 -4.454 -15.356 1136 HA HIS 134 HA HIS 134 -7.130 -2.942 -15.159 1137 HB2 HIS 134 2HB HIS 134 -7.385 -5.248 -14.155 1138 HB3 HIS 134 3HB HIS 134 -7.547 -5.899 -15.780 1139 HD1 HIS 134 HD1 HIS 134 -5.376 -6.281 -17.101 1140 HD2 HIS 134 HD2 HIS 134 -4.801 -4.275 -13.508 1141 HE1 HIS 134 HE1 HIS 134 -2.885 -6.175 -16.769 1142 HE2 HIS 134 HE2 HIS 134 -2.575 -4.811 -14.673 1143 H HIS 135 H HIS 135 -7.726 -1.590 -16.992 1144 HA HIS 135 HA HIS 135 -6.525 -2.707 -19.453 1145 HB2 HIS 135 2HB HIS 135 -8.019 -1.520 -20.902 1146 HB3 HIS 135 3HB HIS 135 -9.070 -2.264 -19.700 1147 HD1 HIS 135 HD1 HIS 135 -9.892 -0.539 -17.716 1148 HD2 HIS 135 HD2 HIS 135 -8.359 1.195 -21.179 1149 HE1 HIS 135 HE1 HIS 135 -10.637 1.865 -17.666 1150 HE2 HIS 135 HE2 HIS 135 -9.860 2.819 -19.858 1151 H HIS 136 H HIS 136 -6.738 -0.284 -17.032 1152 HA HIS 136 HA HIS 136 -4.393 1.128 -17.969 1153 HB2 HIS 136 2HB HIS 136 -6.219 2.372 -19.102 1154 HB3 HIS 136 3HB HIS 136 -7.063 2.558 -17.569 1155 HD1 HIS 136 HD1 HIS 136 -4.058 3.816 -19.457 1156 HD2 HIS 136 HD2 HIS 136 -6.149 4.685 -15.971 1157 HE1 HIS 136 HE1 HIS 136 -3.158 6.013 -18.658 1158 HE2 HIS 136 HE2 HIS 136 -4.615 6.621 -16.705 Start of MODEL 10 1 H1 MET 1 1H MET 1 -6.639 -14.380 -0.722 2 H2 MET 1 2H MET 1 -5.478 -15.478 -1.264 3 H3 MET 1 3H MET 1 -5.760 -14.061 -2.133 4 HA MET 1 HA MET 1 -4.955 -12.738 -0.320 5 HB2 MET 1 2HB MET 1 -4.342 -15.423 0.991 6 HB3 MET 1 3HB MET 1 -3.765 -13.874 1.590 7 HG2 MET 1 2HG MET 1 -6.182 -13.194 1.868 8 HG3 MET 1 3HG MET 1 -6.623 -14.861 1.505 9 HE1 MET 1 3HE MET 1 -4.848 -16.745 4.520 10 HE2 MET 1 1HE MET 1 -4.107 -16.398 2.958 11 HE3 MET 1 2HE MET 1 -5.779 -16.959 3.040 12 H GLY 2 H GLY 2 -2.347 -13.240 0.568 13 HA2 GLY 2 2HA GLY 2 -0.161 -13.386 -0.171 14 HA3 GLY 2 3HA GLY 2 -0.718 -14.152 -1.654 15 H THR 3 H THR 3 -1.971 -11.128 -0.396 16 HA THR 3 HA THR 3 -0.873 -9.664 -2.718 17 HB THR 3 HB THR 3 -2.790 -8.124 -2.499 18 HG1 THR 3 HG1 THR 3 -3.301 -8.178 -0.365 19 HG21 THR 3 3HG2 THR 3 -3.110 -10.113 -3.937 20 HG22 THR 3 1HG2 THR 3 -4.623 -9.621 -3.170 21 HG23 THR 3 2HG2 THR 3 -3.731 -11.013 -2.553 22 H VAL 4 H VAL 4 -0.323 -7.421 -2.378 23 HA VAL 4 HA VAL 4 0.370 -6.655 0.400 24 HB VAL 4 HB VAL 4 2.147 -6.170 -2.062 25 HG11 VAL 4 1HG1 VAL 4 3.813 -5.293 -0.470 26 HG12 VAL 4 2HG1 VAL 4 2.694 -5.555 0.867 27 HG13 VAL 4 3HG1 VAL 4 2.312 -4.372 -0.379 28 HG21 VAL 4 3HG2 VAL 4 3.763 -7.745 -1.079 29 HG22 VAL 4 1HG2 VAL 4 2.223 -8.544 -1.410 30 HG23 VAL 4 2HG2 VAL 4 2.641 -8.087 0.241 31 H VAL 5 H VAL 5 -0.860 -4.903 0.800 32 HA VAL 5 HA VAL 5 -1.516 -3.052 -1.413 33 HB VAL 5 HB VAL 5 -3.534 -2.359 -0.038 34 HG11 VAL 5 1HG1 VAL 5 -4.933 -4.283 -0.718 35 HG12 VAL 5 2HG1 VAL 5 -3.482 -5.265 -0.942 36 HG13 VAL 5 3HG1 VAL 5 -3.765 -3.862 -1.973 37 HG21 VAL 5 3HG2 VAL 5 -4.388 -3.895 1.711 38 HG22 VAL 5 1HG2 VAL 5 -2.836 -3.196 2.179 39 HG23 VAL 5 2HG2 VAL 5 -2.912 -4.857 1.592 40 H ILE 6 H ILE 6 -0.757 -1.063 -1.285 41 HA ILE 6 HA ILE 6 0.432 -0.124 1.274 42 HB ILE 6 HB ILE 6 1.403 0.549 -1.555 43 HG12 ILE 6 2HG1 ILE 6 3.626 -0.500 -0.612 44 HG13 ILE 6 3HG1 ILE 6 2.595 -1.257 0.592 45 HG21 ILE 6 1HG2 ILE 6 2.445 1.514 1.133 46 HG22 ILE 6 2HG2 ILE 6 1.614 2.493 -0.078 47 HG23 ILE 6 3HG2 ILE 6 3.210 1.829 -0.424 48 HD11 ILE 6 3HD1 ILE 6 3.108 -2.767 -1.229 49 HD12 ILE 6 1HD1 ILE 6 2.421 -1.638 -2.395 50 HD13 ILE 6 2HD1 ILE 6 1.382 -2.413 -1.198 51 H VAL 7 H VAL 7 -0.594 1.580 2.067 52 HA VAL 7 HA VAL 7 -2.464 3.135 0.471 53 HB VAL 7 HB VAL 7 -1.714 3.556 3.407 54 HG11 VAL 7 1HG1 VAL 7 -4.187 4.369 1.835 55 HG12 VAL 7 2HG1 VAL 7 -2.904 5.447 2.388 56 HG13 VAL 7 3HG1 VAL 7 -3.936 4.630 3.563 57 HG21 VAL 7 3HG2 VAL 7 -3.707 2.176 3.972 58 HG22 VAL 7 1HG2 VAL 7 -2.436 1.246 3.176 59 HG23 VAL 7 2HG2 VAL 7 -3.866 1.743 2.270 60 H VAL 8 H VAL 8 -1.493 4.519 -0.799 61 HA VAL 8 HA VAL 8 0.805 6.160 0.044 62 HB VAL 8 HB VAL 8 -0.424 5.653 -2.712 63 HG11 VAL 8 1HG1 VAL 8 1.939 7.414 -1.971 64 HG12 VAL 8 2HG1 VAL 8 0.407 7.931 -2.673 65 HG13 VAL 8 3HG1 VAL 8 1.516 6.940 -3.619 66 HG21 VAL 8 3HG2 VAL 8 2.269 4.772 -1.599 67 HG22 VAL 8 1HG2 VAL 8 1.668 4.460 -3.231 68 HG23 VAL 8 2HG2 VAL 8 0.865 3.730 -1.837 69 H SER 9 H SER 9 0.307 8.115 0.816 70 HA SER 9 HA SER 9 -1.799 9.753 -0.411 71 HB2 SER 9 2HB SER 9 -1.591 9.452 2.609 72 HB3 SER 9 3HB SER 9 -2.827 10.324 1.713 73 HG SER 9 HG SER 9 -2.968 7.893 0.836 74 H ASN 10 H ASN 10 -1.134 11.850 -0.569 75 HA ASN 10 HA ASN 10 1.592 12.533 0.055 76 HB2 ASN 10 2HB ASN 10 0.496 13.248 -2.045 77 HB3 ASN 10 3HB ASN 10 -0.661 14.209 -1.141 78 HD21 ASN 10 1HD2 ASN 10 2.711 13.962 -2.120 79 HD22 ASN 10 2HD2 ASN 10 3.096 15.622 -1.826 80 H ASP 11 H ASP 11 -1.499 13.113 1.550 81 HA ASP 11 HA ASP 11 -0.366 14.932 3.581 82 HB2 ASP 11 2HB ASP 11 -2.536 15.570 2.521 83 HB3 ASP 11 3HB ASP 11 -3.252 14.079 3.105 84 H GLU 12 H GLU 12 -0.582 14.426 5.836 85 HA GLU 12 HA GLU 12 0.056 11.627 6.360 86 HB2 GLU 12 2HB GLU 12 1.501 13.515 7.150 87 HB3 GLU 12 3HB GLU 12 0.194 14.047 8.202 88 HG2 GLU 12 2HG GLU 12 0.324 11.882 9.420 89 HG3 GLU 12 3HG GLU 12 1.675 11.403 8.390 90 H ARG 13 H ARG 13 -2.321 14.057 7.442 91 HA ARG 13 HA ARG 13 -3.567 12.443 9.435 92 HB2 ARG 13 2HB ARG 13 -4.612 14.866 7.937 93 HB3 ARG 13 3HB ARG 13 -5.472 14.089 9.265 94 HG2 ARG 13 2HG ARG 13 -3.516 14.593 10.752 95 HG3 ARG 13 3HG ARG 13 -2.781 15.485 9.418 96 HD2 ARG 13 2HD ARG 13 -4.679 17.046 9.390 97 HD3 ARG 13 3HD ARG 13 -5.475 16.135 10.680 98 HE ARG 13 HE ARG 13 -3.207 17.948 10.912 99 HH11 ARG 13 1HH1 ARG 13 -5.159 15.504 12.545 100 HH12 ARG 13 2HH1 ARG 13 -4.645 15.990 14.133 101 HH21 ARG 13 1HH2 ARG 13 -2.527 18.541 12.981 102 HH22 ARG 13 2HH2 ARG 13 -3.156 17.711 14.375 103 H ILE 14 H ILE 14 -3.984 12.745 5.970 104 HA ILE 14 HA ILE 14 -6.379 11.286 5.689 105 HB ILE 14 HB ILE 14 -3.993 11.448 3.781 106 HG12 ILE 14 2HG1 ILE 14 -4.948 13.646 4.162 107 HG13 ILE 14 3HG1 ILE 14 -5.464 13.117 2.568 108 HG21 ILE 14 1HG2 ILE 14 -5.546 10.724 1.990 109 HG22 ILE 14 2HG2 ILE 14 -6.806 10.451 3.196 110 HG23 ILE 14 3HG2 ILE 14 -5.338 9.472 3.220 111 HD11 ILE 14 3HD1 ILE 14 -7.263 14.227 3.708 112 HD12 ILE 14 1HD1 ILE 14 -7.132 13.141 5.088 113 HD13 ILE 14 2HD1 ILE 14 -7.671 12.523 3.524 114 H LEU 15 H LEU 15 -2.964 10.183 5.771 115 HA LEU 15 HA LEU 15 -3.414 7.405 5.635 116 HB2 LEU 15 2HB LEU 15 -1.213 9.014 6.968 117 HB3 LEU 15 3HB LEU 15 -1.177 7.262 6.877 118 HG LEU 15 HG LEU 15 -1.225 9.071 4.438 119 HD11 LEU 15 1HD1 LEU 15 0.829 9.397 5.746 120 HD12 LEU 15 2HD1 LEU 15 1.155 8.584 4.221 121 HD13 LEU 15 3HD1 LEU 15 1.133 7.656 5.724 122 HD21 LEU 15 3HD2 LEU 15 -2.141 6.841 3.989 123 HD22 LEU 15 1HD2 LEU 15 -0.723 6.079 4.717 124 HD23 LEU 15 2HD2 LEU 15 -0.563 7.013 3.225 125 H GLU 16 H GLU 16 -3.586 9.624 8.398 126 HA GLU 16 HA GLU 16 -3.642 7.642 10.463 127 HB2 GLU 16 2HB GLU 16 -2.988 10.044 10.804 128 HB3 GLU 16 3HB GLU 16 -4.660 10.517 10.523 129 HG2 GLU 16 2HG GLU 16 -4.301 10.518 12.888 130 HG3 GLU 16 3HG GLU 16 -5.308 9.122 12.515 131 H GLU 17 H GLU 17 -6.140 9.643 8.925 132 HA GLU 17 HA GLU 17 -8.468 8.635 10.079 133 HB2 GLU 17 2HB GLU 17 -8.394 10.671 8.709 134 HB3 GLU 17 3HB GLU 17 -7.908 9.749 7.292 135 HG2 GLU 17 2HG GLU 17 -10.261 10.455 7.172 136 HG3 GLU 17 3HG GLU 17 -10.101 8.700 7.174 137 H LEU 18 H LEU 18 -6.706 7.622 7.224 138 HA LEU 18 HA LEU 18 -8.414 5.524 6.362 139 HB2 LEU 18 2HB LEU 18 -5.714 6.619 5.601 140 HB3 LEU 18 3HB LEU 18 -6.101 5.003 5.049 141 HG LEU 18 HG LEU 18 -7.994 5.815 3.741 142 HD11 LEU 18 1HD1 LEU 18 -8.838 7.596 5.196 143 HD12 LEU 18 2HD1 LEU 18 -8.650 8.141 3.532 144 HD13 LEU 18 3HD1 LEU 18 -7.466 8.615 4.750 145 HD21 LEU 18 3HD2 LEU 18 -6.804 7.243 2.104 146 HD22 LEU 18 1HD2 LEU 18 -5.833 5.879 2.652 147 HD23 LEU 18 2HD2 LEU 18 -5.517 7.497 3.281 148 H LEU 19 H LEU 19 -5.706 5.709 8.595 149 HA LEU 19 HA LEU 19 -4.841 3.047 8.697 150 HB2 LEU 19 2HB LEU 19 -3.662 4.935 9.833 151 HB3 LEU 19 3HB LEU 19 -4.973 5.039 10.993 152 HG LEU 19 HG LEU 19 -4.341 2.478 11.473 153 HD11 LEU 19 1HD1 LEU 19 -1.955 2.010 11.287 154 HD12 LEU 19 2HD1 LEU 19 -1.710 3.525 10.411 155 HD13 LEU 19 3HD1 LEU 19 -2.697 2.240 9.704 156 HD21 LEU 19 3HD2 LEU 19 -2.687 4.760 12.580 157 HD22 LEU 19 1HD2 LEU 19 -2.887 3.166 13.311 158 HD23 LEU 19 2HD2 LEU 19 -4.271 4.243 13.157 159 H GLU 20 H GLU 20 -7.236 4.743 10.615 160 HA GLU 20 HA GLU 20 -7.880 2.636 12.392 161 HB2 GLU 20 2HB GLU 20 -9.599 5.037 11.687 162 HB3 GLU 20 3HB GLU 20 -9.601 4.130 13.195 163 HG2 GLU 20 2HG GLU 20 -7.392 4.982 13.777 164 HG3 GLU 20 3HG GLU 20 -7.236 5.759 12.198 165 H VAL 21 H VAL 21 -9.118 3.631 9.271 166 HA VAL 21 HA VAL 21 -11.518 2.098 9.253 167 HB VAL 21 HB VAL 21 -9.891 3.229 6.934 168 HG11 VAL 21 1HG1 VAL 21 -11.952 2.969 5.563 169 HG12 VAL 21 2HG1 VAL 21 -12.723 2.114 6.900 170 HG13 VAL 21 3HG1 VAL 21 -11.318 1.412 6.100 171 HG21 VAL 21 3HG2 VAL 21 -10.737 4.953 8.480 172 HG22 VAL 21 1HG2 VAL 21 -12.373 4.308 8.324 173 HG23 VAL 21 2HG2 VAL 21 -11.575 5.038 6.930 174 H VAL 22 H VAL 22 -8.179 1.418 8.179 175 HA VAL 22 HA VAL 22 -8.762 -1.172 7.076 176 HB VAL 22 HB VAL 22 -6.080 -0.036 8.014 177 HG11 VAL 22 1HG1 VAL 22 -5.042 -1.775 6.598 178 HG12 VAL 22 2HG1 VAL 22 -6.633 -2.436 6.222 179 HG13 VAL 22 3HG1 VAL 22 -6.021 -2.504 7.875 180 HG21 VAL 22 3HG2 VAL 22 -5.675 0.453 5.621 181 HG22 VAL 22 1HG2 VAL 22 -7.091 1.318 6.222 182 HG23 VAL 22 2HG2 VAL 22 -7.297 -0.122 5.225 183 H LEU 23 H LEU 23 -7.613 0.036 10.209 184 HA LEU 23 HA LEU 23 -7.052 -2.342 11.557 185 HB2 LEU 23 2HB LEU 23 -8.104 0.312 12.607 186 HB3 LEU 23 3HB LEU 23 -7.601 -0.992 13.657 187 HG LEU 23 HG LEU 23 -5.774 0.486 11.727 188 HD11 LEU 23 1HD1 LEU 23 -5.956 0.672 14.757 189 HD12 LEU 23 2HD1 LEU 23 -6.469 1.908 13.606 190 HD13 LEU 23 3HD1 LEU 23 -4.764 1.484 13.736 191 HD21 LEU 23 3HD2 LEU 23 -5.111 -1.649 13.789 192 HD22 LEU 23 1HD2 LEU 23 -3.939 -0.730 12.840 193 HD23 LEU 23 2HD2 LEU 23 -5.048 -1.834 12.033 194 H LYS 24 H LYS 24 -10.129 -0.539 11.361 195 HA LYS 24 HA LYS 24 -11.534 -2.231 13.194 196 HB2 LYS 24 2HB LYS 24 -13.514 -0.914 12.653 197 HB3 LYS 24 3HB LYS 24 -12.133 0.148 12.878 198 HG2 LYS 24 2HG LYS 24 -11.924 0.228 10.345 199 HG3 LYS 24 3HG LYS 24 -13.478 -0.600 10.264 200 HD2 LYS 24 2HD LYS 24 -12.995 2.092 11.609 201 HD3 LYS 24 3HD LYS 24 -13.671 1.877 9.997 202 HE2 LYS 24 2HE LYS 24 -15.654 0.825 10.889 203 HE3 LYS 24 3HE LYS 24 -14.954 0.757 12.511 204 HZ1 LYS 24 3HZ LYS 24 -15.496 3.292 11.056 205 HZ2 LYS 24 1HZ LYS 24 -15.052 3.118 12.676 206 HZ3 LYS 24 2HZ LYS 24 -16.572 2.597 12.155 207 H SER 25 H SER 25 -11.266 -2.093 9.671 208 HA SER 25 HA SER 25 -13.362 -3.966 9.108 209 HB2 SER 25 2HB SER 25 -11.048 -3.006 7.367 210 HB3 SER 25 3HB SER 25 -12.456 -3.911 6.795 211 HG SER 25 HG SER 25 -12.531 -1.377 8.081 212 H ASP 26 H ASP 26 -9.805 -4.216 9.380 213 HA ASP 26 HA ASP 26 -10.069 -7.048 10.039 214 HB2 ASP 26 2HB ASP 26 -9.654 -6.824 7.486 215 HB3 ASP 26 3HB ASP 26 -8.034 -6.277 7.907 216 HA PRO 27 HA PRO 27 -6.801 -5.351 12.757 217 HB2 PRO 27 2HB PRO 27 -7.201 -6.962 14.879 218 HB3 PRO 27 3HB PRO 27 -8.408 -5.737 14.432 219 HG2 PRO 27 2HG PRO 27 -8.438 -8.685 13.862 220 HG3 PRO 27 3HG PRO 27 -9.755 -7.646 14.451 221 HD2 PRO 27 2HD PRO 27 -9.417 -8.370 11.790 222 HD3 PRO 27 3HD PRO 27 -10.299 -6.919 12.327 223 H ASN 28 H ASN 28 -6.974 -8.397 11.194 224 HA ASN 28 HA ASN 28 -4.702 -9.660 12.531 225 HB2 ASN 28 2HB ASN 28 -6.281 -10.624 10.106 226 HB3 ASN 28 3HB ASN 28 -5.147 -11.580 11.056 227 HD21 ASN 28 1HD2 ASN 28 -7.947 -12.091 10.458 228 HD22 ASN 28 2HD2 ASN 28 -8.757 -12.216 11.979 229 H VAL 29 H VAL 29 -5.352 -7.865 9.603 230 HA VAL 29 HA VAL 29 -3.015 -8.584 8.126 231 HB VAL 29 HB VAL 29 -3.457 -6.538 6.745 232 HG11 VAL 29 1HG1 VAL 29 -5.954 -8.174 7.293 233 HG12 VAL 29 2HG1 VAL 29 -4.623 -8.647 6.245 234 HG13 VAL 29 3HG1 VAL 29 -5.613 -7.251 5.826 235 HG21 VAL 29 3HG2 VAL 29 -4.280 -5.023 8.504 236 HG22 VAL 29 1HG2 VAL 29 -5.733 -6.011 8.692 237 HG23 VAL 29 2HG2 VAL 29 -5.444 -5.138 7.182 238 H LYS 30 H LYS 30 -1.064 -7.466 7.849 239 HA LYS 30 HA LYS 30 -0.021 -6.212 10.232 240 HB2 LYS 30 2HB LYS 30 1.239 -7.030 7.588 241 HB3 LYS 30 3HB LYS 30 2.153 -6.167 8.820 242 HG2 LYS 30 2HG LYS 30 0.803 -8.855 9.213 243 HG3 LYS 30 3HG LYS 30 2.525 -8.612 8.905 244 HD2 LYS 30 2HD LYS 30 2.754 -7.363 11.018 245 HD3 LYS 30 3HD LYS 30 1.019 -7.504 11.311 246 HE2 LYS 30 2HE LYS 30 1.231 -9.935 11.533 247 HE3 LYS 30 3HE LYS 30 2.956 -9.839 11.163 248 HZ1 LYS 30 3HZ LYS 30 1.612 -8.615 13.518 249 HZ2 LYS 30 1HZ LYS 30 3.256 -8.491 13.160 250 HZ3 LYS 30 2HZ LYS 30 2.589 -9.996 13.537 251 H THR 31 H THR 31 -1.352 -4.336 10.230 252 HA THR 31 HA THR 31 -0.994 -2.218 8.315 253 HB THR 31 HB THR 31 -2.169 -0.823 10.082 254 HG1 THR 31 HG1 THR 31 -1.414 -2.228 11.865 255 HG21 THR 31 3HG2 THR 31 -4.361 -1.939 9.861 256 HG22 THR 31 1HG2 THR 31 -3.557 -3.431 9.358 257 HG23 THR 31 2HG2 THR 31 -3.476 -1.995 8.334 258 H VAL 32 H VAL 32 1.172 -1.783 8.140 259 HA VAL 32 HA VAL 32 2.695 -0.964 10.550 260 HB VAL 32 HB VAL 32 3.806 -2.061 7.930 261 HG11 VAL 32 1HG1 VAL 32 5.953 -2.265 9.153 262 HG12 VAL 32 2HG1 VAL 32 5.207 -1.547 10.582 263 HG13 VAL 32 3HG1 VAL 32 5.393 -0.591 9.109 264 HG21 VAL 32 3HG2 VAL 32 4.301 -4.167 9.134 265 HG22 VAL 32 1HG2 VAL 32 2.566 -3.843 9.058 266 HG23 VAL 32 2HG2 VAL 32 3.455 -3.545 10.552 267 H ARG 33 H ARG 33 2.758 1.217 10.590 268 HA ARG 33 HA ARG 33 3.356 2.715 8.109 269 HB2 ARG 33 2HB ARG 33 2.922 4.772 9.469 270 HB3 ARG 33 3HB ARG 33 1.520 3.719 9.326 271 HG2 ARG 33 2HG ARG 33 1.698 2.993 11.591 272 HG3 ARG 33 3HG ARG 33 3.317 3.681 11.766 273 HD2 ARG 33 2HD ARG 33 1.659 5.050 12.903 274 HD3 ARG 33 3HD ARG 33 2.378 5.948 11.579 275 HE ARG 33 HE ARG 33 0.183 4.976 10.416 276 HH11 ARG 33 1HH1 ARG 33 0.480 6.667 13.508 277 HH12 ARG 33 2HH1 ARG 33 -1.117 7.343 13.401 278 HH21 ARG 33 1HH2 ARG 33 -1.836 5.939 10.277 279 HH22 ARG 33 2HH2 ARG 33 -2.421 6.931 11.579 280 H THR 34 H THR 34 5.367 3.302 7.753 281 HA THR 34 HA THR 34 7.344 3.981 9.650 282 HB THR 34 HB THR 34 7.390 1.530 10.135 283 HG1 THR 34 HG1 THR 34 9.368 2.186 10.497 284 HG21 THR 34 3HG2 THR 34 8.229 -0.102 8.473 285 HG22 THR 34 1HG2 THR 34 8.243 1.154 7.231 286 HG23 THR 34 2HG2 THR 34 6.713 0.616 7.926 287 H ASP 35 H ASP 35 9.033 4.995 8.663 288 HA ASP 35 HA ASP 35 9.079 5.177 5.712 289 HB2 ASP 35 2HB ASP 35 10.365 7.211 6.014 290 HB3 ASP 35 3HB ASP 35 8.994 7.286 7.114 291 H ASP 36 H ASP 36 10.331 3.051 7.744 292 HA ASP 36 HA ASP 36 13.144 3.454 7.744 293 HB2 ASP 36 2HB ASP 36 11.814 2.200 9.485 294 HB3 ASP 36 3HB ASP 36 11.590 0.891 8.332 295 H LYS 37 H LYS 37 10.975 2.023 5.469 296 HA LYS 37 HA LYS 37 11.200 1.397 3.327 297 HB2 LYS 37 2HB LYS 37 14.198 1.854 3.623 298 HB3 LYS 37 3HB LYS 37 13.342 1.605 2.107 299 HG2 LYS 37 2HG LYS 37 12.184 3.749 2.363 300 HG3 LYS 37 3HG LYS 37 12.909 3.976 3.958 301 HD2 LYS 37 2HD LYS 37 14.087 5.307 2.213 302 HD3 LYS 37 3HD LYS 37 15.149 4.111 2.962 303 HE2 LYS 37 2HE LYS 37 14.722 2.592 1.004 304 HE3 LYS 37 3HE LYS 37 13.797 3.893 0.253 305 HZ1 LYS 37 3HZ LYS 37 15.746 5.233 0.153 306 HZ2 LYS 37 1HZ LYS 37 16.109 3.729 -0.520 307 HZ3 LYS 37 2HZ LYS 37 16.650 4.110 1.034 308 H GLU 38 H GLU 38 14.247 0.084 4.703 309 HA GLU 38 HA GLU 38 14.035 -2.435 3.474 310 HB2 GLU 38 2HB GLU 38 15.851 -3.148 5.039 311 HB3 GLU 38 3HB GLU 38 16.194 -1.634 4.209 312 HG2 GLU 38 2HG GLU 38 15.655 -0.356 6.216 313 HG3 GLU 38 3HG GLU 38 15.156 -1.823 7.052 314 H LYS 39 H LYS 39 12.933 -1.314 6.673 315 HA LYS 39 HA LYS 39 12.246 -3.754 7.831 316 HB2 LYS 39 2HB LYS 39 12.186 -1.704 9.150 317 HB3 LYS 39 3HB LYS 39 10.881 -1.049 8.164 318 HG2 LYS 39 2HG LYS 39 9.375 -2.841 8.959 319 HG3 LYS 39 3HG LYS 39 10.683 -3.515 9.927 320 HD2 LYS 39 2HD LYS 39 10.716 -1.482 11.323 321 HD3 LYS 39 3HD LYS 39 9.448 -0.764 10.317 322 HE2 LYS 39 2HE LYS 39 8.523 -1.721 12.400 323 HE3 LYS 39 3HE LYS 39 7.887 -2.543 10.975 324 HZ1 LYS 39 3HZ LYS 39 10.096 -3.551 12.692 325 HZ2 LYS 39 1HZ LYS 39 9.438 -4.345 11.354 326 HZ3 LYS 39 2HZ LYS 39 8.497 -4.097 12.733 327 H VAL 40 H VAL 40 10.426 -1.765 5.503 328 HA VAL 40 HA VAL 40 7.942 -3.045 5.574 329 HB VAL 40 HB VAL 40 9.318 -1.836 3.114 330 HG11 VAL 40 1HG1 VAL 40 7.024 -1.570 2.194 331 HG12 VAL 40 2HG1 VAL 40 6.383 -2.481 3.560 332 HG13 VAL 40 3HG1 VAL 40 7.467 -3.265 2.413 333 HG21 VAL 40 3HG2 VAL 40 7.393 -0.550 5.099 334 HG22 VAL 40 1HG2 VAL 40 8.042 0.221 3.646 335 HG23 VAL 40 2HG2 VAL 40 9.121 -0.218 4.972 336 H LYS 41 H LYS 41 10.908 -3.955 3.870 337 HA LYS 41 HA LYS 41 9.881 -6.125 2.335 338 HB2 LYS 41 2HB LYS 41 12.719 -5.474 3.250 339 HB3 LYS 41 3HB LYS 41 12.346 -6.862 2.237 340 HG2 LYS 41 2HG LYS 41 13.143 -5.138 0.797 341 HG3 LYS 41 3HG LYS 41 11.408 -5.284 0.517 342 HD2 LYS 41 2HD LYS 41 11.050 -3.283 1.980 343 HD3 LYS 41 3HD LYS 41 12.801 -3.133 2.153 344 HE2 LYS 41 2HE LYS 41 11.235 -2.908 -0.435 345 HE3 LYS 41 3HE LYS 41 11.959 -1.574 0.460 346 HZ1 LYS 41 3HZ LYS 41 13.387 -2.107 -1.316 347 HZ2 LYS 41 1HZ LYS 41 13.371 -3.762 -0.947 348 HZ3 LYS 41 2HZ LYS 41 14.139 -2.670 0.091 349 H GLU 42 H GLU 42 11.485 -5.955 5.511 350 HA GLU 42 HA GLU 42 11.452 -8.683 6.164 351 HB2 GLU 42 2HB GLU 42 11.567 -6.142 7.799 352 HB3 GLU 42 3HB GLU 42 11.338 -7.676 8.635 353 HG2 GLU 42 2HG GLU 42 13.683 -7.082 8.645 354 HG3 GLU 42 3HG GLU 42 13.446 -8.515 7.657 355 H GLU 43 H GLU 43 9.000 -6.156 6.718 356 HA GLU 43 HA GLU 43 7.219 -7.809 8.214 357 HB2 GLU 43 2HB GLU 43 6.651 -5.201 6.741 358 HB3 GLU 43 3HB GLU 43 5.575 -5.968 7.898 359 HG2 GLU 43 2HG GLU 43 8.288 -4.762 8.472 360 HG3 GLU 43 3HG GLU 43 6.719 -4.117 8.947 361 H ILE 44 H ILE 44 7.527 -7.059 4.746 362 HA ILE 44 HA ILE 44 5.170 -8.282 3.781 363 HB ILE 44 HB ILE 44 7.899 -7.864 2.472 364 HG12 ILE 44 2HG1 ILE 44 5.174 -6.592 1.916 365 HG13 ILE 44 3HG1 ILE 44 6.523 -5.823 2.744 366 HG21 ILE 44 1HG2 ILE 44 6.970 -8.603 0.296 367 HG22 ILE 44 2HG2 ILE 44 5.484 -9.103 1.101 368 HG23 ILE 44 3HG2 ILE 44 7.001 -9.923 1.467 369 HD11 ILE 44 3HD1 ILE 44 7.839 -5.904 0.686 370 HD12 ILE 44 1HD1 ILE 44 6.316 -5.044 0.452 371 HD13 ILE 44 2HD1 ILE 44 6.498 -6.695 -0.151 372 H GLU 45 H GLU 45 8.451 -9.551 4.279 373 HA GLU 45 HA GLU 45 8.129 -12.179 3.399 374 HB2 GLU 45 2HB GLU 45 10.283 -10.930 3.902 375 HB3 GLU 45 3HB GLU 45 9.994 -11.197 5.610 376 HG2 GLU 45 2HG GLU 45 10.355 -13.420 3.576 377 HG3 GLU 45 3HG GLU 45 11.665 -12.744 4.531 378 H LYS 46 H LYS 46 7.873 -10.817 6.655 379 HA LYS 46 HA LYS 46 7.257 -13.124 8.122 380 HB2 LYS 46 2HB LYS 46 6.615 -10.190 8.616 381 HB3 LYS 46 3HB LYS 46 6.354 -11.451 9.816 382 HG2 LYS 46 2HG LYS 46 8.697 -11.859 10.063 383 HG3 LYS 46 3HG LYS 46 9.085 -10.936 8.607 384 HD2 LYS 46 2HD LYS 46 9.627 -9.702 10.721 385 HD3 LYS 46 3HD LYS 46 8.482 -8.844 9.689 386 HE2 LYS 46 2HE LYS 46 6.621 -9.606 11.118 387 HE3 LYS 46 3HE LYS 46 7.757 -10.489 12.139 388 HZ1 LYS 46 3HZ LYS 46 8.829 -8.343 12.642 389 HZ2 LYS 46 1HZ LYS 46 7.217 -8.411 13.148 390 HZ3 LYS 46 2HZ LYS 46 7.628 -7.545 11.756 391 H ALA 47 H ALA 47 5.136 -10.727 6.543 392 HA ALA 47 HA ALA 47 2.665 -11.686 7.528 393 HB1 ALA 47 3HB ALA 47 3.215 -10.152 4.961 394 HB2 ALA 47 1HB ALA 47 2.915 -9.444 6.550 395 HB3 ALA 47 2HB ALA 47 1.638 -10.348 5.732 396 H ARG 48 H ARG 48 4.276 -12.234 4.350 397 HA ARG 48 HA ARG 48 2.253 -13.993 3.377 398 HB2 ARG 48 2HB ARG 48 3.740 -14.375 1.438 399 HB3 ARG 48 3HB ARG 48 3.564 -12.673 1.816 400 HG2 ARG 48 2HG ARG 48 5.825 -12.874 1.253 401 HG3 ARG 48 3HG ARG 48 5.846 -12.876 3.013 402 HD2 ARG 48 2HD ARG 48 6.106 -15.330 3.008 403 HD3 ARG 48 3HD ARG 48 6.033 -15.344 1.247 404 HE ARG 48 HE ARG 48 8.108 -13.666 1.852 405 HH11 ARG 48 1HH1 ARG 48 7.358 -17.019 2.620 406 HH12 ARG 48 2HH1 ARG 48 9.028 -17.498 2.685 407 HH21 ARG 48 1HH2 ARG 48 10.267 -14.321 1.834 408 HH22 ARG 48 2HH2 ARG 48 10.681 -15.962 2.238 409 H LYS 49 H LYS 49 5.185 -14.528 5.183 410 HA LYS 49 HA LYS 49 5.569 -17.300 4.897 411 HB2 LYS 49 2HB LYS 49 7.145 -15.710 6.047 412 HB3 LYS 49 3HB LYS 49 6.011 -15.588 7.384 413 HG2 LYS 49 2HG LYS 49 6.373 -18.291 7.351 414 HG3 LYS 49 3HG LYS 49 7.927 -17.786 6.688 415 HD2 LYS 49 2HD LYS 49 6.722 -16.982 9.358 416 HD3 LYS 49 3HD LYS 49 8.108 -18.041 9.108 417 HE2 LYS 49 2HE LYS 49 8.019 -15.080 8.425 418 HE3 LYS 49 3HE LYS 49 8.771 -15.777 9.858 419 HZ1 LYS 49 3HZ LYS 49 10.419 -15.346 8.197 420 HZ2 LYS 49 1HZ LYS 49 9.580 -16.257 7.046 421 HZ3 LYS 49 2HZ LYS 49 10.262 -17.019 8.393 422 H GLN 50 H GLN 50 3.584 -15.426 7.139 423 HA GLN 50 HA GLN 50 2.311 -17.701 8.403 424 HB2 GLN 50 2HB GLN 50 2.819 -15.530 9.573 425 HB3 GLN 50 3HB GLN 50 1.649 -14.718 8.540 426 HG2 GLN 50 2HG GLN 50 0.708 -15.165 10.755 427 HG3 GLN 50 3HG GLN 50 -0.164 -16.058 9.511 428 HE21 GLN 50 1HE2 GLN 50 -0.950 -17.583 10.970 429 HE22 GLN 50 2HE2 GLN 50 0.051 -18.772 11.721 430 H GLY 51 H GLY 51 1.814 -15.800 5.581 431 HA2 GLY 51 2HA GLY 51 0.384 -16.241 3.795 432 HA3 GLY 51 3HA GLY 51 -0.607 -17.256 4.833 433 H ARG 52 H ARG 52 0.395 -13.986 5.546 434 HA ARG 52 HA ARG 52 -2.412 -13.087 5.644 435 HB2 ARG 52 2HB ARG 52 0.038 -12.169 7.230 436 HB3 ARG 52 3HB ARG 52 -1.537 -11.386 7.307 437 HG2 ARG 52 2HG ARG 52 -2.509 -13.551 8.113 438 HG3 ARG 52 3HG ARG 52 -0.875 -14.210 8.167 439 HD2 ARG 52 2HD ARG 52 -0.228 -12.575 9.862 440 HD3 ARG 52 3HD ARG 52 -1.811 -11.786 9.749 441 HE ARG 52 HE ARG 52 -1.656 -14.624 10.500 442 HH11 ARG 52 1HH1 ARG 52 -2.380 -11.326 11.478 443 HH12 ARG 52 2HH1 ARG 52 -3.198 -11.822 12.930 444 HH21 ARG 52 1HH2 ARG 52 -2.773 -15.257 12.336 445 HH22 ARG 52 2HH2 ARG 52 -3.424 -14.062 13.419 446 HA PRO 53 HA PRO 53 -1.112 -9.697 2.901 447 HB2 PRO 53 2HB PRO 53 -3.327 -7.999 3.620 448 HB3 PRO 53 3HB PRO 53 -3.241 -9.112 2.244 449 HG2 PRO 53 2HG PRO 53 -4.951 -9.393 4.445 450 HG3 PRO 53 3HG PRO 53 -4.560 -10.659 3.265 451 HD2 PRO 53 2HD PRO 53 -3.438 -10.223 6.007 452 HD3 PRO 53 3HD PRO 53 -3.776 -11.740 5.146 453 H ILE 54 H ILE 54 -0.451 -7.453 3.052 454 HA ILE 54 HA ILE 54 -0.026 -6.395 5.774 455 HB ILE 54 HB ILE 54 2.061 -7.453 5.239 456 HG12 ILE 54 2HG1 ILE 54 2.289 -4.453 4.758 457 HG13 ILE 54 3HG1 ILE 54 2.255 -5.253 6.323 458 HG21 ILE 54 1HG2 ILE 54 2.105 -5.993 2.581 459 HG22 ILE 54 2HG2 ILE 54 1.797 -7.714 2.804 460 HG23 ILE 54 3HG2 ILE 54 3.380 -7.041 3.205 461 HD11 ILE 54 3HD1 ILE 54 4.423 -5.424 4.249 462 HD12 ILE 54 1HD1 ILE 54 4.382 -6.357 5.749 463 HD13 ILE 54 2HD1 ILE 54 4.474 -4.599 5.805 464 H VAL 55 H VAL 55 -0.390 -4.278 5.965 465 HA VAL 55 HA VAL 55 -1.039 -2.681 3.568 466 HB VAL 55 HB VAL 55 -2.223 -2.168 6.331 467 HG11 VAL 55 1HG1 VAL 55 -2.379 -0.336 4.683 468 HG12 VAL 55 2HG1 VAL 55 -3.974 -0.987 5.056 469 HG13 VAL 55 3HG1 VAL 55 -3.183 -1.416 3.538 470 HG21 VAL 55 3HG2 VAL 55 -4.247 -3.435 5.675 471 HG22 VAL 55 1HG2 VAL 55 -2.833 -4.485 5.771 472 HG23 VAL 55 2HG2 VAL 55 -3.446 -3.969 4.200 473 H ILE 56 H ILE 56 0.617 -1.290 3.220 474 HA ILE 56 HA ILE 56 2.205 -0.256 5.492 475 HB ILE 56 HB ILE 56 2.837 -0.463 2.513 476 HG12 ILE 56 2HG1 ILE 56 3.022 -2.564 3.853 477 HG13 ILE 56 3HG1 ILE 56 4.579 -2.036 3.228 478 HG21 ILE 56 1HG2 ILE 56 5.103 0.432 3.025 479 HG22 ILE 56 2HG2 ILE 56 4.575 0.812 4.665 480 HG23 ILE 56 3HG2 ILE 56 3.840 1.637 3.290 481 HD11 ILE 56 3HD1 ILE 56 5.134 -1.109 5.459 482 HD12 ILE 56 1HD1 ILE 56 4.808 -2.840 5.490 483 HD13 ILE 56 2HD1 ILE 56 3.587 -1.710 6.065 484 H PHE 57 H PHE 57 1.727 1.690 6.199 485 HA PHE 57 HA PHE 57 0.473 3.718 4.465 486 HB2 PHE 57 2HB PHE 57 0.882 3.540 7.482 487 HB3 PHE 57 3HB PHE 57 0.253 4.979 6.683 488 HD1 PHE 57 HD2 PHE 57 -0.428 1.339 7.231 489 HD2 PHE 57 HD1 PHE 57 -2.044 5.147 6.127 490 HE1 PHE 57 HE2 PHE 57 -2.702 0.398 7.272 491 HE2 PHE 57 HE1 PHE 57 -4.302 4.195 6.178 492 HZ PHE 57 HZ PHE 57 -4.625 1.828 6.729 493 H ILE 58 H ILE 58 1.789 5.071 3.433 494 HA ILE 58 HA ILE 58 4.083 6.294 4.787 495 HB ILE 58 HB ILE 58 5.446 6.001 2.566 496 HG12 ILE 58 2HG1 ILE 58 3.525 3.650 2.295 497 HG13 ILE 58 3HG1 ILE 58 3.719 4.988 1.165 498 HG21 ILE 58 1HG2 ILE 58 6.154 5.056 4.719 499 HG22 ILE 58 2HG2 ILE 58 6.538 3.965 3.389 500 HG23 ILE 58 3HG2 ILE 58 5.156 3.627 4.434 501 HD11 ILE 58 3HD1 ILE 58 5.806 2.901 1.794 502 HD12 ILE 58 1HD1 ILE 58 5.985 4.237 0.651 503 HD13 ILE 58 2HD1 ILE 58 4.790 2.976 0.361 504 H ARG 59 H ARG 59 4.732 8.283 3.884 505 HA ARG 59 HA ARG 59 2.492 9.645 2.521 506 HB2 ARG 59 2HB ARG 59 2.971 10.147 5.005 507 HB3 ARG 59 3HB ARG 59 4.458 10.914 4.481 508 HG2 ARG 59 2HG ARG 59 2.884 12.332 2.923 509 HG3 ARG 59 3HG ARG 59 1.605 11.775 4.005 510 HD2 ARG 59 2HD ARG 59 2.352 13.928 4.778 511 HD3 ARG 59 3HD ARG 59 2.924 12.718 5.928 512 HE ARG 59 HE ARG 59 5.096 13.159 5.322 513 HH11 ARG 59 1HH1 ARG 59 2.964 14.835 3.065 514 HH12 ARG 59 2HH1 ARG 59 4.252 15.759 2.362 515 HH21 ARG 59 1HH2 ARG 59 6.759 14.355 4.368 516 HH22 ARG 59 2HH2 ARG 59 6.401 15.487 3.099 517 H GLY 60 H GLY 60 3.050 10.205 0.491 518 HA2 GLY 60 2HA GLY 60 3.960 11.433 -1.190 519 HA3 GLY 60 3HA GLY 60 4.540 12.478 0.076 520 H ALA 61 H ALA 61 6.723 12.154 0.876 521 HA ALA 61 HA ALA 61 8.673 11.682 -1.134 522 HB1 ALA 61 3HB ALA 61 9.050 13.200 0.768 523 HB2 ALA 61 1HB ALA 61 10.319 11.975 0.705 524 HB3 ALA 61 2HB ALA 61 9.009 11.837 1.887 525 H TYR 62 H TYR 62 7.383 9.754 1.448 526 HA TYR 62 HA TYR 62 9.211 7.565 1.319 527 HB2 TYR 62 2HB TYR 62 6.411 7.583 2.526 528 HB3 TYR 62 3HB TYR 62 7.728 6.490 2.924 529 HD1 TYR 62 HD2 TYR 62 9.830 8.917 3.048 530 HD2 TYR 62 HD1 TYR 62 6.038 8.157 4.865 531 HE1 TYR 62 HE2 TYR 62 10.444 10.341 4.946 532 HE2 TYR 62 HE1 TYR 62 6.659 9.588 6.761 533 HH TYR 62 HH TYR 62 8.776 10.363 7.858 534 H GLU 63 H GLU 63 6.242 8.379 -0.383 535 HA GLU 63 HA GLU 63 5.388 5.785 -1.092 536 HB2 GLU 63 2HB GLU 63 3.780 6.772 -2.432 537 HB3 GLU 63 3HB GLU 63 4.171 8.113 -1.371 538 HG2 GLU 63 2HG GLU 63 5.686 9.012 -3.195 539 HG3 GLU 63 3HG GLU 63 5.102 7.719 -4.235 540 H GLU 64 H GLU 64 7.860 7.870 -2.471 541 HA GLU 64 HA GLU 64 8.330 6.673 -4.948 542 HB2 GLU 64 2HB GLU 64 9.445 8.733 -4.350 543 HB3 GLU 64 3HB GLU 64 10.262 7.975 -2.985 544 HG2 GLU 64 2HG GLU 64 11.595 6.607 -4.515 545 HG3 GLU 64 3HG GLU 64 10.738 7.275 -5.899 546 H VAL 65 H VAL 65 9.194 5.583 -1.742 547 HA VAL 65 HA VAL 65 11.158 3.659 -2.367 548 HB VAL 65 HB VAL 65 9.302 3.680 0.056 549 HG11 VAL 65 1HG1 VAL 65 11.098 2.428 1.205 550 HG12 VAL 65 2HG1 VAL 65 12.042 2.400 -0.284 551 HG13 VAL 65 3HG1 VAL 65 10.506 1.541 -0.203 552 HG21 VAL 65 3HG2 VAL 65 10.444 5.853 -0.166 553 HG22 VAL 65 1HG2 VAL 65 12.009 5.038 -0.270 554 HG23 VAL 65 2HG2 VAL 65 11.071 4.962 1.223 555 H VAL 66 H VAL 66 7.620 3.517 -2.460 556 HA VAL 66 HA VAL 66 7.132 0.779 -2.344 557 HB VAL 66 HB VAL 66 5.694 2.756 -4.176 558 HG11 VAL 66 1HG1 VAL 66 3.770 1.205 -4.109 559 HG12 VAL 66 2HG1 VAL 66 4.723 0.045 -3.179 560 HG13 VAL 66 3HG1 VAL 66 5.183 0.438 -4.836 561 HG21 VAL 66 3HG2 VAL 66 4.035 2.973 -2.384 562 HG22 VAL 66 1HG2 VAL 66 5.636 3.471 -1.841 563 HG23 VAL 66 2HG2 VAL 66 4.993 1.900 -1.358 564 H ARG 67 H ARG 67 8.477 2.662 -4.994 565 HA ARG 67 HA ARG 67 8.210 0.954 -7.177 566 HB2 ARG 67 2HB ARG 67 9.082 3.289 -7.259 567 HB3 ARG 67 3HB ARG 67 10.555 2.765 -6.454 568 HG2 ARG 67 2HG ARG 67 10.893 1.191 -8.487 569 HG3 ARG 67 3HG ARG 67 9.640 2.156 -9.272 570 HD2 ARG 67 2HD ARG 67 11.918 2.944 -9.854 571 HD3 ARG 67 3HD ARG 67 10.995 4.185 -9.007 572 HE ARG 67 HE ARG 67 12.613 4.196 -7.406 573 HH11 ARG 67 1HH1 ARG 67 12.784 1.020 -8.930 574 HH12 ARG 67 2HH1 ARG 67 14.145 0.511 -7.984 575 HH21 ARG 67 1HH2 ARG 67 14.387 3.474 -6.150 576 HH22 ARG 67 2HH2 ARG 67 15.047 1.890 -6.424 577 H ASP 68 H ASP 68 10.932 1.069 -4.806 578 HA ASP 68 HA ASP 68 12.111 -1.375 -5.820 579 HB2 ASP 68 2HB ASP 68 13.802 -1.118 -4.043 580 HB3 ASP 68 3HB ASP 68 13.610 0.346 -4.988 581 H ILE 69 H ILE 69 9.942 -0.565 -3.149 582 HA ILE 69 HA ILE 69 9.947 -3.009 -1.720 583 HB ILE 69 HB ILE 69 7.674 -1.009 -2.151 584 HG12 ILE 69 2HG1 ILE 69 9.480 -1.395 0.285 585 HG13 ILE 69 3HG1 ILE 69 9.700 -0.145 -0.932 586 HG21 ILE 69 1HG2 ILE 69 7.733 -3.294 -0.145 587 HG22 ILE 69 2HG2 ILE 69 6.664 -3.162 -1.542 588 HG23 ILE 69 3HG2 ILE 69 6.512 -2.020 -0.207 589 HD11 ILE 69 3HD1 ILE 69 7.322 -0.416 0.907 590 HD12 ILE 69 1HD1 ILE 69 7.552 0.839 -0.312 591 HD13 ILE 69 2HD1 ILE 69 8.647 0.735 1.067 592 H VAL 70 H VAL 70 8.337 -2.009 -4.658 593 HA VAL 70 HA VAL 70 6.581 -4.164 -5.115 594 HB VAL 70 HB VAL 70 7.780 -1.947 -6.810 595 HG11 VAL 70 1HG1 VAL 70 6.289 -4.265 -8.078 596 HG12 VAL 70 2HG1 VAL 70 7.971 -3.823 -8.371 597 HG13 VAL 70 3HG1 VAL 70 6.671 -2.738 -8.876 598 HG21 VAL 70 3HG2 VAL 70 4.909 -2.834 -6.347 599 HG22 VAL 70 1HG2 VAL 70 5.409 -1.377 -7.214 600 HG23 VAL 70 2HG2 VAL 70 5.737 -1.537 -5.486 601 H GLU 71 H GLU 71 9.913 -3.485 -6.180 602 HA GLU 71 HA GLU 71 10.417 -5.714 -7.750 603 HB2 GLU 71 2HB GLU 71 12.368 -4.193 -5.970 604 HB3 GLU 71 3HB GLU 71 12.838 -5.338 -7.224 605 HG2 GLU 71 2HG GLU 71 11.778 -3.889 -8.935 606 HG3 GLU 71 3HG GLU 71 11.359 -2.732 -7.668 607 H TYR 72 H TYR 72 10.926 -5.318 -4.244 608 HA TYR 72 HA TYR 72 11.973 -7.877 -3.702 609 HB2 TYR 72 2HB TYR 72 12.190 -6.063 -2.067 610 HB3 TYR 72 3HB TYR 72 10.440 -5.978 -1.871 611 HD1 TYR 72 HD1 TYR 72 13.443 -8.087 -1.197 612 HD2 TYR 72 HD2 TYR 72 9.276 -7.534 -0.394 613 HE1 TYR 72 HE1 TYR 72 13.546 -9.791 0.563 614 HE2 TYR 72 HE2 TYR 72 9.387 -9.243 1.361 615 HH TYR 72 HH TYR 72 10.788 -11.165 1.960 616 H ALA 73 H ALA 73 8.626 -6.654 -3.527 617 HA ALA 73 HA ALA 73 7.422 -9.010 -2.546 618 HB1 ALA 73 3HB ALA 73 6.358 -6.807 -2.394 619 HB2 ALA 73 1HB ALA 73 5.294 -7.965 -3.198 620 HB3 ALA 73 2HB ALA 73 6.169 -6.761 -4.149 621 H GLN 74 H GLN 74 8.249 -7.974 -5.814 622 HA GLN 74 HA GLN 74 6.912 -10.018 -7.285 623 HB2 GLN 74 2HB GLN 74 9.421 -8.422 -7.958 624 HB3 GLN 74 3HB GLN 74 8.565 -9.459 -9.098 625 HG2 GLN 74 2HG GLN 74 6.622 -8.033 -9.055 626 HG3 GLN 74 3HG GLN 74 7.282 -7.080 -7.733 627 HE21 GLN 74 1HE2 GLN 74 6.402 -6.102 -10.282 628 HE22 GLN 74 2HE2 GLN 74 7.763 -5.330 -11.011 629 H LYS 75 H LYS 75 10.078 -9.848 -5.646 630 HA LYS 75 HA LYS 75 11.139 -12.330 -6.595 631 HB2 LYS 75 2HB LYS 75 11.801 -11.121 -3.869 632 HB3 LYS 75 3HB LYS 75 12.805 -12.188 -4.839 633 HG2 LYS 75 2HG LYS 75 12.152 -9.292 -5.366 634 HG3 LYS 75 3HG LYS 75 13.717 -9.960 -4.913 635 HD2 LYS 75 2HD LYS 75 13.884 -11.089 -7.108 636 HD3 LYS 75 3HD LYS 75 12.274 -10.504 -7.546 637 HE2 LYS 75 2HE LYS 75 13.120 -8.159 -7.355 638 HE3 LYS 75 3HE LYS 75 14.735 -8.792 -7.035 639 HZ1 LYS 75 3HZ LYS 75 14.715 -9.828 -9.214 640 HZ2 LYS 75 1HZ LYS 75 14.452 -8.164 -9.346 641 HZ3 LYS 75 2HZ LYS 75 13.161 -9.243 -9.510 642 H GLU 76 H GLU 76 9.100 -11.400 -3.879 643 HA GLU 76 HA GLU 76 8.854 -13.999 -2.687 644 HB2 GLU 76 2HB GLU 76 6.981 -11.604 -2.384 645 HB3 GLU 76 3HB GLU 76 7.125 -12.969 -1.284 646 HG2 GLU 76 2HG GLU 76 9.262 -10.885 -1.808 647 HG3 GLU 76 3HG GLU 76 8.194 -10.927 -0.414 648 H GLY 77 H GLY 77 7.367 -12.390 -5.362 649 HA2 GLY 77 2HA GLY 77 6.030 -13.211 -7.045 650 HA3 GLY 77 3HA GLY 77 5.952 -14.756 -6.210 651 H LEU 78 H LEU 78 5.100 -11.641 -4.855 652 HA LEU 78 HA LEU 78 2.395 -12.577 -4.229 653 HB2 LEU 78 2HB LEU 78 3.959 -10.148 -3.237 654 HB3 LEU 78 3HB LEU 78 2.366 -10.626 -2.666 655 HG LEU 78 HG LEU 78 4.921 -12.250 -2.300 656 HD11 LEU 78 1HD1 LEU 78 3.352 -10.661 -0.251 657 HD12 LEU 78 2HD1 LEU 78 4.925 -10.227 -0.926 658 HD13 LEU 78 3HD1 LEU 78 4.765 -11.673 0.064 659 HD21 LEU 78 3HD2 LEU 78 3.566 -13.695 -0.825 660 HD22 LEU 78 1HD2 LEU 78 2.973 -13.716 -2.484 661 HD23 LEU 78 2HD2 LEU 78 2.117 -12.782 -1.257 662 H ARG 79 H ARG 79 0.562 -11.404 -4.749 663 HA ARG 79 HA ARG 79 0.547 -9.716 -7.083 664 HB2 ARG 79 2HB ARG 79 -1.292 -11.329 -6.449 665 HB3 ARG 79 3HB ARG 79 -1.666 -10.347 -5.046 666 HG2 ARG 79 2HG ARG 79 -1.928 -9.329 -7.899 667 HG3 ARG 79 3HG ARG 79 -3.234 -10.131 -7.038 668 HD2 ARG 79 2HD ARG 79 -3.068 -8.311 -5.280 669 HD3 ARG 79 3HD ARG 79 -1.940 -7.471 -6.343 670 HE ARG 79 HE ARG 79 -4.815 -7.821 -6.710 671 HH11 ARG 79 1HH1 ARG 79 -1.817 -6.602 -8.130 672 HH12 ARG 79 2HH1 ARG 79 -2.659 -5.613 -9.277 673 HH21 ARG 79 1HH2 ARG 79 -5.853 -6.468 -8.158 674 HH22 ARG 79 2HH2 ARG 79 -4.933 -5.535 -9.297 675 H VAL 80 H VAL 80 1.031 -7.548 -6.994 676 HA VAL 80 HA VAL 80 0.938 -6.162 -4.372 677 HB VAL 80 HB VAL 80 2.564 -5.250 -6.792 678 HG11 VAL 80 1HG1 VAL 80 2.777 -4.538 -3.840 679 HG12 VAL 80 2HG1 VAL 80 2.098 -3.513 -5.107 680 HG13 VAL 80 3HG1 VAL 80 3.816 -3.917 -5.126 681 HG21 VAL 80 3HG2 VAL 80 4.564 -6.264 -5.761 682 HG22 VAL 80 1HG2 VAL 80 3.364 -7.491 -6.174 683 HG23 VAL 80 2HG2 VAL 80 3.557 -6.977 -4.498 684 H LEU 81 H LEU 81 -0.556 -4.645 -4.169 685 HA LEU 81 HA LEU 81 -1.666 -3.203 -6.478 686 HB2 LEU 81 2HB LEU 81 -3.141 -5.146 -5.939 687 HB3 LEU 81 3HB LEU 81 -3.269 -4.568 -4.302 688 HG LEU 81 HG LEU 81 -4.488 -2.566 -5.046 689 HD11 LEU 81 1HD1 LEU 81 -4.166 -3.757 -7.800 690 HD12 LEU 81 2HD1 LEU 81 -3.437 -2.266 -7.196 691 HD13 LEU 81 3HD1 LEU 81 -5.182 -2.375 -7.395 692 HD21 LEU 81 3HD2 LEU 81 -6.573 -3.668 -5.789 693 HD22 LEU 81 1HD2 LEU 81 -5.806 -4.556 -4.470 694 HD23 LEU 81 2HD2 LEU 81 -5.670 -5.150 -6.126 695 H VAL 82 H VAL 82 -1.092 -1.116 -5.971 696 HA VAL 82 HA VAL 82 -1.036 -0.307 -3.129 697 HB VAL 82 HB VAL 82 0.352 1.575 -3.787 698 HG11 VAL 82 1HG1 VAL 82 1.276 -1.005 -5.119 699 HG12 VAL 82 2HG1 VAL 82 1.497 -0.551 -3.429 700 HG13 VAL 82 3HG1 VAL 82 2.323 0.352 -4.693 701 HG21 VAL 82 3HG2 VAL 82 -0.649 2.167 -5.955 702 HG22 VAL 82 1HG2 VAL 82 0.013 0.702 -6.684 703 HG23 VAL 82 2HG2 VAL 82 1.097 1.975 -6.111 704 H ILE 83 H ILE 83 -2.541 0.994 -2.301 705 HA ILE 83 HA ILE 83 -4.666 2.072 -4.045 706 HB ILE 83 HB ILE 83 -4.682 1.727 -1.001 707 HG12 ILE 83 2HG1 ILE 83 -5.993 -0.098 -3.079 708 HG13 ILE 83 3HG1 ILE 83 -4.455 -0.457 -2.299 709 HG21 ILE 83 1HG2 ILE 83 -6.970 2.282 -2.943 710 HG22 ILE 83 2HG2 ILE 83 -6.290 3.431 -1.788 711 HG23 ILE 83 3HG2 ILE 83 -7.145 2.001 -1.210 712 HD11 ILE 83 3HD1 ILE 83 -7.069 -0.103 -0.834 713 HD12 ILE 83 1HD1 ILE 83 -5.513 -0.601 -0.151 714 HD13 ILE 83 2HD1 ILE 83 -6.346 -1.650 -1.301 715 H LYS 84 H LYS 84 -4.488 4.213 -4.491 716 HA LYS 84 HA LYS 84 -2.808 5.970 -2.766 717 HB2 LYS 84 2HB LYS 84 -1.630 5.205 -4.815 718 HB3 LYS 84 3HB LYS 84 -2.960 5.768 -5.819 719 HG2 LYS 84 2HG LYS 84 -2.446 8.127 -4.894 720 HG3 LYS 84 3HG LYS 84 -0.954 7.427 -4.267 721 HD2 LYS 84 2HD LYS 84 -0.521 8.497 -6.421 722 HD3 LYS 84 3HD LYS 84 -0.322 6.749 -6.584 723 HE2 LYS 84 2HE LYS 84 -1.572 7.794 -8.490 724 HE3 LYS 84 3HE LYS 84 -2.506 6.554 -7.651 725 HZ1 LYS 84 3HZ LYS 84 -3.845 8.519 -8.118 726 HZ2 LYS 84 1HZ LYS 84 -2.768 9.490 -7.253 727 HZ3 LYS 84 2HZ LYS 84 -3.676 8.315 -6.450 728 H VAL 85 H VAL 85 -3.644 7.903 -2.301 729 HA VAL 85 HA VAL 85 -5.936 8.992 -3.823 730 HB VAL 85 HB VAL 85 -6.678 8.578 -1.577 731 HG11 VAL 85 1HG1 VAL 85 -5.597 9.376 0.452 732 HG12 VAL 85 2HG1 VAL 85 -4.268 10.038 -0.501 733 HG13 VAL 85 3HG1 VAL 85 -4.535 8.294 -0.454 734 HG21 VAL 85 3HG2 VAL 85 -7.261 10.819 -0.721 735 HG22 VAL 85 1HG2 VAL 85 -7.437 10.735 -2.476 736 HG23 VAL 85 2HG2 VAL 85 -6.036 11.542 -1.768 737 H ALA 86 H ALA 86 -5.160 10.421 -5.222 738 HA ALA 86 HA ALA 86 -2.884 12.166 -4.655 739 HB1 ALA 86 3HB ALA 86 -3.117 11.214 -6.918 740 HB2 ALA 86 1HB ALA 86 -3.224 12.976 -6.967 741 HB3 ALA 86 2HB ALA 86 -4.688 11.994 -7.100 742 H GLN 87 H GLN 87 -3.055 14.362 -4.448 743 HA GLN 87 HA GLN 87 -5.719 15.611 -4.053 744 HB2 GLN 87 2HB GLN 87 -3.006 16.292 -2.813 745 HB3 GLN 87 3HB GLN 87 -4.500 17.177 -2.515 746 HG2 GLN 87 2HG GLN 87 -5.471 15.334 -1.330 747 HG3 GLN 87 3HG GLN 87 -4.195 14.235 -1.855 748 HE21 GLN 87 1HE2 GLN 87 -4.967 16.908 0.285 749 HE22 GLN 87 2HE2 GLN 87 -3.613 16.697 1.336 750 H ASP 88 H ASP 88 -4.493 15.201 -6.549 751 HA ASP 88 HA ASP 88 -4.067 16.108 -8.531 752 HB2 ASP 88 2HB ASP 88 -5.842 17.762 -8.007 753 HB3 ASP 88 3HB ASP 88 -4.645 18.808 -7.249 754 H GLN 89 H GLN 89 -1.949 15.278 -8.224 755 HA GLN 89 HA GLN 89 0.094 17.394 -8.474 756 HB2 GLN 89 2HB GLN 89 0.617 14.720 -7.083 757 HB3 GLN 89 3HB GLN 89 1.806 15.974 -7.397 758 HG2 GLN 89 2HG GLN 89 1.396 16.394 -5.181 759 HG3 GLN 89 3HG GLN 89 0.167 17.444 -5.881 760 HE21 GLN 89 1HE2 GLN 89 0.080 16.455 -3.248 761 HE22 GLN 89 2HE2 GLN 89 -1.285 15.405 -3.105 762 H GLU 90 H GLU 90 0.685 17.333 -10.519 763 HA GLU 90 HA GLU 90 0.321 15.164 -12.323 764 HB2 GLU 90 2HB GLU 90 0.307 17.617 -12.915 765 HB3 GLU 90 3HB GLU 90 2.053 17.649 -12.693 766 HG2 GLU 90 2HG GLU 90 2.328 16.041 -14.540 767 HG3 GLU 90 3HG GLU 90 0.578 15.950 -14.740 768 H LEU 91 H LEU 91 3.048 16.300 -10.402 769 HA LEU 91 HA LEU 91 5.118 14.712 -11.530 770 HB2 LEU 91 2HB LEU 91 5.460 16.700 -10.045 771 HB3 LEU 91 3HB LEU 91 4.858 15.765 -8.688 772 HG LEU 91 HG LEU 91 6.804 14.192 -8.944 773 HD11 LEU 91 1HD1 LEU 91 7.278 14.490 -11.316 774 HD12 LEU 91 2HD1 LEU 91 8.715 14.808 -10.350 775 HD13 LEU 91 3HD1 LEU 91 7.798 16.154 -11.029 776 HD21 LEU 91 3HD2 LEU 91 8.518 15.676 -8.000 777 HD22 LEU 91 1HD2 LEU 91 6.934 16.023 -7.308 778 HD23 LEU 91 2HD2 LEU 91 7.613 17.093 -8.537 779 H LEU 92 H LEU 92 2.659 14.069 -9.100 780 HA LEU 92 HA LEU 92 3.549 11.580 -8.110 781 HB2 LEU 92 2HB LEU 92 1.933 12.631 -6.807 782 HB3 LEU 92 3HB LEU 92 0.935 13.069 -8.167 783 HG LEU 92 HG LEU 92 1.069 10.146 -7.345 784 HD11 LEU 92 1HD1 LEU 92 -0.806 10.472 -5.775 785 HD12 LEU 92 2HD1 LEU 92 -0.673 12.223 -5.968 786 HD13 LEU 92 3HD1 LEU 92 0.649 11.312 -5.234 787 HD21 LEU 92 3HD2 LEU 92 -0.168 10.683 -9.410 788 HD22 LEU 92 1HD2 LEU 92 -1.163 11.852 -8.540 789 HD23 LEU 92 2HD2 LEU 92 -1.284 10.132 -8.164 790 H GLU 93 H GLU 93 1.847 12.456 -11.061 791 HA GLU 93 HA GLU 93 0.869 9.911 -11.810 792 HB2 GLU 93 2HB GLU 93 1.642 12.265 -13.571 793 HB3 GLU 93 3HB GLU 93 0.750 10.848 -14.124 794 HG2 GLU 93 2HG GLU 93 -1.059 11.427 -12.448 795 HG3 GLU 93 3HG GLU 93 -0.177 12.923 -12.114 796 H ARG 94 H ARG 94 4.088 11.273 -11.995 797 HA ARG 94 HA ARG 94 5.261 9.443 -13.819 798 HB2 ARG 94 2HB ARG 94 6.410 11.504 -13.104 799 HB3 ARG 94 3HB ARG 94 6.518 10.906 -11.451 800 HG2 ARG 94 2HG ARG 94 7.995 9.053 -12.247 801 HG3 ARG 94 3HG ARG 94 7.913 9.717 -13.882 802 HD2 ARG 94 2HD ARG 94 9.065 11.100 -11.438 803 HD3 ARG 94 3HD ARG 94 9.990 10.396 -12.769 804 HE ARG 94 HE ARG 94 8.270 12.256 -13.899 805 HH11 ARG 94 1HH1 ARG 94 10.950 12.346 -11.615 806 HH12 ARG 94 2HH1 ARG 94 11.413 13.964 -12.040 807 HH21 ARG 94 1HH2 ARG 94 8.870 14.372 -14.436 808 HH22 ARG 94 2HH2 ARG 94 10.225 15.117 -13.649 809 H PHE 95 H PHE 95 4.902 9.389 -10.259 810 HA PHE 95 HA PHE 95 6.089 6.875 -9.762 811 HB2 PHE 95 2HB PHE 95 5.715 8.363 -7.886 812 HB3 PHE 95 3HB PHE 95 3.986 8.441 -8.206 813 HD1 PHE 95 HD2 PHE 95 6.678 5.981 -7.289 814 HD2 PHE 95 HD1 PHE 95 2.525 6.994 -7.014 815 HE1 PHE 95 HE2 PHE 95 6.297 4.072 -5.792 816 HE2 PHE 95 HE1 PHE 95 2.158 5.074 -5.523 817 HZ PHE 95 HZ PHE 95 4.041 3.617 -4.914 818 H TYR 96 H TYR 96 2.683 7.795 -10.279 819 HA TYR 96 HA TYR 96 1.388 5.352 -10.117 820 HB2 TYR 96 2HB TYR 96 0.072 7.364 -10.318 821 HB3 TYR 96 3HB TYR 96 0.872 7.833 -11.814 822 HD1 TYR 96 HD1 TYR 96 -1.334 5.153 -10.418 823 HD2 TYR 96 HD2 TYR 96 -0.213 7.361 -13.891 824 HE1 TYR 96 HE1 TYR 96 -3.077 4.016 -11.688 825 HE2 TYR 96 HE2 TYR 96 -1.990 6.229 -15.170 826 HH TYR 96 HH TYR 96 -3.269 4.191 -15.102 827 H GLU 97 H GLU 97 2.838 6.884 -12.955 828 HA GLU 97 HA GLU 97 2.180 4.921 -14.888 829 HB2 GLU 97 2HB GLU 97 2.570 7.276 -15.443 830 HB3 GLU 97 3HB GLU 97 4.227 7.178 -14.857 831 HG2 GLU 97 2HG GLU 97 4.666 5.495 -16.706 832 HG3 GLU 97 3HG GLU 97 3.064 5.876 -17.334 833 H GLN 98 H GLN 98 4.882 5.311 -12.688 834 HA GLN 98 HA GLN 98 6.837 3.735 -13.988 835 HB2 GLN 98 2HB GLN 98 7.369 5.320 -12.153 836 HB3 GLN 98 3HB GLN 98 6.479 4.316 -11.016 837 HG2 GLN 98 2HG GLN 98 8.875 3.954 -10.740 838 HG3 GLN 98 3HG GLN 98 8.119 2.484 -11.352 839 HE21 GLN 98 1HE2 GLN 98 8.557 1.848 -13.526 840 HE22 GLN 98 2HE2 GLN 98 9.915 2.478 -14.389 841 H LEU 99 H LEU 99 4.375 2.918 -11.541 842 HA LEU 99 HA LEU 99 5.060 0.119 -11.437 843 HB2 LEU 99 2HB LEU 99 2.669 1.654 -10.362 844 HB3 LEU 99 3HB LEU 99 2.833 -0.084 -10.188 845 HG LEU 99 HG LEU 99 4.996 0.317 -8.902 846 HD11 LEU 99 1HD1 LEU 99 5.407 2.536 -7.942 847 HD12 LEU 99 2HD1 LEU 99 4.093 3.203 -8.920 848 HD13 LEU 99 3HD1 LEU 99 5.534 2.551 -9.702 849 HD21 LEU 99 3HD2 LEU 99 3.884 0.947 -6.796 850 HD22 LEU 99 1HD2 LEU 99 2.927 -0.207 -7.725 851 HD23 LEU 99 2HD2 LEU 99 2.473 1.496 -7.705 852 H LYS 100 H LYS 100 2.919 2.098 -13.346 853 HA LYS 100 HA LYS 100 1.241 -0.017 -14.314 854 HB2 LYS 100 2HB LYS 100 1.662 2.847 -15.231 855 HB3 LYS 100 3HB LYS 100 0.466 1.777 -15.946 856 HG2 LYS 100 2HG LYS 100 0.439 2.335 -12.968 857 HG3 LYS 100 3HG LYS 100 -0.264 3.477 -14.111 858 HD2 LYS 100 2HD LYS 100 -2.074 2.142 -13.352 859 HD3 LYS 100 3HD LYS 100 -1.719 1.578 -14.979 860 HE2 LYS 100 2HE LYS 100 -0.437 -0.330 -13.931 861 HE3 LYS 100 3HE LYS 100 -1.021 0.217 -12.362 862 HZ1 LYS 100 3HZ LYS 100 -3.300 -0.104 -13.173 863 HZ2 LYS 100 1HZ LYS 100 -2.416 -1.542 -13.210 864 HZ3 LYS 100 2HZ LYS 100 -2.707 -0.687 -14.639 865 H LYS 101 H LYS 101 4.222 1.477 -15.497 866 HA LYS 101 HA LYS 101 4.191 -0.012 -17.999 867 HB2 LYS 101 2HB LYS 101 6.398 0.950 -18.422 868 HB3 LYS 101 3HB LYS 101 5.286 2.203 -17.889 869 HG2 LYS 101 2HG LYS 101 6.297 2.109 -15.616 870 HG3 LYS 101 3HG LYS 101 7.438 0.897 -16.194 871 HD2 LYS 101 2HD LYS 101 8.585 3.003 -16.174 872 HD3 LYS 101 3HD LYS 101 8.287 2.603 -17.863 873 HE2 LYS 101 2HE LYS 101 6.571 4.513 -16.233 874 HE3 LYS 101 3HE LYS 101 7.908 5.019 -17.261 875 HZ1 LYS 101 3HZ LYS 101 5.363 3.752 -18.120 876 HZ2 LYS 101 1HZ LYS 101 6.688 3.983 -19.151 877 HZ3 LYS 101 2HZ LYS 101 5.913 5.312 -18.464 878 H ASP 102 H ASP 102 5.220 -0.488 -14.762 879 HA ASP 102 HA ASP 102 7.085 -2.624 -15.161 880 HB2 ASP 102 2HB ASP 102 7.214 -1.348 -13.116 881 HB3 ASP 102 3HB ASP 102 5.508 -1.599 -12.760 882 H GLY 103 H GLY 103 3.762 -2.614 -13.837 883 HA2 GLY 103 2HA GLY 103 2.410 -4.509 -15.136 884 HA3 GLY 103 3HA GLY 103 3.492 -5.506 -14.157 885 H VAL 104 H VAL 104 3.518 -3.558 -11.937 886 HA VAL 104 HA VAL 104 1.349 -4.586 -10.406 887 HB VAL 104 HB VAL 104 3.459 -2.460 -9.848 888 HG11 VAL 104 1HG1 VAL 104 1.522 -1.817 -8.489 889 HG12 VAL 104 2HG1 VAL 104 2.783 -2.490 -7.454 890 HG13 VAL 104 3HG1 VAL 104 1.372 -3.464 -7.874 891 HG21 VAL 104 3HG2 VAL 104 4.253 -4.785 -10.002 892 HG22 VAL 104 1HG2 VAL 104 3.073 -5.289 -8.789 893 HG23 VAL 104 2HG2 VAL 104 4.386 -4.198 -8.343 894 H ASP 105 H ASP 105 -0.522 -3.616 -9.642 895 HA ASP 105 HA ASP 105 -1.586 -1.506 -11.361 896 HB2 ASP 105 2HB ASP 105 -2.791 -3.761 -10.875 897 HB3 ASP 105 3HB ASP 105 -3.150 -3.090 -9.309 898 H VAL 106 H VAL 106 -2.504 0.399 -10.605 899 HA VAL 106 HA VAL 106 -2.109 1.142 -7.758 900 HB VAL 106 HB VAL 106 -2.033 3.106 -10.098 901 HG11 VAL 106 1HG1 VAL 106 -2.610 4.103 -7.943 902 HG12 VAL 106 2HG1 VAL 106 -1.022 4.662 -8.468 903 HG13 VAL 106 3HG1 VAL 106 -1.150 3.433 -7.210 904 HG21 VAL 106 3HG2 VAL 106 0.413 3.200 -9.953 905 HG22 VAL 106 1HG2 VAL 106 -0.138 1.589 -10.410 906 HG23 VAL 106 2HG2 VAL 106 0.412 1.895 -8.761 907 H ARG 107 H ARG 107 -4.123 1.338 -6.850 908 HA ARG 107 HA ARG 107 -6.480 1.930 -8.460 909 HB2 ARG 107 2HB ARG 107 -6.223 1.555 -5.443 910 HB3 ARG 107 3HB ARG 107 -7.727 1.609 -6.355 911 HG2 ARG 107 2HG ARG 107 -5.596 -0.522 -6.610 912 HG3 ARG 107 3HG ARG 107 -7.093 -0.670 -5.703 913 HD2 ARG 107 2HD ARG 107 -8.311 -0.259 -7.936 914 HD3 ARG 107 3HD ARG 107 -6.736 -0.509 -8.708 915 HE ARG 107 HE ARG 107 -7.651 -2.569 -6.852 916 HH11 ARG 107 1HH1 ARG 107 -7.321 -1.669 -10.242 917 HH12 ARG 107 2HH1 ARG 107 -7.508 -3.299 -10.810 918 HH21 ARG 107 1HH2 ARG 107 -7.893 -4.664 -7.601 919 HH22 ARG 107 2HH2 ARG 107 -7.832 -4.994 -9.301 920 H VAL 108 H VAL 108 -6.652 4.037 -9.042 921 HA VAL 108 HA VAL 108 -5.831 6.187 -7.251 922 HB VAL 108 HB VAL 108 -6.379 7.742 -9.087 923 HG11 VAL 108 1HG1 VAL 108 -4.669 6.998 -10.715 924 HG12 VAL 108 2HG1 VAL 108 -4.720 5.370 -10.029 925 HG13 VAL 108 3HG1 VAL 108 -4.154 6.725 -9.049 926 HG21 VAL 108 3HG2 VAL 108 -7.093 6.934 -11.330 927 HG22 VAL 108 1HG2 VAL 108 -8.323 6.623 -10.101 928 HG23 VAL 108 2HG2 VAL 108 -7.300 5.307 -10.673 929 H THR 109 H THR 109 -7.119 6.896 -5.755 930 HA THR 109 HA THR 109 -10.066 6.717 -5.967 931 HB THR 109 HB THR 109 -10.070 6.982 -3.497 932 HG1 THR 109 HG1 THR 109 -7.287 6.632 -3.344 933 HG21 THR 109 3HG2 THR 109 -9.051 4.832 -2.860 934 HG22 THR 109 1HG2 THR 109 -8.146 4.792 -4.374 935 HG23 THR 109 2HG2 THR 109 -9.908 4.679 -4.393 936 H ASP 110 H ASP 110 -7.460 8.758 -4.717 937 HA ASP 110 HA ASP 110 -6.909 10.909 -4.846 938 HB2 ASP 110 2HB ASP 110 -8.714 11.033 -7.282 939 HB3 ASP 110 3HB ASP 110 -7.391 12.130 -6.902 940 H ASN 111 H ASN 111 -9.491 10.056 -3.545 941 HA ASN 111 HA ASN 111 -10.395 12.730 -2.714 942 HB2 ASN 111 2HB ASN 111 -12.199 10.347 -3.388 943 HB3 ASN 111 3HB ASN 111 -12.745 11.756 -2.478 944 HD21 ASN 111 1HD2 ASN 111 -13.050 13.722 -3.575 945 HD22 ASN 111 2HD2 ASN 111 -13.111 13.816 -5.299 946 H GLU 112 H GLU 112 -10.635 12.835 -0.519 947 HA GLU 112 HA GLU 112 -9.073 11.166 1.104 948 HB2 GLU 112 2HB GLU 112 -11.319 12.950 2.126 949 HB3 GLU 112 3HB GLU 112 -9.839 12.504 2.969 950 HG2 GLU 112 2HG GLU 112 -8.499 13.899 1.522 951 HG3 GLU 112 3HG GLU 112 -9.875 14.203 0.454 952 H ASP 113 H ASP 113 -12.551 11.371 0.725 953 HA ASP 113 HA ASP 113 -13.301 9.465 2.713 954 HB2 ASP 113 2HB ASP 113 -14.746 11.370 2.037 955 HB3 ASP 113 3HB ASP 113 -14.896 10.700 0.418 956 H GLU 114 H GLU 114 -13.087 9.393 -0.864 957 HA GLU 114 HA GLU 114 -14.054 6.740 -1.200 958 HB2 GLU 114 2HB GLU 114 -14.110 8.403 -3.030 959 HB3 GLU 114 3HB GLU 114 -12.351 8.420 -3.093 960 HG2 GLU 114 2HG GLU 114 -13.221 7.107 -4.939 961 HG3 GLU 114 3HG GLU 114 -12.375 6.036 -3.825 962 H ALA 115 H ALA 115 -10.885 8.029 -0.512 963 HA ALA 115 HA ALA 115 -9.213 5.894 -1.265 964 HB1 ALA 115 3HB ALA 115 -7.596 6.864 0.293 965 HB2 ALA 115 1HB ALA 115 -8.872 7.822 1.055 966 HB3 ALA 115 2HB ALA 115 -8.413 8.136 -0.619 967 H LYS 116 H LYS 116 -10.615 6.590 1.952 968 HA LYS 116 HA LYS 116 -9.805 4.120 3.115 969 HB2 LYS 116 2HB LYS 116 -11.345 4.790 5.011 970 HB3 LYS 116 3HB LYS 116 -10.061 5.917 4.612 971 HG2 LYS 116 2HG LYS 116 -11.736 7.283 3.334 972 HG3 LYS 116 3HG LYS 116 -13.001 6.205 3.937 973 HD2 LYS 116 2HD LYS 116 -12.469 6.830 6.256 974 HD3 LYS 116 3HD LYS 116 -11.120 7.829 5.706 975 HE2 LYS 116 2HE LYS 116 -13.027 9.243 6.244 976 HE3 LYS 116 3HE LYS 116 -12.737 9.295 4.504 977 HZ1 LYS 116 3HZ LYS 116 -14.536 7.657 4.243 978 HZ2 LYS 116 1HZ LYS 116 -15.072 9.096 4.952 979 HZ3 LYS 116 2HZ LYS 116 -14.832 7.719 5.905 980 H LYS 117 H LYS 117 -12.753 5.124 1.458 981 HA LYS 117 HA LYS 117 -14.397 2.908 2.009 982 HB2 LYS 117 2HB LYS 117 -14.199 4.661 -0.467 983 HB3 LYS 117 3HB LYS 117 -15.423 3.411 -0.292 984 HG2 LYS 117 2HG LYS 117 -16.408 4.543 1.606 985 HG3 LYS 117 3HG LYS 117 -15.094 5.718 1.639 986 HD2 LYS 117 2HD LYS 117 -16.984 6.812 0.652 987 HD3 LYS 117 3HD LYS 117 -15.838 6.503 -0.650 988 HE2 LYS 117 2HE LYS 117 -18.234 4.729 -0.083 989 HE3 LYS 117 3HE LYS 117 -18.280 6.096 -1.189 990 HZ1 LYS 117 3HZ LYS 117 -16.594 3.670 -1.470 991 HZ2 LYS 117 1HZ LYS 117 -16.526 5.008 -2.498 992 HZ3 LYS 117 2HZ LYS 117 -17.938 4.085 -2.406 993 H ARG 118 H ARG 118 -12.070 3.397 -0.675 994 HA ARG 118 HA ARG 118 -12.407 0.756 -1.714 995 HB2 ARG 118 2HB ARG 118 -10.355 2.874 -2.434 996 HB3 ARG 118 3HB ARG 118 -10.493 1.310 -3.240 997 HG2 ARG 118 2HG ARG 118 -12.993 1.990 -3.646 998 HG3 ARG 118 3HG ARG 118 -12.435 3.622 -3.279 999 HD2 ARG 118 2HD ARG 118 -10.717 3.348 -5.119 1000 HD3 ARG 118 3HD ARG 118 -11.497 1.822 -5.539 1001 HE ARG 118 HE ARG 118 -12.394 4.481 -6.140 1002 HH11 ARG 118 1HH1 ARG 118 -13.612 1.199 -5.623 1003 HH12 ARG 118 2HH1 ARG 118 -15.037 1.482 -6.574 1004 HH21 ARG 118 1HH2 ARG 118 -14.229 4.783 -7.397 1005 HH22 ARG 118 2HH2 ARG 118 -15.385 3.498 -7.573 1006 H LEU 119 H LEU 119 -10.228 2.114 0.676 1007 HA LEU 119 HA LEU 119 -8.334 0.057 0.851 1008 HB2 LEU 119 2HB LEU 119 -9.621 1.686 3.075 1009 HB3 LEU 119 3HB LEU 119 -8.324 0.540 3.374 1010 HG LEU 119 HG LEU 119 -8.137 3.080 1.721 1011 HD11 LEU 119 1HD1 LEU 119 -6.603 3.822 3.456 1012 HD12 LEU 119 2HD1 LEU 119 -6.833 2.313 4.336 1013 HD13 LEU 119 3HD1 LEU 119 -8.180 3.433 4.139 1014 HD21 LEU 119 3HD2 LEU 119 -6.005 0.986 2.231 1015 HD22 LEU 119 1HD2 LEU 119 -5.739 2.567 1.489 1016 HD23 LEU 119 2HD2 LEU 119 -6.753 1.377 0.679 1017 H LYS 120 H LYS 120 -11.487 0.341 2.543 1018 HA LYS 120 HA LYS 120 -11.440 -2.246 3.708 1019 HB2 LYS 120 2HB LYS 120 -12.883 -0.440 4.612 1020 HB3 LYS 120 3HB LYS 120 -13.846 -0.444 3.134 1021 HG2 LYS 120 2HG LYS 120 -14.570 -2.769 3.599 1022 HG3 LYS 120 3HG LYS 120 -13.594 -2.784 5.068 1023 HD2 LYS 120 2HD LYS 120 -15.023 -0.959 6.006 1024 HD3 LYS 120 3HD LYS 120 -16.010 -1.003 4.539 1025 HE2 LYS 120 2HE LYS 120 -16.614 -3.356 5.021 1026 HE3 LYS 120 3HE LYS 120 -15.630 -3.307 6.485 1027 HZ1 LYS 120 3HZ LYS 120 -18.005 -2.978 6.904 1028 HZ2 LYS 120 1HZ LYS 120 -17.978 -1.568 5.976 1029 HZ3 LYS 120 2HZ LYS 120 -17.081 -1.659 7.406 1030 H GLU 121 H GLU 121 -12.792 -0.974 0.723 1031 HA GLU 121 HA GLU 121 -14.435 -2.996 -0.223 1032 HB2 GLU 121 2HB GLU 121 -14.252 -0.778 -1.235 1033 HB3 GLU 121 3HB GLU 121 -12.573 -1.064 -1.662 1034 HG2 GLU 121 2HG GLU 121 -13.379 -2.853 -3.241 1035 HG3 GLU 121 3HG GLU 121 -15.027 -2.326 -2.908 1036 H LEU 122 H LEU 122 -10.969 -2.523 -0.828 1037 HA LEU 122 HA LEU 122 -10.632 -5.021 -2.246 1038 HB2 LEU 122 2HB LEU 122 -8.629 -2.927 -1.323 1039 HB3 LEU 122 3HB LEU 122 -8.247 -4.287 -2.373 1040 HG LEU 122 HG LEU 122 -10.238 -2.087 -3.070 1041 HD11 LEU 122 1HD1 LEU 122 -7.987 -1.172 -3.003 1042 HD12 LEU 122 2HD1 LEU 122 -8.567 -1.265 -4.664 1043 HD13 LEU 122 3HD1 LEU 122 -7.403 -2.452 -4.068 1044 HD21 LEU 122 3HD2 LEU 122 -9.146 -4.351 -4.770 1045 HD22 LEU 122 1HD2 LEU 122 -10.183 -3.041 -5.342 1046 HD23 LEU 122 2HD2 LEU 122 -10.796 -4.195 -4.161 1047 H LEU 123 H LEU 123 -10.217 -3.903 1.051 1048 HA LEU 123 HA LEU 123 -8.253 -5.794 1.914 1049 HB2 LEU 123 2HB LEU 123 -8.760 -3.581 3.010 1050 HB3 LEU 123 3HB LEU 123 -10.261 -4.259 3.610 1051 HG LEU 123 HG LEU 123 -8.853 -5.977 4.886 1052 HD11 LEU 123 1HD1 LEU 123 -6.782 -5.817 3.595 1053 HD12 LEU 123 2HD1 LEU 123 -6.489 -5.458 5.296 1054 HD13 LEU 123 3HD1 LEU 123 -6.560 -4.144 4.119 1055 HD21 LEU 123 3HD2 LEU 123 -8.477 -3.052 5.613 1056 HD22 LEU 123 1HD2 LEU 123 -8.299 -4.424 6.712 1057 HD23 LEU 123 2HD2 LEU 123 -9.872 -4.056 6.013 1058 H GLU 124 H GLU 124 -11.789 -5.786 1.922 1059 HA GLU 124 HA GLU 124 -12.229 -7.971 3.686 1060 HB2 GLU 124 2HB GLU 124 -14.027 -6.864 1.486 1061 HB3 GLU 124 3HB GLU 124 -14.544 -8.005 2.732 1062 HG2 GLU 124 2HG GLU 124 -13.957 -6.310 4.469 1063 HG3 GLU 124 3HG GLU 124 -13.562 -5.180 3.186 1064 H LYS 125 H LYS 125 -11.620 -7.790 0.240 1065 HA LYS 125 HA LYS 125 -11.774 -10.739 0.007 1066 HB2 LYS 125 2HB LYS 125 -13.227 -9.252 -1.478 1067 HB3 LYS 125 3HB LYS 125 -11.750 -8.694 -2.254 1068 HG2 LYS 125 2HG LYS 125 -11.278 -10.924 -3.098 1069 HG3 LYS 125 3HG LYS 125 -12.607 -11.615 -2.167 1070 HD2 LYS 125 2HD LYS 125 -12.849 -9.672 -4.493 1071 HD3 LYS 125 3HD LYS 125 -13.251 -11.389 -4.523 1072 HE2 LYS 125 2HE LYS 125 -14.650 -9.289 -2.821 1073 HE3 LYS 125 3HE LYS 125 -15.267 -9.958 -4.333 1074 HZ1 LYS 125 3HZ LYS 125 -14.742 -11.515 -1.861 1075 HZ2 LYS 125 1HZ LYS 125 -15.375 -12.125 -3.305 1076 HZ3 LYS 125 2HZ LYS 125 -16.259 -11.003 -2.405 1077 H VAL 126 H VAL 126 -9.625 -8.394 0.656 1078 HA VAL 126 HA VAL 126 -7.408 -8.287 0.911 1079 HB VAL 126 HB VAL 126 -7.502 -11.244 0.202 1080 HG11 VAL 126 1HG1 VAL 126 -5.251 -9.670 1.479 1081 HG12 VAL 126 2HG1 VAL 126 -5.221 -10.473 -0.093 1082 HG13 VAL 126 3HG1 VAL 126 -5.326 -11.430 1.383 1083 HG21 VAL 126 3HG2 VAL 126 -7.461 -11.629 2.631 1084 HG22 VAL 126 1HG2 VAL 126 -8.867 -10.667 2.170 1085 HG23 VAL 126 2HG2 VAL 126 -7.472 -9.889 2.922 1086 H GLY 127 H GLY 127 -7.241 -6.811 -0.831 1087 HA2 GLY 127 2HA GLY 127 -6.155 -5.910 -2.627 1088 HA3 GLY 127 3HA GLY 127 -5.037 -7.249 -2.465 1089 H SER 128 H SER 128 -8.314 -8.029 -3.155 1090 HA SER 128 HA SER 128 -8.011 -8.092 -6.053 1091 HB2 SER 128 2HB SER 128 -8.641 -10.523 -6.161 1092 HB3 SER 128 3HB SER 128 -7.084 -10.283 -5.373 1093 HG SER 128 HG SER 128 -9.009 -10.200 -3.516 1094 H LEU 129 H LEU 129 -10.022 -8.181 -7.099 1095 HA LEU 129 HA LEU 129 -12.505 -8.678 -5.880 1096 HB2 LEU 129 2HB LEU 129 -12.156 -6.591 -4.656 1097 HB3 LEU 129 3HB LEU 129 -11.759 -5.736 -6.135 1098 HG LEU 129 HG LEU 129 -14.099 -5.916 -6.909 1099 HD11 LEU 129 1HD1 LEU 129 -15.874 -6.803 -5.471 1100 HD12 LEU 129 2HD1 LEU 129 -14.674 -7.344 -4.296 1101 HD13 LEU 129 3HD1 LEU 129 -14.719 -8.060 -5.910 1102 HD21 LEU 129 3HD2 LEU 129 -15.143 -4.418 -5.272 1103 HD22 LEU 129 1HD2 LEU 129 -13.461 -3.974 -5.553 1104 HD23 LEU 129 2HD2 LEU 129 -13.910 -4.836 -4.078 1105 H GLU 130 H GLU 130 -11.166 -6.309 -8.188 1106 HA GLU 130 HA GLU 130 -11.669 -5.694 -10.283 1107 HB2 GLU 130 2HB GLU 130 -12.217 -8.662 -10.668 1108 HB3 GLU 130 3HB GLU 130 -12.085 -7.507 -11.985 1109 HG2 GLU 130 2HG GLU 130 -9.891 -8.301 -10.048 1110 HG3 GLU 130 3HG GLU 130 -10.005 -8.752 -11.747 1111 H HIS 131 H HIS 131 -13.369 -4.350 -9.878 1112 HA HIS 131 HA HIS 131 -16.115 -5.403 -10.202 1113 HB2 HIS 131 2HB HIS 131 -16.845 -3.147 -9.253 1114 HB3 HIS 131 3HB HIS 131 -16.014 -4.213 -8.129 1115 HD1 HIS 131 HD1 HIS 131 -15.695 -0.897 -9.825 1116 HD2 HIS 131 HD2 HIS 131 -13.491 -3.296 -7.260 1117 HE1 HIS 131 HE1 HIS 131 -13.912 0.585 -8.869 1118 HE2 HIS 131 HE2 HIS 131 -12.783 -0.832 -7.140 1119 H HIS 132 H HIS 132 -16.812 -5.285 -12.219 1120 HA HIS 132 HA HIS 132 -15.506 -3.864 -14.297 1121 HB2 HIS 132 2HB HIS 132 -16.761 -6.017 -14.639 1122 HB3 HIS 132 3HB HIS 132 -18.278 -5.159 -14.377 1123 HD1 HIS 132 HD1 HIS 132 -19.142 -3.662 -16.316 1124 HD2 HIS 132 HD2 HIS 132 -15.507 -5.508 -17.136 1125 HE1 HIS 132 HE1 HIS 132 -18.721 -3.275 -18.758 1126 HE2 HIS 132 HE2 HIS 132 -16.634 -4.570 -19.262 1127 H HIS 133 H HIS 133 -15.654 -1.752 -14.640 1128 HA HIS 133 HA HIS 133 -18.140 -0.279 -14.601 1129 HB2 HIS 133 2HB HIS 133 -17.542 -0.347 -12.177 1130 HB3 HIS 133 3HB HIS 133 -15.981 0.384 -12.536 1131 HD1 HIS 133 HD1 HIS 133 -15.942 2.929 -12.915 1132 HD2 HIS 133 HD2 HIS 133 -19.767 1.404 -12.385 1133 HE1 HIS 133 HE1 HIS 133 -17.436 4.924 -12.674 1134 HE2 HIS 133 HE2 HIS 133 -19.757 3.982 -12.513 1135 H HIS 134 H HIS 134 -14.593 -0.181 -14.616 1136 HA HIS 134 HA HIS 134 -13.019 0.910 -15.780 1137 HB2 HIS 134 2HB HIS 134 -15.288 1.385 -17.749 1138 HB3 HIS 134 3HB HIS 134 -13.672 2.007 -18.044 1139 HD1 HIS 134 HD1 HIS 134 -12.231 0.518 -19.389 1140 HD2 HIS 134 HD2 HIS 134 -15.175 -1.629 -17.383 1141 HE1 HIS 134 HE1 HIS 134 -11.976 -1.854 -20.155 1142 HE2 HIS 134 HE2 HIS 134 -13.893 -3.079 -19.098 1143 H HIS 135 H HIS 135 -12.315 3.083 -16.585 1144 HA HIS 135 HA HIS 135 -13.627 5.349 -15.167 1145 HB2 HIS 135 2HB HIS 135 -11.326 6.327 -14.957 1146 HB3 HIS 135 3HB HIS 135 -11.481 4.796 -14.104 1147 HD1 HIS 135 HD1 HIS 135 -10.017 6.185 -17.336 1148 HD2 HIS 135 HD2 HIS 135 -9.640 2.900 -14.826 1149 HE1 HIS 135 HE1 HIS 135 -8.121 4.834 -18.274 1150 HE2 HIS 135 HE2 HIS 135 -7.866 2.895 -16.699 1151 H HIS 136 H HIS 136 -14.571 4.700 -17.562 1152 HA HIS 136 HA HIS 136 -14.983 5.146 -19.711 1153 HB2 HIS 136 2HB HIS 136 -14.677 7.584 -19.122 1154 HB3 HIS 136 3HB HIS 136 -12.973 7.446 -19.523 1155 HD1 HIS 136 HD1 HIS 136 -16.382 7.549 -21.065 1156 HD2 HIS 136 HD2 HIS 136 -12.416 7.545 -22.302 1157 HE1 HIS 136 HE1 HIS 136 -16.439 8.136 -23.500 1158 HE2 HIS 136 HE2 HIS 136 -14.027 8.281 -24.184 Start of MODEL 11 1 H1 MET 1 1H MET 1 -4.224 -14.053 -1.768 2 H2 MET 1 2H MET 1 -4.908 -15.498 -1.233 3 H3 MET 1 3H MET 1 -3.240 -15.395 -1.482 4 HA MET 1 HA MET 1 -4.788 -13.878 0.525 5 HB2 MET 1 2HB MET 1 -3.712 -15.289 2.218 6 HB3 MET 1 3HB MET 1 -4.617 -16.282 1.086 7 HG2 MET 1 2HG MET 1 -1.613 -15.917 1.132 8 HG3 MET 1 3HG MET 1 -2.512 -17.337 1.672 9 HE1 MET 1 3HE MET 1 -0.654 -18.483 -1.675 10 HE2 MET 1 1HE MET 1 -0.801 -18.791 0.055 11 HE3 MET 1 2HE MET 1 -0.045 -17.303 -0.518 12 H GLY 2 H GLY 2 -1.724 -14.490 -1.106 13 HA2 GLY 2 2HA GLY 2 -0.166 -12.669 0.522 14 HA3 GLY 2 3HA GLY 2 0.367 -13.546 -0.901 15 H THR 3 H THR 3 -1.769 -10.871 0.046 16 HA THR 3 HA THR 3 -1.005 -9.378 -2.400 17 HB THR 3 HB THR 3 -3.087 -7.952 -1.724 18 HG1 THR 3 HG1 THR 3 -3.990 -8.602 0.063 19 HG21 THR 3 3HG2 THR 3 -3.123 -9.415 -3.703 20 HG22 THR 3 1HG2 THR 3 -4.667 -9.485 -2.852 21 HG23 THR 3 2HG2 THR 3 -3.510 -10.806 -2.690 22 H VAL 4 H VAL 4 -0.220 -7.349 -2.181 23 HA VAL 4 HA VAL 4 0.406 -6.317 0.525 24 HB VAL 4 HB VAL 4 2.131 -5.914 -1.994 25 HG11 VAL 4 1HG1 VAL 4 2.369 -4.139 -0.304 26 HG12 VAL 4 2HG1 VAL 4 3.850 -5.086 -0.417 27 HG13 VAL 4 3HG1 VAL 4 2.746 -5.335 0.937 28 HG21 VAL 4 3HG2 VAL 4 2.186 -8.307 -1.391 29 HG22 VAL 4 1HG2 VAL 4 2.650 -7.898 0.263 30 HG23 VAL 4 2HG2 VAL 4 3.747 -7.550 -1.076 31 H VAL 5 H VAL 5 -0.911 -4.603 0.787 32 HA VAL 5 HA VAL 5 -1.523 -2.850 -1.510 33 HB VAL 5 HB VAL 5 -3.638 -2.193 -0.293 34 HG11 VAL 5 1HG1 VAL 5 -4.912 -4.201 -0.960 35 HG12 VAL 5 2HG1 VAL 5 -3.419 -5.139 -1.034 36 HG13 VAL 5 3HG1 VAL 5 -3.677 -3.802 -2.153 37 HG21 VAL 5 3HG2 VAL 5 -3.042 -4.592 1.499 38 HG22 VAL 5 1HG2 VAL 5 -4.553 -3.674 1.468 39 HG23 VAL 5 2HG2 VAL 5 -3.064 -2.903 2.006 40 H ILE 6 H ILE 6 -0.431 -1.046 -1.429 41 HA ILE 6 HA ILE 6 0.682 -0.082 1.130 42 HB ILE 6 HB ILE 6 1.517 0.697 -1.714 43 HG12 ILE 6 2HG1 ILE 6 3.689 -0.641 -1.038 44 HG13 ILE 6 3HG1 ILE 6 2.667 -1.426 0.156 45 HG21 ILE 6 1HG2 ILE 6 3.498 1.710 -0.630 46 HG22 ILE 6 2HG2 ILE 6 2.858 1.280 0.957 47 HG23 ILE 6 3HG2 ILE 6 2.001 2.443 -0.056 48 HD11 ILE 6 3HD1 ILE 6 2.930 -2.765 -1.859 49 HD12 ILE 6 1HD1 ILE 6 2.243 -1.470 -2.837 50 HD13 ILE 6 2HD1 ILE 6 1.246 -2.297 -1.637 51 H VAL 7 H VAL 7 -0.745 1.311 2.028 52 HA VAL 7 HA VAL 7 -2.364 3.135 0.418 53 HB VAL 7 HB VAL 7 -2.234 2.833 3.468 54 HG11 VAL 7 1HG1 VAL 7 -4.396 4.044 3.482 55 HG12 VAL 7 2HG1 VAL 7 -4.296 4.269 1.734 56 HG13 VAL 7 3HG1 VAL 7 -3.109 5.036 2.792 57 HG21 VAL 7 3HG2 VAL 7 -2.973 0.754 2.394 58 HG22 VAL 7 1HG2 VAL 7 -4.212 1.631 1.493 59 HG23 VAL 7 2HG2 VAL 7 -4.307 1.519 3.253 60 H VAL 8 H VAL 8 -1.302 4.837 -0.304 61 HA VAL 8 HA VAL 8 0.653 6.278 1.355 62 HB VAL 8 HB VAL 8 0.274 6.439 -1.665 63 HG11 VAL 8 1HG1 VAL 8 2.557 7.443 0.062 64 HG12 VAL 8 2HG1 VAL 8 1.321 8.440 -0.709 65 HG13 VAL 8 3HG1 VAL 8 2.467 7.539 -1.699 66 HG21 VAL 8 3HG2 VAL 8 0.972 4.163 -1.073 67 HG22 VAL 8 1HG2 VAL 8 2.339 4.802 -0.159 68 HG23 VAL 8 2HG2 VAL 8 2.268 5.017 -1.908 69 H SER 9 H SER 9 0.337 8.437 1.765 70 HA SER 9 HA SER 9 -1.656 10.032 0.379 71 HB2 SER 9 2HB SER 9 -3.057 8.918 2.105 72 HB3 SER 9 3HB SER 9 -1.958 9.467 3.368 73 HG SER 9 HG SER 9 -3.609 11.046 1.694 74 H ASN 10 H ASN 10 -1.399 12.265 0.784 75 HA ASN 10 HA ASN 10 1.310 13.075 1.296 76 HB2 ASN 10 2HB ASN 10 -0.111 14.155 -0.443 77 HB3 ASN 10 3HB ASN 10 -1.199 14.758 0.803 78 HD21 ASN 10 1HD2 ASN 10 -0.894 16.923 0.405 79 HD22 ASN 10 2HD2 ASN 10 0.608 17.747 0.621 80 H ASP 11 H ASP 11 -1.663 13.035 3.151 81 HA ASP 11 HA ASP 11 -0.451 14.626 5.346 82 HB2 ASP 11 2HB ASP 11 -2.550 15.538 4.384 83 HB3 ASP 11 3HB ASP 11 -3.385 14.039 4.755 84 H GLU 12 H GLU 12 -0.573 13.845 7.471 85 HA GLU 12 HA GLU 12 -0.169 10.982 7.638 86 HB2 GLU 12 2HB GLU 12 1.393 12.677 8.661 87 HB3 GLU 12 3HB GLU 12 0.135 13.080 9.826 88 HG2 GLU 12 2HG GLU 12 0.194 10.701 10.629 89 HG3 GLU 12 3HG GLU 12 1.536 10.402 9.524 90 H ARG 13 H ARG 13 -2.571 13.327 8.849 91 HA ARG 13 HA ARG 13 -3.919 11.441 10.568 92 HB2 ARG 13 2HB ARG 13 -4.956 14.039 9.387 93 HB3 ARG 13 3HB ARG 13 -5.886 13.016 10.479 94 HG2 ARG 13 2HG ARG 13 -3.990 13.344 12.173 95 HG3 ARG 13 3HG ARG 13 -3.388 14.601 11.088 96 HD2 ARG 13 2HD ARG 13 -6.010 14.536 12.600 97 HD3 ARG 13 3HD ARG 13 -4.721 15.739 12.698 98 HE ARG 13 HE ARG 13 -5.396 16.142 10.210 99 HH11 ARG 13 1HH1 ARG 13 -7.632 15.500 12.852 100 HH12 ARG 13 2HH1 ARG 13 -8.939 16.368 12.111 101 HH21 ARG 13 1HH2 ARG 13 -7.131 17.202 9.221 102 HH22 ARG 13 2HH2 ARG 13 -8.652 17.332 10.048 103 H ILE 14 H ILE 14 -4.093 12.215 7.155 104 HA ILE 14 HA ILE 14 -6.479 10.711 6.625 105 HB ILE 14 HB ILE 14 -4.185 11.348 4.700 106 HG12 ILE 14 2HG1 ILE 14 -5.103 13.424 5.620 107 HG13 ILE 14 3HG1 ILE 14 -5.626 13.256 3.952 108 HG21 ILE 14 1HG2 ILE 14 -7.056 10.514 4.097 109 HG22 ILE 14 2HG2 ILE 14 -5.610 9.537 3.836 110 HG23 ILE 14 3HG2 ILE 14 -5.857 11.009 2.900 111 HD11 ILE 14 3HD1 ILE 14 -7.293 12.743 6.415 112 HD12 ILE 14 1HD1 ILE 14 -7.836 12.508 4.751 113 HD13 ILE 14 2HD1 ILE 14 -7.406 14.119 5.320 114 H LEU 15 H LEU 15 -2.983 9.938 6.573 115 HA LEU 15 HA LEU 15 -3.195 7.170 6.039 116 HB2 LEU 15 2HB LEU 15 -1.134 8.755 7.612 117 HB3 LEU 15 3HB LEU 15 -0.983 7.021 7.378 118 HG LEU 15 HG LEU 15 -1.022 9.085 5.138 119 HD11 LEU 15 1HD1 LEU 15 1.048 9.212 6.460 120 HD12 LEU 15 2HD1 LEU 15 1.363 8.572 4.850 121 HD13 LEU 15 3HD1 LEU 15 1.316 7.480 6.237 122 HD21 LEU 15 3HD2 LEU 15 -0.592 6.074 5.016 123 HD22 LEU 15 1HD2 LEU 15 -0.413 7.195 3.659 124 HD23 LEU 15 2HD2 LEU 15 -1.992 6.957 4.403 125 H GLU 16 H GLU 16 -3.566 9.003 9.032 126 HA GLU 16 HA GLU 16 -3.667 6.753 10.793 127 HB2 GLU 16 2HB GLU 16 -4.201 9.710 11.072 128 HB3 GLU 16 3HB GLU 16 -4.793 8.644 12.337 129 HG2 GLU 16 2HG GLU 16 -1.898 8.637 11.446 130 HG3 GLU 16 3HG GLU 16 -2.508 9.703 12.711 131 H GLU 17 H GLU 17 -6.144 8.718 9.193 132 HA GLU 17 HA GLU 17 -8.396 7.582 10.528 133 HB2 GLU 17 2HB GLU 17 -8.511 9.799 9.516 134 HB3 GLU 17 3HB GLU 17 -8.155 9.153 7.916 135 HG2 GLU 17 2HG GLU 17 -10.284 8.035 7.819 136 HG3 GLU 17 3HG GLU 17 -10.619 8.405 9.511 137 H LEU 18 H LEU 18 -6.956 7.166 7.326 138 HA LEU 18 HA LEU 18 -8.518 4.994 6.435 139 HB2 LEU 18 2HB LEU 18 -5.887 6.201 5.581 140 HB3 LEU 18 3HB LEU 18 -6.363 4.655 4.906 141 HG LEU 18 HG LEU 18 -8.356 5.623 3.881 142 HD11 LEU 18 1HD1 LEU 18 -8.922 8.003 3.958 143 HD12 LEU 18 2HD1 LEU 18 -7.633 8.292 5.130 144 HD13 LEU 18 3HD1 LEU 18 -9.010 7.274 5.559 145 HD21 LEU 18 3HD2 LEU 18 -7.314 7.133 2.241 146 HD22 LEU 18 1HD2 LEU 18 -6.273 5.758 2.602 147 HD23 LEU 18 2HD2 LEU 18 -5.917 7.340 3.300 148 H LEU 19 H LEU 19 -5.640 5.127 8.495 149 HA LEU 19 HA LEU 19 -5.036 2.361 8.607 150 HB2 LEU 19 2HB LEU 19 -3.588 4.147 9.618 151 HB3 LEU 19 3HB LEU 19 -4.800 4.396 10.861 152 HG LEU 19 HG LEU 19 -4.422 1.869 11.437 153 HD11 LEU 19 1HD1 LEU 19 -3.141 1.229 9.486 154 HD12 LEU 19 2HD1 LEU 19 -2.193 0.984 10.949 155 HD13 LEU 19 3HD1 LEU 19 -1.859 2.370 9.907 156 HD21 LEU 19 3HD2 LEU 19 -2.275 3.905 12.105 157 HD22 LEU 19 1HD2 LEU 19 -2.582 2.395 12.972 158 HD23 LEU 19 2HD2 LEU 19 -3.803 3.662 12.955 159 H GLU 20 H GLU 20 -7.153 4.396 10.588 160 HA GLU 20 HA GLU 20 -8.084 2.389 12.348 161 HB2 GLU 20 2HB GLU 20 -9.347 5.058 11.589 162 HB3 GLU 20 3HB GLU 20 -9.817 4.071 12.975 163 HG2 GLU 20 2HG GLU 20 -7.632 4.377 14.001 164 HG3 GLU 20 3HG GLU 20 -7.040 5.214 12.568 165 H VAL 21 H VAL 21 -9.209 3.469 9.180 166 HA VAL 21 HA VAL 21 -11.689 2.102 9.077 167 HB VAL 21 HB VAL 21 -9.782 2.801 6.787 168 HG11 VAL 21 1HG1 VAL 21 -12.714 1.976 6.623 169 HG12 VAL 21 2HG1 VAL 21 -11.331 1.048 6.041 170 HG13 VAL 21 3HG1 VAL 21 -11.743 2.579 5.273 171 HG21 VAL 21 3HG2 VAL 21 -12.233 4.292 7.801 172 HG22 VAL 21 1HG2 VAL 21 -11.224 4.758 6.429 173 HG23 VAL 21 2HG2 VAL 21 -10.555 4.768 8.057 174 H VAL 22 H VAL 22 -8.408 1.128 8.104 175 HA VAL 22 HA VAL 22 -9.061 -1.500 7.232 176 HB VAL 22 HB VAL 22 -6.385 -0.304 8.118 177 HG11 VAL 22 1HG1 VAL 22 -6.296 -2.755 8.258 178 HG12 VAL 22 2HG1 VAL 22 -5.298 -2.168 6.931 179 HG13 VAL 22 3HG1 VAL 22 -6.872 -2.887 6.595 180 HG21 VAL 22 3HG2 VAL 22 -5.920 -0.052 5.702 181 HG22 VAL 22 1HG2 VAL 22 -7.371 0.841 6.157 182 HG23 VAL 22 2HG2 VAL 22 -7.515 -0.699 5.312 183 H LEU 23 H LEU 23 -8.070 -0.138 10.362 184 HA LEU 23 HA LEU 23 -7.568 -2.643 11.668 185 HB2 LEU 23 2HB LEU 23 -7.565 0.247 12.450 186 HB3 LEU 23 3HB LEU 23 -7.840 -0.890 13.752 187 HG LEU 23 HG LEU 23 -5.698 -2.028 13.254 188 HD11 LEU 23 1HD1 LEU 23 -5.289 0.075 11.117 189 HD12 LEU 23 2HD1 LEU 23 -5.544 -1.651 10.855 190 HD13 LEU 23 3HD1 LEU 23 -4.087 -1.094 11.669 191 HD21 LEU 23 3HD2 LEU 23 -4.185 -0.254 14.026 192 HD22 LEU 23 1HD2 LEU 23 -5.711 -0.229 14.903 193 HD23 LEU 23 2HD2 LEU 23 -5.399 0.966 13.640 194 H LYS 24 H LYS 24 -10.412 -0.523 11.514 195 HA LYS 24 HA LYS 24 -11.876 -1.981 13.560 196 HB2 LYS 24 2HB LYS 24 -13.740 -0.505 13.076 197 HB3 LYS 24 3HB LYS 24 -12.267 0.459 13.112 198 HG2 LYS 24 2HG LYS 24 -12.208 0.429 10.628 199 HG3 LYS 24 3HG LYS 24 -13.717 -0.481 10.623 200 HD2 LYS 24 2HD LYS 24 -14.859 1.427 11.741 201 HD3 LYS 24 3HD LYS 24 -13.343 2.335 11.704 202 HE2 LYS 24 2HE LYS 24 -13.364 2.129 9.185 203 HE3 LYS 24 3HE LYS 24 -14.964 1.397 9.311 204 HZ1 LYS 24 3HZ LYS 24 -15.067 3.759 8.822 205 HZ2 LYS 24 1HZ LYS 24 -14.239 4.115 10.253 206 HZ3 LYS 24 2HZ LYS 24 -15.781 3.425 10.319 207 H SER 25 H SER 25 -11.376 -2.264 10.157 208 HA SER 25 HA SER 25 -13.608 -4.048 9.635 209 HB2 SER 25 2HB SER 25 -12.743 -2.523 7.864 210 HB3 SER 25 3HB SER 25 -11.179 -3.331 7.921 211 HG SER 25 HG SER 25 -12.034 -5.098 6.972 212 H ASP 26 H ASP 26 -10.075 -4.497 9.220 213 HA ASP 26 HA ASP 26 -10.194 -7.173 10.462 214 HB2 ASP 26 2HB ASP 26 -9.007 -6.500 7.735 215 HB3 ASP 26 3HB ASP 26 -8.614 -7.973 8.611 216 HA PRO 27 HA PRO 27 -6.529 -5.001 12.282 217 HB2 PRO 27 2HB PRO 27 -6.792 -6.025 14.803 218 HB3 PRO 27 3HB PRO 27 -7.742 -4.634 14.244 219 HG2 PRO 27 2HG PRO 27 -8.568 -7.504 14.465 220 HG3 PRO 27 3HG PRO 27 -9.474 -6.035 14.894 221 HD2 PRO 27 2HD PRO 27 -9.870 -7.407 12.549 222 HD3 PRO 27 3HD PRO 27 -10.164 -5.664 12.723 223 H ASN 28 H ASN 28 -7.407 -8.261 11.712 224 HA ASN 28 HA ASN 28 -5.161 -9.643 12.779 225 HB2 ASN 28 2HB ASN 28 -5.872 -11.552 11.410 226 HB3 ASN 28 3HB ASN 28 -7.279 -10.795 12.144 227 HD21 ASN 28 1HD2 ASN 28 -8.770 -9.724 10.813 228 HD22 ASN 28 2HD2 ASN 28 -8.765 -9.891 9.090 229 H VAL 29 H VAL 29 -5.668 -7.823 9.886 230 HA VAL 29 HA VAL 29 -3.539 -8.894 8.294 231 HB VAL 29 HB VAL 29 -5.085 -6.265 8.019 232 HG11 VAL 29 1HG1 VAL 29 -2.999 -6.218 6.719 233 HG12 VAL 29 2HG1 VAL 29 -4.399 -6.290 5.654 234 HG13 VAL 29 3HG1 VAL 29 -3.433 -7.740 5.935 235 HG21 VAL 29 3HG2 VAL 29 -6.576 -8.232 8.003 236 HG22 VAL 29 1HG2 VAL 29 -5.626 -8.962 6.706 237 HG23 VAL 29 2HG2 VAL 29 -6.522 -7.468 6.417 238 H LYS 30 H LYS 30 -1.465 -8.025 7.947 239 HA LYS 30 HA LYS 30 -0.268 -6.682 10.188 240 HB2 LYS 30 2HB LYS 30 0.833 -7.760 7.571 241 HB3 LYS 30 3HB LYS 30 1.854 -6.846 8.674 242 HG2 LYS 30 2HG LYS 30 0.411 -9.435 9.324 243 HG3 LYS 30 3HG LYS 30 2.140 -9.257 8.997 244 HD2 LYS 30 2HD LYS 30 2.314 -7.744 11.001 245 HD3 LYS 30 3HD LYS 30 0.609 -8.049 11.338 246 HE2 LYS 30 2HE LYS 30 1.122 -10.470 11.602 247 HE3 LYS 30 3HE LYS 30 2.833 -10.112 11.341 248 HZ1 LYS 30 3HZ LYS 30 2.327 -10.268 13.686 249 HZ2 LYS 30 1HZ LYS 30 1.154 -9.058 13.555 250 HZ3 LYS 30 2HZ LYS 30 2.787 -8.686 13.306 251 H THR 31 H THR 31 -1.139 -4.652 10.299 252 HA THR 31 HA THR 31 -0.823 -2.744 8.093 253 HB THR 31 HB THR 31 -2.193 -1.249 9.570 254 HG1 THR 31 HG1 THR 31 -1.671 -2.064 11.614 255 HG21 THR 31 3HG2 THR 31 -4.298 -2.531 9.387 256 HG22 THR 31 1HG2 THR 31 -3.382 -4.015 9.126 257 HG23 THR 31 2HG2 THR 31 -3.322 -2.715 7.931 258 H VAL 32 H VAL 32 1.235 -2.005 8.008 259 HA VAL 32 HA VAL 32 2.564 -1.043 10.486 260 HB VAL 32 HB VAL 32 3.927 -2.385 8.096 261 HG11 VAL 32 1HG1 VAL 32 5.364 -0.713 9.172 262 HG12 VAL 32 2HG1 VAL 32 5.978 -2.333 9.488 263 HG13 VAL 32 3HG1 VAL 32 5.106 -1.459 10.752 264 HG21 VAL 32 3HG2 VAL 32 2.647 -4.048 9.380 265 HG22 VAL 32 1HG2 VAL 32 3.440 -3.543 10.873 266 HG23 VAL 32 2HG2 VAL 32 4.377 -4.308 9.587 267 H ARG 33 H ARG 33 2.847 1.125 10.369 268 HA ARG 33 HA ARG 33 3.223 2.443 7.755 269 HB2 ARG 33 2HB ARG 33 1.592 3.459 9.357 270 HB3 ARG 33 3HB ARG 33 2.897 3.717 10.516 271 HG2 ARG 33 2HG ARG 33 4.015 5.261 8.957 272 HG3 ARG 33 3HG ARG 33 2.793 4.939 7.726 273 HD2 ARG 33 2HD ARG 33 2.402 6.359 10.376 274 HD3 ARG 33 3HD ARG 33 2.304 7.063 8.759 275 HE ARG 33 HE ARG 33 0.325 5.557 8.414 276 HH11 ARG 33 1HH1 ARG 33 1.201 6.636 11.630 277 HH12 ARG 33 2HH1 ARG 33 -0.419 6.476 12.253 278 HH21 ARG 33 1HH2 ARG 33 -1.794 5.305 9.256 279 HH22 ARG 33 2HH2 ARG 33 -2.104 5.727 10.919 280 H THR 34 H THR 34 5.272 2.170 7.131 281 HA THR 34 HA THR 34 7.337 3.586 8.565 282 HB THR 34 HB THR 34 7.635 1.321 9.545 283 HG1 THR 34 HG1 THR 34 9.761 1.497 9.387 284 HG21 THR 34 3HG2 THR 34 8.154 0.338 6.706 285 HG22 THR 34 1HG2 THR 34 6.737 -0.067 7.682 286 HG23 THR 34 2HG2 THR 34 8.339 -0.605 8.185 287 H ASP 35 H ASP 35 8.550 4.640 7.127 288 HA ASP 35 HA ASP 35 8.367 4.034 4.257 289 HB2 ASP 35 2HB ASP 35 9.475 6.236 3.933 290 HB3 ASP 35 3HB ASP 35 8.023 6.381 4.912 291 H ASP 36 H ASP 36 10.317 3.180 6.834 292 HA ASP 36 HA ASP 36 12.942 3.263 5.786 293 HB2 ASP 36 2HB ASP 36 12.436 2.889 8.195 294 HB3 ASP 36 3HB ASP 36 11.750 1.311 7.808 295 H LYS 37 H LYS 37 13.526 2.344 3.974 296 HA LYS 37 HA LYS 37 11.995 0.776 2.321 297 HB2 LYS 37 2HB LYS 37 13.952 2.276 1.736 298 HB3 LYS 37 3HB LYS 37 15.033 0.985 2.240 299 HG2 LYS 37 2HG LYS 37 14.218 -0.456 0.446 300 HG3 LYS 37 3HG LYS 37 13.002 0.741 -0.006 301 HD2 LYS 37 2HD LYS 37 16.020 1.030 -0.245 302 HD3 LYS 37 3HD LYS 37 14.861 0.878 -1.562 303 HE2 LYS 37 2HE LYS 37 13.913 3.065 -1.022 304 HE3 LYS 37 3HE LYS 37 15.001 3.221 0.358 305 HZ1 LYS 37 3HZ LYS 37 15.832 4.461 -1.508 306 HZ2 LYS 37 1HZ LYS 37 15.795 3.091 -2.500 307 HZ3 LYS 37 2HZ LYS 37 16.877 3.162 -1.202 308 H GLU 38 H GLU 38 14.726 -0.277 4.324 309 HA GLU 38 HA GLU 38 14.687 -3.019 3.522 310 HB2 GLU 38 2HB GLU 38 16.218 -3.370 5.472 311 HB3 GLU 38 3HB GLU 38 16.729 -2.069 4.409 312 HG2 GLU 38 2HG GLU 38 15.883 -0.399 5.986 313 HG3 GLU 38 3HG GLU 38 15.271 -1.675 7.037 314 H LYS 39 H LYS 39 13.038 -1.228 6.093 315 HA LYS 39 HA LYS 39 12.212 -3.535 7.574 316 HB2 LYS 39 2HB LYS 39 12.453 -1.349 8.674 317 HB3 LYS 39 3HB LYS 39 11.121 -0.704 7.718 318 HG2 LYS 39 2HG LYS 39 9.548 -2.223 8.784 319 HG3 LYS 39 3HG LYS 39 10.854 -3.048 9.637 320 HD2 LYS 39 2HD LYS 39 11.294 -1.033 10.971 321 HD3 LYS 39 3HD LYS 39 10.072 -0.137 10.061 322 HE2 LYS 39 2HE LYS 39 8.306 -1.593 10.929 323 HE3 LYS 39 3HE LYS 39 9.502 -2.594 11.756 324 HZ1 LYS 39 3HZ LYS 39 9.001 0.274 12.333 325 HZ2 LYS 39 1HZ LYS 39 10.077 -0.740 13.153 326 HZ3 LYS 39 2HZ LYS 39 8.410 -1.026 13.243 327 H VAL 40 H VAL 40 10.656 -1.486 5.105 328 HA VAL 40 HA VAL 40 8.025 -2.448 5.281 329 HB VAL 40 HB VAL 40 9.432 -1.567 2.707 330 HG11 VAL 40 1HG1 VAL 40 6.468 -1.619 3.399 331 HG12 VAL 40 2HG1 VAL 40 7.294 -2.685 2.263 332 HG13 VAL 40 3HG1 VAL 40 7.163 -0.964 1.911 333 HG21 VAL 40 3HG2 VAL 40 7.916 0.153 4.707 334 HG22 VAL 40 1HG2 VAL 40 8.563 0.700 3.156 335 HG23 VAL 40 2HG2 VAL 40 9.656 0.169 4.431 336 H LYS 41 H LYS 41 10.803 -3.631 3.456 337 HA LYS 41 HA LYS 41 9.605 -5.837 2.118 338 HB2 LYS 41 2HB LYS 41 12.502 -5.425 2.972 339 HB3 LYS 41 3HB LYS 41 11.942 -6.598 1.782 340 HG2 LYS 41 2HG LYS 41 11.179 -4.762 0.323 341 HG3 LYS 41 3HG LYS 41 11.748 -3.584 1.512 342 HD2 LYS 41 2HD LYS 41 14.063 -4.457 1.248 343 HD3 LYS 41 3HD LYS 41 13.478 -5.603 0.035 344 HE2 LYS 41 2HE LYS 41 12.789 -3.724 -1.405 345 HE3 LYS 41 3HE LYS 41 13.366 -2.580 -0.188 346 HZ1 LYS 41 3HZ LYS 41 15.599 -3.548 -0.462 347 HZ2 LYS 41 1HZ LYS 41 15.004 -2.844 -1.881 348 HZ3 LYS 41 2HZ LYS 41 15.012 -4.524 -1.712 349 H GLU 42 H GLU 42 11.236 -5.495 5.241 350 HA GLU 42 HA GLU 42 11.369 -8.200 6.016 351 HB2 GLU 42 2HB GLU 42 11.994 -5.648 7.195 352 HB3 GLU 42 3HB GLU 42 10.952 -6.459 8.351 353 HG2 GLU 42 2HG GLU 42 13.570 -7.516 7.231 354 HG3 GLU 42 3HG GLU 42 13.301 -6.872 8.849 355 H GLU 43 H GLU 43 8.808 -5.783 6.299 356 HA GLU 43 HA GLU 43 7.054 -7.299 7.960 357 HB2 GLU 43 2HB GLU 43 6.268 -5.022 6.092 358 HB3 GLU 43 3HB GLU 43 5.373 -5.599 7.491 359 HG2 GLU 43 2HG GLU 43 7.934 -4.010 7.436 360 HG3 GLU 43 3HG GLU 43 6.388 -3.565 8.145 361 H ILE 44 H ILE 44 7.483 -7.000 4.467 362 HA ILE 44 HA ILE 44 5.151 -8.279 3.539 363 HB ILE 44 HB ILE 44 7.942 -8.123 2.308 364 HG12 ILE 44 2HG1 ILE 44 5.373 -6.580 1.701 365 HG13 ILE 44 3HG1 ILE 44 6.789 -5.943 2.529 366 HG21 ILE 44 1HG2 ILE 44 6.983 -8.824 0.145 367 HG22 ILE 44 2HG2 ILE 44 5.423 -9.113 0.920 368 HG23 ILE 44 3HG2 ILE 44 6.821 -10.099 1.352 369 HD11 ILE 44 3HD1 ILE 44 6.696 -5.172 0.243 370 HD12 ILE 44 1HD1 ILE 44 6.670 -6.835 -0.351 371 HD13 ILE 44 2HD1 ILE 44 8.100 -6.211 0.478 372 H GLU 45 H GLU 45 8.299 -9.645 4.538 373 HA GLU 45 HA GLU 45 7.649 -12.361 3.908 374 HB2 GLU 45 2HB GLU 45 10.012 -11.493 4.145 375 HB3 GLU 45 3HB GLU 45 9.766 -11.414 5.890 376 HG2 GLU 45 2HG GLU 45 9.230 -13.896 5.827 377 HG3 GLU 45 3HG GLU 45 9.735 -13.896 4.140 378 H LYS 46 H LYS 46 7.208 -10.345 6.780 379 HA LYS 46 HA LYS 46 6.403 -12.377 8.609 380 HB2 LYS 46 2HB LYS 46 5.644 -9.427 8.511 381 HB3 LYS 46 3HB LYS 46 5.305 -10.496 9.870 382 HG2 LYS 46 2HG LYS 46 7.698 -10.785 10.290 383 HG3 LYS 46 3HG LYS 46 8.088 -9.816 8.864 384 HD2 LYS 46 2HD LYS 46 6.980 -7.850 9.905 385 HD3 LYS 46 3HD LYS 46 6.625 -8.818 11.338 386 HE2 LYS 46 2HE LYS 46 9.023 -9.071 11.789 387 HE3 LYS 46 3HE LYS 46 9.412 -8.181 10.313 388 HZ1 LYS 46 3HZ LYS 46 7.956 -7.094 12.663 389 HZ2 LYS 46 1HZ LYS 46 8.277 -6.245 11.232 390 HZ3 LYS 46 2HZ LYS 46 9.545 -6.746 12.232 391 H ALA 47 H ALA 47 4.677 -10.529 6.148 392 HA ALA 47 HA ALA 47 2.010 -11.098 6.912 393 HB1 ALA 47 3HB ALA 47 2.623 -9.246 5.419 394 HB2 ALA 47 1HB ALA 47 1.409 -10.290 4.675 395 HB3 ALA 47 2HB ALA 47 3.099 -10.395 4.168 396 H ARG 48 H ARG 48 4.031 -12.543 4.330 397 HA ARG 48 HA ARG 48 2.224 -14.592 3.566 398 HB2 ARG 48 2HB ARG 48 4.291 -15.712 2.536 399 HB3 ARG 48 3HB ARG 48 3.933 -14.084 1.979 400 HG2 ARG 48 2HG ARG 48 5.727 -13.139 3.229 401 HG3 ARG 48 3HG ARG 48 5.946 -14.609 4.173 402 HD2 ARG 48 2HD ARG 48 6.444 -14.514 1.178 403 HD3 ARG 48 3HD ARG 48 7.693 -14.145 2.371 404 HE ARG 48 HE ARG 48 6.314 -16.720 2.597 405 HH11 ARG 48 1HH1 ARG 48 9.265 -15.039 1.620 406 HH12 ARG 48 2HH1 ARG 48 10.214 -16.497 1.607 407 HH21 ARG 48 1HH2 ARG 48 7.593 -18.600 2.598 408 HH22 ARG 48 2HH2 ARG 48 9.268 -18.502 2.156 409 H LYS 49 H LYS 49 4.597 -14.412 6.147 410 HA LYS 49 HA LYS 49 4.643 -17.163 6.886 411 HB2 LYS 49 2HB LYS 49 6.373 -15.623 7.655 412 HB3 LYS 49 3HB LYS 49 5.192 -14.648 8.516 413 HG2 LYS 49 2HG LYS 49 4.857 -16.341 10.176 414 HG3 LYS 49 3HG LYS 49 5.722 -17.552 9.237 415 HD2 LYS 49 2HD LYS 49 7.156 -15.054 10.183 416 HD3 LYS 49 3HD LYS 49 6.910 -16.405 11.287 417 HE2 LYS 49 2HE LYS 49 9.135 -16.471 10.201 418 HE3 LYS 49 3HE LYS 49 8.167 -17.893 9.825 419 HZ1 LYS 49 3HZ LYS 49 7.738 -17.067 7.655 420 HZ2 LYS 49 1HZ LYS 49 9.403 -16.944 7.919 421 HZ3 LYS 49 2HZ LYS 49 8.428 -15.563 8.002 422 H GLN 50 H GLN 50 2.670 -14.402 7.987 423 HA GLN 50 HA GLN 50 1.052 -15.871 9.844 424 HB2 GLN 50 2HB GLN 50 0.550 -13.185 8.485 425 HB3 GLN 50 3HB GLN 50 -0.419 -13.827 9.805 426 HG2 GLN 50 2HG GLN 50 2.506 -13.056 9.944 427 HG3 GLN 50 3HG GLN 50 1.146 -12.148 10.609 428 HE21 GLN 50 1HE2 GLN 50 0.048 -13.015 12.445 429 HE22 GLN 50 2HE2 GLN 50 0.810 -14.167 13.481 430 H GLY 51 H GLY 51 1.022 -15.549 6.415 431 HA2 GLY 51 2HA GLY 51 -0.287 -16.556 4.800 432 HA3 GLY 51 3HA GLY 51 -1.255 -17.280 6.075 433 H ARG 52 H ARG 52 -0.666 -13.869 5.960 434 HA ARG 52 HA ARG 52 -3.499 -13.308 5.284 435 HB2 ARG 52 2HB ARG 52 -1.801 -11.945 7.435 436 HB3 ARG 52 3HB ARG 52 -3.477 -11.569 7.047 437 HG2 ARG 52 2HG ARG 52 -4.205 -13.742 7.890 438 HG3 ARG 52 3HG ARG 52 -2.531 -14.227 8.162 439 HD2 ARG 52 2HD ARG 52 -2.300 -12.348 9.799 440 HD3 ARG 52 3HD ARG 52 -4.023 -12.003 9.589 441 HE ARG 52 HE ARG 52 -3.708 -14.716 10.302 442 HH11 ARG 52 1HH1 ARG 52 -3.355 -11.530 11.746 443 HH12 ARG 52 2HH1 ARG 52 -3.668 -12.092 13.359 444 HH21 ARG 52 1HH2 ARG 52 -4.082 -15.441 12.441 445 HH22 ARG 52 2HH2 ARG 52 -4.078 -14.302 13.748 446 HA PRO 53 HA PRO 53 -1.782 -10.022 2.600 447 HB2 PRO 53 2HB PRO 53 -4.025 -8.262 3.582 448 HB3 PRO 53 3HB PRO 53 -3.604 -8.741 1.922 449 HG2 PRO 53 2HG PRO 53 -5.745 -9.780 3.115 450 HG3 PRO 53 3HG PRO 53 -4.711 -10.784 2.070 451 HD2 PRO 53 2HD PRO 53 -4.777 -10.651 5.087 452 HD3 PRO 53 3HD PRO 53 -4.685 -12.076 4.022 453 H ILE 54 H ILE 54 -1.248 -7.590 2.796 454 HA ILE 54 HA ILE 54 -0.609 -6.709 5.531 455 HB ILE 54 HB ILE 54 1.404 -7.867 4.899 456 HG12 ILE 54 2HG1 ILE 54 1.824 -4.869 4.538 457 HG13 ILE 54 3HG1 ILE 54 1.776 -5.732 6.071 458 HG21 ILE 54 1HG2 ILE 54 1.081 -7.999 2.464 459 HG22 ILE 54 2HG2 ILE 54 2.704 -7.434 2.855 460 HG23 ILE 54 3HG2 ILE 54 1.479 -6.286 2.307 461 HD11 ILE 54 3HD1 ILE 54 4.029 -5.211 5.486 462 HD12 ILE 54 1HD1 ILE 54 3.860 -5.998 3.919 463 HD13 ILE 54 2HD1 ILE 54 3.803 -6.956 5.401 464 H VAL 55 H VAL 55 -0.751 -4.542 5.784 465 HA VAL 55 HA VAL 55 -1.225 -2.849 3.405 466 HB VAL 55 HB VAL 55 -2.409 -2.242 6.153 467 HG11 VAL 55 1HG1 VAL 55 -3.209 -1.369 3.350 468 HG12 VAL 55 2HG1 VAL 55 -2.336 -0.394 4.536 469 HG13 VAL 55 3HG1 VAL 55 -4.003 -0.881 4.852 470 HG21 VAL 55 3HG2 VAL 55 -3.266 -4.458 5.536 471 HG22 VAL 55 1HG2 VAL 55 -3.791 -3.849 3.969 472 HG23 VAL 55 2HG2 VAL 55 -4.547 -3.253 5.448 473 H ILE 56 H ILE 56 0.599 -1.683 3.123 474 HA ILE 56 HA ILE 56 2.149 -0.704 5.446 475 HB ILE 56 HB ILE 56 2.880 -0.909 2.486 476 HG12 ILE 56 2HG1 ILE 56 2.927 -3.054 3.797 477 HG13 ILE 56 3HG1 ILE 56 4.508 -2.592 3.185 478 HG21 ILE 56 1HG2 ILE 56 4.584 0.224 4.745 479 HG22 ILE 56 2HG2 ILE 56 3.911 1.127 3.387 480 HG23 ILE 56 3HG2 ILE 56 5.140 -0.097 3.101 481 HD11 ILE 56 3HD1 ILE 56 4.670 -3.465 5.446 482 HD12 ILE 56 1HD1 ILE 56 3.535 -2.246 6.027 483 HD13 ILE 56 2HD1 ILE 56 5.121 -1.762 5.423 484 H PHE 57 H PHE 57 1.925 1.368 6.045 485 HA PHE 57 HA PHE 57 0.572 3.281 4.261 486 HB2 PHE 57 2HB PHE 57 1.045 3.252 7.264 487 HB3 PHE 57 3HB PHE 57 0.477 4.694 6.421 488 HD1 PHE 57 HD2 PHE 57 -0.360 1.044 6.846 489 HD2 PHE 57 HD1 PHE 57 -1.845 4.993 6.137 490 HE1 PHE 57 HE2 PHE 57 -2.671 0.207 6.930 491 HE2 PHE 57 HE1 PHE 57 -4.149 4.141 6.235 492 HZ PHE 57 HZ PHE 57 -4.555 1.752 6.602 493 H ILE 58 H ILE 58 1.760 4.534 3.092 494 HA ILE 58 HA ILE 58 4.427 5.523 3.962 495 HB ILE 58 HB ILE 58 3.424 4.888 1.131 496 HG12 ILE 58 2HG1 ILE 58 4.029 2.866 2.505 497 HG13 ILE 58 3HG1 ILE 58 5.028 3.059 1.073 498 HG21 ILE 58 1HG2 ILE 58 4.906 6.816 1.040 499 HG22 ILE 58 2HG2 ILE 58 5.720 5.416 0.348 500 HG23 ILE 58 3HG2 ILE 58 6.136 5.964 1.974 501 HD11 ILE 58 3HD1 ILE 58 5.821 3.740 3.899 502 HD12 ILE 58 1HD1 ILE 58 6.829 3.970 2.469 503 HD13 ILE 58 2HD1 ILE 58 6.350 2.347 2.958 504 H ARG 59 H ARG 59 4.856 7.769 3.480 505 HA ARG 59 HA ARG 59 2.507 9.424 2.837 506 HB2 ARG 59 2HB ARG 59 4.048 9.916 4.815 507 HB3 ARG 59 3HB ARG 59 5.284 10.368 3.645 508 HG2 ARG 59 2HG ARG 59 3.799 12.155 2.781 509 HG3 ARG 59 3HG ARG 59 2.575 11.698 3.967 510 HD2 ARG 59 2HD ARG 59 4.206 12.240 5.796 511 HD3 ARG 59 3HD ARG 59 5.345 12.803 4.567 512 HE ARG 59 HE ARG 59 3.121 14.239 4.027 513 HH11 ARG 59 1HH1 ARG 59 4.996 13.806 6.975 514 HH12 ARG 59 2HH1 ARG 59 4.578 15.368 7.607 515 HH21 ARG 59 1HH2 ARG 59 2.494 16.226 4.898 516 HH22 ARG 59 2HH2 ARG 59 3.150 16.748 6.422 517 H GLY 60 H GLY 60 2.636 11.067 1.165 518 HA2 GLY 60 2HA GLY 60 3.110 10.015 -1.326 519 HA3 GLY 60 3HA GLY 60 2.901 11.726 -1.012 520 H ALA 61 H ALA 61 5.339 12.137 0.463 521 HA ALA 61 HA ALA 61 7.174 12.627 -1.677 522 HB1 ALA 61 3HB ALA 61 7.617 12.789 1.322 523 HB2 ALA 61 1HB ALA 61 7.027 14.091 0.288 524 HB3 ALA 61 2HB ALA 61 8.672 13.483 0.088 525 H TYR 62 H TYR 62 6.982 10.253 0.889 526 HA TYR 62 HA TYR 62 9.510 9.003 0.453 527 HB2 TYR 62 2HB TYR 62 7.093 8.005 2.006 528 HB3 TYR 62 3HB TYR 62 8.699 7.282 2.052 529 HD1 TYR 62 HD2 TYR 62 10.616 9.322 2.491 530 HD2 TYR 62 HD1 TYR 62 6.605 9.193 3.954 531 HE1 TYR 62 HE2 TYR 62 11.235 10.798 4.353 532 HE2 TYR 62 HE1 TYR 62 7.231 10.669 5.816 533 HH TYR 62 HH TYR 62 9.338 11.237 7.067 534 H GLU 63 H GLU 63 6.426 8.653 -1.079 535 HA GLU 63 HA GLU 63 6.159 5.935 -1.467 536 HB2 GLU 63 2HB GLU 63 4.416 7.682 -2.000 537 HB3 GLU 63 3HB GLU 63 5.270 8.012 -3.505 538 HG2 GLU 63 2HG GLU 63 4.996 5.477 -4.006 539 HG3 GLU 63 3HG GLU 63 3.835 5.474 -2.679 540 H GLU 64 H GLU 64 8.307 8.073 -3.276 541 HA GLU 64 HA GLU 64 8.839 6.535 -5.535 542 HB2 GLU 64 2HB GLU 64 11.135 7.616 -5.495 543 HB3 GLU 64 3HB GLU 64 9.762 8.713 -5.414 544 HG2 GLU 64 2HG GLU 64 10.080 8.894 -2.941 545 HG3 GLU 64 3HG GLU 64 11.506 7.863 -3.084 546 H VAL 65 H VAL 65 9.962 6.029 -2.259 547 HA VAL 65 HA VAL 65 11.860 3.982 -2.564 548 HB VAL 65 HB VAL 65 9.900 4.577 -0.312 549 HG11 VAL 65 1HG1 VAL 65 12.247 2.683 -0.189 550 HG12 VAL 65 2HG1 VAL 65 10.540 2.250 -0.073 551 HG13 VAL 65 3HG1 VAL 65 11.290 3.220 1.194 552 HG21 VAL 65 3HG2 VAL 65 12.845 5.263 -0.579 553 HG22 VAL 65 1HG2 VAL 65 11.816 5.654 0.801 554 HG23 VAL 65 2HG2 VAL 65 11.499 6.389 -0.771 555 H VAL 66 H VAL 66 8.308 3.873 -2.510 556 HA VAL 66 HA VAL 66 7.885 1.147 -2.075 557 HB VAL 66 HB VAL 66 6.091 3.057 -3.643 558 HG11 VAL 66 1HG1 VAL 66 4.232 1.504 -3.088 559 HG12 VAL 66 2HG1 VAL 66 5.386 0.376 -2.372 560 HG13 VAL 66 3HG1 VAL 66 5.450 0.728 -4.099 561 HG21 VAL 66 3HG2 VAL 66 6.058 2.317 -0.687 562 HG22 VAL 66 1HG2 VAL 66 4.882 3.353 -1.502 563 HG23 VAL 66 2HG2 VAL 66 6.562 3.866 -1.365 564 H ARG 67 H ARG 67 8.619 2.862 -5.080 565 HA ARG 67 HA ARG 67 8.136 0.912 -7.023 566 HB2 ARG 67 2HB ARG 67 8.855 3.205 -7.568 567 HB3 ARG 67 3HB ARG 67 10.437 2.909 -6.864 568 HG2 ARG 67 2HG ARG 67 10.882 1.225 -8.644 569 HG3 ARG 67 3HG ARG 67 9.310 1.595 -9.360 570 HD2 ARG 67 2HD ARG 67 11.074 2.791 -10.562 571 HD3 ARG 67 3HD ARG 67 10.045 3.947 -9.716 572 HE ARG 67 HE ARG 67 11.787 4.254 -8.083 573 HH11 ARG 67 1HH1 ARG 67 12.836 2.515 -10.954 574 HH12 ARG 67 2HH1 ARG 67 14.514 2.866 -10.692 575 HH21 ARG 67 1HH2 ARG 67 13.987 4.677 -7.744 576 HH22 ARG 67 2HH2 ARG 67 15.165 4.089 -8.874 577 H ASP 68 H ASP 68 10.904 1.300 -4.881 578 HA ASP 68 HA ASP 68 12.455 -0.904 -5.907 579 HB2 ASP 68 2HB ASP 68 13.517 1.065 -4.858 580 HB3 ASP 68 3HB ASP 68 12.704 0.727 -3.331 581 H ILE 69 H ILE 69 10.115 -0.431 -3.296 582 HA ILE 69 HA ILE 69 10.502 -2.900 -1.914 583 HB ILE 69 HB ILE 69 7.947 -1.229 -2.055 584 HG12 ILE 69 2HG1 ILE 69 9.765 0.199 -1.294 585 HG13 ILE 69 3HG1 ILE 69 8.734 -0.177 0.076 586 HG21 ILE 69 1HG2 ILE 69 7.353 -2.263 0.094 587 HG22 ILE 69 2HG2 ILE 69 8.811 -3.255 0.044 588 HG23 ILE 69 3HG2 ILE 69 7.542 -3.484 -1.161 589 HD11 ILE 69 3HD1 ILE 69 11.059 -0.191 0.703 590 HD12 ILE 69 1HD1 ILE 69 11.424 -1.401 -0.525 591 HD13 ILE 69 2HD1 ILE 69 10.395 -1.816 0.848 592 H VAL 70 H VAL 70 8.500 -1.908 -4.620 593 HA VAL 70 HA VAL 70 6.806 -4.083 -5.001 594 HB VAL 70 HB VAL 70 8.075 -2.135 -6.987 595 HG11 VAL 70 1HG1 VAL 70 5.904 -4.175 -7.585 596 HG12 VAL 70 2HG1 VAL 70 7.547 -4.170 -8.233 597 HG13 VAL 70 3HG1 VAL 70 6.431 -2.880 -8.667 598 HG21 VAL 70 3HG2 VAL 70 5.235 -2.287 -5.889 599 HG22 VAL 70 1HG2 VAL 70 5.835 -1.096 -7.045 600 HG23 VAL 70 2HG2 VAL 70 6.469 -1.127 -5.402 601 H GLU 71 H GLU 71 10.163 -3.574 -5.991 602 HA GLU 71 HA GLU 71 10.528 -5.796 -7.660 603 HB2 GLU 71 2HB GLU 71 12.091 -3.858 -7.454 604 HB3 GLU 71 3HB GLU 71 12.584 -4.436 -5.870 605 HG2 GLU 71 2HG GLU 71 14.258 -5.033 -7.515 606 HG3 GLU 71 3HG GLU 71 13.482 -6.493 -6.906 607 H TYR 72 H TYR 72 10.930 -5.449 -4.133 608 HA TYR 72 HA TYR 72 11.866 -8.091 -3.589 609 HB2 TYR 72 2HB TYR 72 12.144 -6.235 -1.968 610 HB3 TYR 72 3HB TYR 72 10.402 -6.139 -1.752 611 HD1 TYR 72 HD2 TYR 72 9.199 -7.914 -0.453 612 HD2 TYR 72 HD1 TYR 72 13.455 -8.003 -0.853 613 HE1 TYR 72 HE2 TYR 72 9.343 -9.500 1.408 614 HE2 TYR 72 HE1 TYR 72 13.593 -9.590 1.017 615 HH TYR 72 HH TYR 72 12.197 -10.203 3.019 616 H ALA 73 H ALA 73 8.633 -6.615 -3.542 617 HA ALA 73 HA ALA 73 7.158 -8.838 -2.636 618 HB1 ALA 73 3HB ALA 73 6.273 -6.547 -2.636 619 HB2 ALA 73 1HB ALA 73 5.184 -7.638 -3.501 620 HB3 ALA 73 2HB ALA 73 6.239 -6.540 -4.398 621 H GLN 74 H GLN 74 8.296 -7.920 -5.838 622 HA GLN 74 HA GLN 74 6.893 -9.925 -7.328 623 HB2 GLN 74 2HB GLN 74 9.271 -8.151 -7.996 624 HB3 GLN 74 3HB GLN 74 8.671 -9.364 -9.124 625 HG2 GLN 74 2HG GLN 74 6.411 -8.221 -9.025 626 HG3 GLN 74 3HG GLN 74 7.179 -6.941 -8.079 627 HE21 GLN 74 1HE2 GLN 74 6.640 -5.426 -9.752 628 HE22 GLN 74 2HE2 GLN 74 7.534 -5.364 -11.225 629 H LYS 75 H LYS 75 10.002 -9.867 -5.612 630 HA LYS 75 HA LYS 75 11.118 -12.298 -6.579 631 HB2 LYS 75 2HB LYS 75 11.352 -11.330 -3.689 632 HB3 LYS 75 3HB LYS 75 12.452 -12.409 -4.535 633 HG2 LYS 75 2HG LYS 75 12.062 -9.458 -4.983 634 HG3 LYS 75 3HG LYS 75 13.486 -10.262 -4.324 635 HD2 LYS 75 2HD LYS 75 13.882 -11.333 -6.532 636 HD3 LYS 75 3HD LYS 75 12.452 -10.519 -7.176 637 HE2 LYS 75 2HE LYS 75 13.551 -8.317 -6.596 638 HE3 LYS 75 3HE LYS 75 15.021 -9.225 -6.217 639 HZ1 LYS 75 3HZ LYS 75 15.047 -8.374 -8.475 640 HZ2 LYS 75 1HZ LYS 75 13.620 -9.201 -8.831 641 HZ3 LYS 75 2HZ LYS 75 15.031 -10.062 -8.483 642 H GLU 76 H GLU 76 9.026 -11.563 -3.858 643 HA GLU 76 HA GLU 76 8.562 -14.219 -2.955 644 HB2 GLU 76 2HB GLU 76 6.874 -11.719 -2.467 645 HB3 GLU 76 3HB GLU 76 6.892 -13.181 -1.485 646 HG2 GLU 76 2HG GLU 76 9.145 -11.178 -1.796 647 HG3 GLU 76 3HG GLU 76 8.124 -11.391 -0.378 648 H GLY 77 H GLY 77 7.206 -12.304 -5.503 649 HA2 GLY 77 2HA GLY 77 5.801 -12.893 -7.232 650 HA3 GLY 77 3HA GLY 77 5.622 -14.485 -6.505 651 H LEU 78 H LEU 78 5.036 -11.661 -4.601 652 HA LEU 78 HA LEU 78 2.274 -12.408 -4.145 653 HB2 LEU 78 2HB LEU 78 3.908 -10.114 -2.984 654 HB3 LEU 78 3HB LEU 78 2.319 -10.624 -2.428 655 HG LEU 78 HG LEU 78 4.891 -12.231 -2.223 656 HD11 LEU 78 1HD1 LEU 78 4.820 -10.392 -0.639 657 HD12 LEU 78 2HD1 LEU 78 4.656 -11.931 0.200 658 HD13 LEU 78 3HD1 LEU 78 3.236 -10.913 -0.058 659 HD21 LEU 78 3HD2 LEU 78 3.039 -13.766 -2.590 660 HD22 LEU 78 1HD2 LEU 78 2.113 -13.006 -1.293 661 HD23 LEU 78 2HD2 LEU 78 3.601 -13.883 -0.926 662 H ARG 79 H ARG 79 0.517 -10.990 -4.388 663 HA ARG 79 HA ARG 79 0.452 -9.473 -6.820 664 HB2 ARG 79 2HB ARG 79 -1.418 -10.899 -5.703 665 HB3 ARG 79 3HB ARG 79 -1.678 -9.535 -4.634 666 HG2 ARG 79 2HG ARG 79 -1.889 -9.340 -7.650 667 HG3 ARG 79 3HG ARG 79 -3.250 -9.751 -6.618 668 HD2 ARG 79 2HD ARG 79 -3.046 -7.542 -5.493 669 HD3 ARG 79 3HD ARG 79 -1.697 -7.134 -6.560 670 HE ARG 79 HE ARG 79 -4.527 -7.394 -7.307 671 HH11 ARG 79 1HH1 ARG 79 -1.247 -6.586 -8.300 672 HH12 ARG 79 2HH1 ARG 79 -1.759 -5.857 -9.787 673 HH21 ARG 79 1HH2 ARG 79 -5.159 -6.518 -9.311 674 HH22 ARG 79 2HH2 ARG 79 -3.963 -5.819 -10.356 675 H VAL 80 H VAL 80 0.959 -7.326 -7.005 676 HA VAL 80 HA VAL 80 1.474 -5.775 -4.541 677 HB VAL 80 HB VAL 80 2.679 -5.154 -7.290 678 HG11 VAL 80 1HG1 VAL 80 3.532 -4.369 -4.473 679 HG12 VAL 80 2HG1 VAL 80 2.697 -3.332 -5.632 680 HG13 VAL 80 3HG1 VAL 80 4.335 -3.887 -5.972 681 HG21 VAL 80 3HG2 VAL 80 3.390 -7.439 -6.726 682 HG22 VAL 80 1HG2 VAL 80 3.952 -6.898 -5.142 683 HG23 VAL 80 2HG2 VAL 80 4.748 -6.320 -6.609 684 H LEU 81 H LEU 81 0.095 -4.193 -4.199 685 HA LEU 81 HA LEU 81 -1.264 -2.783 -6.399 686 HB2 LEU 81 2HB LEU 81 -2.719 -4.624 -5.384 687 HB3 LEU 81 3HB LEU 81 -2.625 -3.759 -3.859 688 HG LEU 81 HG LEU 81 -3.694 -1.757 -5.086 689 HD11 LEU 81 1HD1 LEU 81 -3.294 -2.462 -7.383 690 HD12 LEU 81 2HD1 LEU 81 -5.018 -2.269 -7.092 691 HD13 LEU 81 3HD1 LEU 81 -4.309 -3.888 -7.155 692 HD21 LEU 81 3HD2 LEU 81 -5.301 -4.301 -4.729 693 HD22 LEU 81 1HD2 LEU 81 -5.967 -2.667 -4.816 694 HD23 LEU 81 2HD2 LEU 81 -4.918 -3.117 -3.478 695 H VAL 82 H VAL 82 -0.481 -0.734 -6.130 696 HA VAL 82 HA VAL 82 0.006 0.283 -3.381 697 HB VAL 82 HB VAL 82 0.953 1.469 -6.049 698 HG11 VAL 82 1HG1 VAL 82 0.797 3.149 -4.263 699 HG12 VAL 82 2HG1 VAL 82 2.484 2.826 -4.649 700 HG13 VAL 82 3HG1 VAL 82 1.771 2.141 -3.187 701 HG21 VAL 82 3HG2 VAL 82 3.175 0.523 -5.520 702 HG22 VAL 82 1HG2 VAL 82 1.965 -0.749 -5.686 703 HG23 VAL 82 2HG2 VAL 82 2.516 -0.261 -4.083 704 H ILE 83 H ILE 83 -1.694 1.371 -2.593 705 HA ILE 83 HA ILE 83 -3.573 2.782 -4.399 706 HB ILE 83 HB ILE 83 -3.975 1.928 -1.477 707 HG12 ILE 83 2HG1 ILE 83 -5.006 0.558 -4.013 708 HG13 ILE 83 3HG1 ILE 83 -3.656 -0.021 -3.043 709 HG21 ILE 83 1HG2 ILE 83 -6.378 2.370 -1.899 710 HG22 ILE 83 2HG2 ILE 83 -6.009 2.896 -3.541 711 HG23 ILE 83 3HG2 ILE 83 -5.419 3.827 -2.163 712 HD11 ILE 83 3HD1 ILE 83 -5.658 -1.278 -2.564 713 HD12 ILE 83 1HD1 ILE 83 -6.518 0.196 -2.120 714 HD13 ILE 83 2HD1 ILE 83 -5.160 -0.366 -1.139 715 H LYS 84 H LYS 84 -2.968 4.900 -4.551 716 HA LYS 84 HA LYS 84 -2.201 6.371 -2.102 717 HB2 LYS 84 2HB LYS 84 -0.745 7.817 -3.525 718 HB3 LYS 84 3HB LYS 84 -0.175 6.169 -3.334 719 HG2 LYS 84 2HG LYS 84 -0.325 5.696 -5.549 720 HG3 LYS 84 3HG LYS 84 -1.799 6.642 -5.777 721 HD2 LYS 84 2HD LYS 84 -0.597 8.684 -5.997 722 HD3 LYS 84 3HD LYS 84 0.884 7.998 -5.317 723 HE2 LYS 84 2HE LYS 84 -0.296 7.034 -7.932 724 HE3 LYS 84 3HE LYS 84 0.842 8.376 -7.834 725 HZ1 LYS 84 3HZ LYS 84 2.467 6.929 -6.827 726 HZ2 LYS 84 1HZ LYS 84 1.951 6.255 -8.297 727 HZ3 LYS 84 2HZ LYS 84 1.383 5.641 -6.825 728 H VAL 85 H VAL 85 -3.091 8.317 -1.780 729 HA VAL 85 HA VAL 85 -5.298 9.130 -3.504 730 HB VAL 85 HB VAL 85 -4.332 10.363 -0.866 731 HG11 VAL 85 1HG1 VAL 85 -5.623 11.977 -2.186 732 HG12 VAL 85 2HG1 VAL 85 -6.549 11.472 -0.773 733 HG13 VAL 85 3HG1 VAL 85 -6.941 10.815 -2.364 734 HG21 VAL 85 3HG2 VAL 85 -6.215 9.163 0.213 735 HG22 VAL 85 1HG2 VAL 85 -5.062 8.044 -0.516 736 HG23 VAL 85 2HG2 VAL 85 -6.596 8.380 -1.322 737 H ALA 86 H ALA 86 -4.614 10.138 -5.291 738 HA ALA 86 HA ALA 86 -2.718 12.384 -5.206 739 HB1 ALA 86 3HB ALA 86 -4.312 11.176 -7.512 740 HB2 ALA 86 1HB ALA 86 -2.626 10.827 -7.122 741 HB3 ALA 86 2HB ALA 86 -3.088 12.441 -7.661 742 H GLN 87 H GLN 87 -3.785 14.244 -6.833 743 HA GLN 87 HA GLN 87 -6.649 14.676 -6.422 744 HB2 GLN 87 2HB GLN 87 -4.537 16.722 -5.574 745 HB3 GLN 87 3HB GLN 87 -6.222 17.135 -5.849 746 HG2 GLN 87 2HG GLN 87 -6.864 15.578 -4.012 747 HG3 GLN 87 3HG GLN 87 -5.155 15.289 -3.696 748 HE21 GLN 87 1HE2 GLN 87 -7.754 17.595 -3.472 749 HE22 GLN 87 2HE2 GLN 87 -6.952 18.698 -2.411 750 H ASP 88 H ASP 88 -5.342 13.789 -8.663 751 HA ASP 88 HA ASP 88 -4.659 14.090 -10.783 752 HB2 ASP 88 2HB ASP 88 -6.453 16.526 -10.496 753 HB3 ASP 88 3HB ASP 88 -5.566 16.240 -11.988 754 H GLN 89 H GLN 89 -2.488 14.202 -10.530 755 HA GLN 89 HA GLN 89 -1.215 16.834 -10.096 756 HB2 GLN 89 2HB GLN 89 -1.559 15.139 -8.008 757 HB3 GLN 89 3HB GLN 89 -0.090 14.434 -8.651 758 HG2 GLN 89 2HG GLN 89 -0.411 17.332 -7.813 759 HG3 GLN 89 3HG GLN 89 0.280 16.065 -6.806 760 HE21 GLN 89 1HE2 GLN 89 1.493 18.544 -7.725 761 HE22 GLN 89 2HE2 GLN 89 2.920 18.094 -8.586 762 H GLU 90 H GLU 90 0.225 17.173 -11.626 763 HA GLU 90 HA GLU 90 0.602 15.494 -13.825 764 HB2 GLU 90 2HB GLU 90 2.245 17.935 -13.013 765 HB3 GLU 90 3HB GLU 90 2.177 17.241 -14.631 766 HG2 GLU 90 2HG GLU 90 -0.120 17.895 -14.911 767 HG3 GLU 90 3HG GLU 90 -0.265 18.336 -13.210 768 H LEU 91 H LEU 91 2.974 16.461 -11.350 769 HA LEU 91 HA LEU 91 5.203 15.022 -12.288 770 HB2 LEU 91 2HB LEU 91 5.345 16.896 -10.693 771 HB3 LEU 91 3HB LEU 91 4.501 15.952 -9.475 772 HG LEU 91 HG LEU 91 6.446 14.365 -9.404 773 HD11 LEU 91 1HD1 LEU 91 7.335 14.699 -11.652 774 HD12 LEU 91 2HD1 LEU 91 8.580 14.971 -10.438 775 HD13 LEU 91 3HD1 LEU 91 7.819 16.347 -11.242 776 HD21 LEU 91 3HD2 LEU 91 6.270 16.174 -7.753 777 HD22 LEU 91 1HD2 LEU 91 7.157 17.263 -8.822 778 HD23 LEU 91 2HD2 LEU 91 7.956 15.843 -8.141 779 H LEU 92 H LEU 92 2.638 14.184 -10.083 780 HA LEU 92 HA LEU 92 3.645 11.791 -8.981 781 HB2 LEU 92 2HB LEU 92 1.961 13.053 -7.863 782 HB3 LEU 92 3HB LEU 92 0.882 13.024 -9.236 783 HG LEU 92 HG LEU 92 1.512 10.377 -7.910 784 HD11 LEU 92 1HD1 LEU 92 -0.226 10.711 -6.197 785 HD12 LEU 92 2HD1 LEU 92 -0.411 12.396 -6.693 786 HD13 LEU 92 3HD1 LEU 92 1.107 11.844 -5.983 787 HD21 LEU 92 3HD2 LEU 92 -0.841 9.876 -8.506 788 HD22 LEU 92 1HD2 LEU 92 0.068 10.416 -9.915 789 HD23 LEU 92 2HD2 LEU 92 -1.050 11.520 -9.114 790 H GLU 93 H GLU 93 1.869 12.491 -11.950 791 HA GLU 93 HA GLU 93 0.979 9.880 -12.592 792 HB2 GLU 93 2HB GLU 93 1.587 12.252 -14.379 793 HB3 GLU 93 3HB GLU 93 0.838 10.765 -14.959 794 HG2 GLU 93 2HG GLU 93 -1.091 11.136 -13.483 795 HG3 GLU 93 3HG GLU 93 -0.331 12.597 -12.850 796 H ARG 94 H ARG 94 4.091 11.462 -13.128 797 HA ARG 94 HA ARG 94 5.141 9.668 -15.043 798 HB2 ARG 94 2HB ARG 94 6.276 11.790 -14.587 799 HB3 ARG 94 3HB ARG 94 6.593 11.315 -12.920 800 HG2 ARG 94 2HG ARG 94 8.620 11.113 -14.310 801 HG3 ARG 94 3HG ARG 94 8.118 9.543 -13.683 802 HD2 ARG 94 2HD ARG 94 6.943 9.201 -15.972 803 HD3 ARG 94 3HD ARG 94 7.871 10.598 -16.516 804 HE ARG 94 HE ARG 94 9.866 9.372 -16.256 805 HH11 ARG 94 1HH1 ARG 94 7.027 7.364 -15.664 806 HH12 ARG 94 2HH1 ARG 94 7.901 5.877 -15.860 807 HH21 ARG 94 1HH2 ARG 94 10.986 7.415 -16.465 808 HH22 ARG 94 2HH2 ARG 94 10.142 5.903 -16.312 809 H PHE 95 H PHE 95 5.303 9.674 -11.493 810 HA PHE 95 HA PHE 95 6.715 7.207 -11.257 811 HB2 PHE 95 2HB PHE 95 6.733 8.912 -9.445 812 HB3 PHE 95 3HB PHE 95 5.007 8.657 -9.175 813 HD1 PHE 95 HD2 PHE 95 8.298 6.872 -9.158 814 HD2 PHE 95 HD1 PHE 95 4.292 6.940 -7.647 815 HE1 PHE 95 HE2 PHE 95 8.825 5.020 -7.650 816 HE2 PHE 95 HE1 PHE 95 4.838 5.065 -6.149 817 HZ PHE 95 HZ PHE 95 7.106 4.107 -6.146 818 H TYR 96 H TYR 96 3.291 8.097 -11.028 819 HA TYR 96 HA TYR 96 2.147 5.668 -10.288 820 HB2 TYR 96 2HB TYR 96 0.747 7.585 -10.206 821 HB3 TYR 96 3HB TYR 96 1.133 8.060 -11.857 822 HD1 TYR 96 HD1 TYR 96 -0.609 5.338 -9.922 823 HD2 TYR 96 HD2 TYR 96 -0.411 7.542 -13.592 824 HE1 TYR 96 HE1 TYR 96 -2.618 4.195 -10.725 825 HE2 TYR 96 HE2 TYR 96 -2.435 6.390 -14.391 826 HH TYR 96 HH TYR 96 -3.651 4.331 -13.990 827 H GLU 97 H GLU 97 2.869 6.916 -13.553 828 HA GLU 97 HA GLU 97 1.697 4.720 -14.948 829 HB2 GLU 97 2HB GLU 97 2.052 7.069 -15.863 830 HB3 GLU 97 3HB GLU 97 3.761 6.670 -16.052 831 HG2 GLU 97 2HG GLU 97 3.200 4.877 -17.615 832 HG3 GLU 97 3HG GLU 97 1.473 5.155 -17.379 833 H GLN 98 H GLN 98 4.838 5.315 -13.551 834 HA GLN 98 HA GLN 98 6.510 3.635 -15.041 835 HB2 GLN 98 2HB GLN 98 7.103 5.316 -13.139 836 HB3 GLN 98 3HB GLN 98 6.749 4.015 -12.019 837 HG2 GLN 98 2HG GLN 98 8.928 4.024 -14.130 838 HG3 GLN 98 3HG GLN 98 9.161 4.255 -12.403 839 HE21 GLN 98 1HE2 GLN 98 8.561 1.927 -14.932 840 HE22 GLN 98 2HE2 GLN 98 8.842 0.516 -13.970 841 H LEU 99 H LEU 99 4.608 2.896 -12.088 842 HA LEU 99 HA LEU 99 5.406 0.167 -11.914 843 HB2 LEU 99 2HB LEU 99 2.985 1.535 -10.681 844 HB3 LEU 99 3HB LEU 99 3.480 -0.105 -10.321 845 HG LEU 99 HG LEU 99 5.714 0.934 -9.486 846 HD11 LEU 99 1HD1 LEU 99 5.480 3.152 -10.433 847 HD12 LEU 99 2HD1 LEU 99 5.578 3.253 -8.676 848 HD13 LEU 99 3HD1 LEU 99 4.017 3.439 -9.488 849 HD21 LEU 99 3HD2 LEU 99 4.047 -0.054 -7.992 850 HD22 LEU 99 1HD2 LEU 99 3.157 1.470 -7.942 851 HD23 LEU 99 2HD2 LEU 99 4.782 1.365 -7.254 852 H LYS 100 H LYS 100 2.546 1.798 -13.243 853 HA LYS 100 HA LYS 100 1.069 -0.483 -13.991 854 HB2 LYS 100 2HB LYS 100 1.042 2.398 -14.959 855 HB3 LYS 100 3HB LYS 100 -0.029 1.198 -15.670 856 HG2 LYS 100 2HG LYS 100 -0.058 1.490 -12.676 857 HG3 LYS 100 3HG LYS 100 -0.788 2.767 -13.642 858 HD2 LYS 100 2HD LYS 100 -2.480 1.132 -12.935 859 HD3 LYS 100 3HD LYS 100 -2.318 1.155 -14.688 860 HE2 LYS 100 2HE LYS 100 -0.900 -0.906 -14.529 861 HE3 LYS 100 3HE LYS 100 -1.213 -0.945 -12.796 862 HZ1 LYS 100 3HZ LYS 100 -3.585 -1.176 -13.293 863 HZ2 LYS 100 1HZ LYS 100 -2.689 -2.439 -13.968 864 HZ3 LYS 100 2HZ LYS 100 -3.252 -1.181 -14.947 865 H LYS 101 H LYS 101 3.594 1.293 -15.651 866 HA LYS 101 HA LYS 101 3.327 0.082 -18.232 867 HB2 LYS 101 2HB LYS 101 4.340 2.310 -17.893 868 HB3 LYS 101 3HB LYS 101 5.652 1.601 -16.960 869 HG2 LYS 101 2HG LYS 101 6.523 0.494 -18.921 870 HG3 LYS 101 3HG LYS 101 5.127 0.990 -19.883 871 HD2 LYS 101 2HD LYS 101 5.790 3.370 -19.602 872 HD3 LYS 101 3HD LYS 101 7.191 2.863 -18.648 873 HE2 LYS 101 2HE LYS 101 7.756 3.395 -21.012 874 HE3 LYS 101 3HE LYS 101 8.153 1.733 -20.574 875 HZ1 LYS 101 3HZ LYS 101 6.212 0.960 -21.702 876 HZ2 LYS 101 1HZ LYS 101 7.067 1.951 -22.766 877 HZ3 LYS 101 2HZ LYS 101 5.673 2.534 -22.005 878 H ASP 102 H ASP 102 5.281 -0.551 -15.354 879 HA ASP 102 HA ASP 102 6.826 -2.741 -16.330 880 HB2 ASP 102 2HB ASP 102 7.413 -1.525 -14.257 881 HB3 ASP 102 3HB ASP 102 5.919 -2.055 -13.490 882 H GLY 103 H GLY 103 3.712 -2.506 -14.681 883 HA2 GLY 103 2HA GLY 103 2.039 -4.156 -15.771 884 HA3 GLY 103 3HA GLY 103 3.096 -5.369 -15.054 885 H VAL 104 H VAL 104 3.531 -3.264 -12.861 886 HA VAL 104 HA VAL 104 1.884 -4.450 -10.892 887 HB VAL 104 HB VAL 104 3.544 -1.890 -10.755 888 HG11 VAL 104 1HG1 VAL 104 3.631 -2.267 -8.305 889 HG12 VAL 104 2HG1 VAL 104 2.521 -3.629 -8.472 890 HG13 VAL 104 3HG1 VAL 104 1.979 -1.998 -8.866 891 HG21 VAL 104 3HG2 VAL 104 4.808 -3.889 -11.499 892 HG22 VAL 104 1HG2 VAL 104 4.345 -4.717 -10.006 893 HG23 VAL 104 2HG2 VAL 104 5.358 -3.271 -9.946 894 H ASP 105 H ASP 105 -0.018 -3.812 -10.021 895 HA ASP 105 HA ASP 105 -1.500 -1.668 -11.320 896 HB2 ASP 105 2HB ASP 105 -2.349 -3.837 -9.363 897 HB3 ASP 105 3HB ASP 105 -3.445 -2.610 -10.000 898 H VAL 106 H VAL 106 -0.364 0.110 -10.460 899 HA VAL 106 HA VAL 106 -1.027 0.867 -7.696 900 HB VAL 106 HB VAL 106 1.154 1.638 -8.469 901 HG11 VAL 106 1HG1 VAL 106 0.818 1.599 -10.858 902 HG12 VAL 106 2HG1 VAL 106 1.477 3.157 -10.360 903 HG13 VAL 106 3HG1 VAL 106 -0.236 3.010 -10.758 904 HG21 VAL 106 3HG2 VAL 106 1.006 4.071 -8.067 905 HG22 VAL 106 1HG2 VAL 106 -0.022 3.169 -6.950 906 HG23 VAL 106 2HG2 VAL 106 -0.738 4.008 -8.327 907 H ARG 107 H ARG 107 -2.605 2.369 -7.255 908 HA ARG 107 HA ARG 107 -4.390 3.266 -9.382 909 HB2 ARG 107 2HB ARG 107 -6.350 2.467 -8.094 910 HB3 ARG 107 3HB ARG 107 -5.328 1.159 -8.667 911 HG2 ARG 107 2HG ARG 107 -4.342 0.934 -6.407 912 HG3 ARG 107 3HG ARG 107 -5.373 2.246 -5.834 913 HD2 ARG 107 2HD ARG 107 -6.318 -0.438 -6.898 914 HD3 ARG 107 3HD ARG 107 -6.305 0.084 -5.213 915 HE ARG 107 HE ARG 107 -7.800 1.990 -6.383 916 HH11 ARG 107 1HH1 ARG 107 -8.058 -1.521 -6.450 917 HH12 ARG 107 2HH1 ARG 107 -9.778 -1.495 -6.675 918 HH21 ARG 107 1HH2 ARG 107 -10.047 1.986 -6.725 919 HH22 ARG 107 2HH2 ARG 107 -10.894 0.472 -6.830 920 H VAL 108 H VAL 108 -5.300 5.196 -9.028 921 HA VAL 108 HA VAL 108 -4.945 6.522 -6.405 922 HB VAL 108 HB VAL 108 -4.800 8.723 -7.533 923 HG11 VAL 108 1HG1 VAL 108 -2.679 6.800 -8.538 924 HG12 VAL 108 2HG1 VAL 108 -2.726 7.568 -6.951 925 HG13 VAL 108 3HG1 VAL 108 -2.509 8.555 -8.394 926 HG21 VAL 108 3HG2 VAL 108 -5.987 8.231 -9.639 927 HG22 VAL 108 1HG2 VAL 108 -4.649 7.211 -10.172 928 HG23 VAL 108 2HG2 VAL 108 -4.409 8.947 -9.949 929 H THR 109 H THR 109 -6.790 6.999 -5.458 930 HA THR 109 HA THR 109 -9.359 6.883 -6.842 931 HB THR 109 HB THR 109 -10.264 7.301 -4.518 932 HG1 THR 109 HG1 THR 109 -8.887 7.614 -2.854 933 HG21 THR 109 3HG2 THR 109 -9.602 5.117 -3.566 934 HG22 THR 109 1HG2 THR 109 -8.261 5.011 -4.706 935 HG23 THR 109 2HG2 THR 109 -9.926 4.976 -5.294 936 H ASP 110 H ASP 110 -7.007 9.178 -5.912 937 HA ASP 110 HA ASP 110 -6.738 11.392 -5.980 938 HB2 ASP 110 2HB ASP 110 -9.183 11.350 -7.789 939 HB3 ASP 110 3HB ASP 110 -8.179 12.773 -7.525 940 H ASN 111 H ASN 111 -8.765 10.072 -4.064 941 HA ASN 111 HA ASN 111 -9.633 12.474 -2.696 942 HB2 ASN 111 2HB ASN 111 -11.479 12.129 -4.306 943 HB3 ASN 111 3HB ASN 111 -11.663 10.467 -3.773 944 HD21 ASN 111 1HD2 ASN 111 -12.154 13.823 -2.893 945 HD22 ASN 111 2HD2 ASN 111 -13.272 13.518 -1.609 946 H GLU 112 H GLU 112 -9.468 12.133 -0.621 947 HA GLU 112 HA GLU 112 -8.384 9.880 0.599 948 HB2 GLU 112 2HB GLU 112 -9.041 11.087 2.770 949 HB3 GLU 112 3HB GLU 112 -8.053 11.996 1.633 950 HG2 GLU 112 2HG GLU 112 -10.087 13.181 0.827 951 HG3 GLU 112 3HG GLU 112 -11.050 12.269 1.984 952 H ASP 113 H ASP 113 -11.783 10.901 0.441 953 HA ASP 113 HA ASP 113 -12.788 8.898 2.247 954 HB2 ASP 113 2HB ASP 113 -13.901 11.067 2.023 955 HB3 ASP 113 3HB ASP 113 -14.214 10.774 0.315 956 H GLU 114 H GLU 114 -12.435 9.154 -1.250 957 HA GLU 114 HA GLU 114 -13.936 6.795 -1.903 958 HB2 GLU 114 2HB GLU 114 -11.940 8.422 -3.520 959 HB3 GLU 114 3HB GLU 114 -12.752 6.993 -4.154 960 HG2 GLU 114 2HG GLU 114 -14.957 8.123 -3.695 961 HG3 GLU 114 3HG GLU 114 -14.055 9.576 -3.268 962 H ALA 115 H ALA 115 -10.594 7.454 -1.061 963 HA ALA 115 HA ALA 115 -9.573 4.839 -1.628 964 HB1 ALA 115 3HB ALA 115 -7.660 5.504 -0.217 965 HB2 ALA 115 1HB ALA 115 -8.544 6.938 0.317 966 HB3 ALA 115 2HB ALA 115 -8.078 6.766 -1.377 967 H LYS 116 H LYS 116 -10.811 6.475 1.249 968 HA LYS 116 HA LYS 116 -10.483 4.627 3.270 969 HB2 LYS 116 2HB LYS 116 -11.153 6.844 3.791 970 HB3 LYS 116 3HB LYS 116 -12.504 6.800 2.670 971 HG2 LYS 116 2HG LYS 116 -13.650 5.178 4.225 972 HG3 LYS 116 3HG LYS 116 -12.351 5.459 5.387 973 HD2 LYS 116 2HD LYS 116 -14.147 7.611 4.225 974 HD3 LYS 116 3HD LYS 116 -14.378 6.867 5.812 975 HE2 LYS 116 2HE LYS 116 -12.206 7.758 6.545 976 HE3 LYS 116 3HE LYS 116 -11.942 8.458 4.948 977 HZ1 LYS 116 3HZ LYS 116 -14.111 9.197 6.836 978 HZ2 LYS 116 1HZ LYS 116 -13.891 9.859 5.292 979 HZ3 LYS 116 2HZ LYS 116 -12.730 10.113 6.497 980 H LYS 117 H LYS 117 -13.384 5.036 1.203 981 HA LYS 117 HA LYS 117 -14.868 2.916 2.381 982 HB2 LYS 117 2HB LYS 117 -16.488 3.272 0.609 983 HB3 LYS 117 3HB LYS 117 -15.899 4.837 1.150 984 HG2 LYS 117 2HG LYS 117 -14.436 4.977 -0.848 985 HG3 LYS 117 3HG LYS 117 -15.015 3.398 -1.372 986 HD2 LYS 117 2HD LYS 117 -16.308 4.838 -2.674 987 HD3 LYS 117 3HD LYS 117 -17.393 4.511 -1.325 988 HE2 LYS 117 2HE LYS 117 -15.649 6.986 -1.620 989 HE3 LYS 117 3HE LYS 117 -17.365 6.907 -1.990 990 HZ1 LYS 117 3HZ LYS 117 -16.169 6.497 0.697 991 HZ2 LYS 117 1HZ LYS 117 -17.817 6.461 0.330 992 HZ3 LYS 117 2HZ LYS 117 -16.943 7.894 0.158 993 H ARG 118 H ARG 118 -12.656 3.105 -0.357 994 HA ARG 118 HA ARG 118 -13.347 0.553 -1.506 995 HB2 ARG 118 2HB ARG 118 -12.380 2.646 -2.740 996 HB3 ARG 118 3HB ARG 118 -10.813 2.115 -2.148 997 HG2 ARG 118 2HG ARG 118 -10.791 1.079 -4.208 998 HG3 ARG 118 3HG ARG 118 -11.557 -0.204 -3.275 999 HD2 ARG 118 2HD ARG 118 -12.897 1.809 -5.104 1000 HD3 ARG 118 3HD ARG 118 -12.765 0.069 -5.343 1001 HE ARG 118 HE ARG 118 -14.404 1.294 -3.190 1002 HH11 ARG 118 1HH1 ARG 118 -14.100 -1.097 -5.750 1003 HH12 ARG 118 2HH1 ARG 118 -15.667 -1.774 -5.453 1004 HH21 ARG 118 1HH2 ARG 118 -16.501 0.408 -2.887 1005 HH22 ARG 118 2HH2 ARG 118 -17.010 -0.936 -3.858 1006 H LEU 119 H LEU 119 -11.051 1.722 0.843 1007 HA LEU 119 HA LEU 119 -9.102 -0.300 0.773 1008 HB2 LEU 119 2HB LEU 119 -10.011 1.589 2.964 1009 HB3 LEU 119 3HB LEU 119 -8.834 0.334 3.326 1010 HG LEU 119 HG LEU 119 -8.475 2.598 1.323 1011 HD11 LEU 119 1HD1 LEU 119 -7.107 2.068 3.979 1012 HD12 LEU 119 2HD1 LEU 119 -8.296 3.328 3.647 1013 HD13 LEU 119 3HD1 LEU 119 -6.723 3.378 2.859 1014 HD21 LEU 119 3HD2 LEU 119 -7.379 0.568 0.486 1015 HD22 LEU 119 1HD2 LEU 119 -6.543 0.364 2.029 1016 HD23 LEU 119 2HD2 LEU 119 -6.186 1.755 1.001 1017 H LYS 120 H LYS 120 -12.012 0.009 2.822 1018 HA LYS 120 HA LYS 120 -11.756 -2.441 4.182 1019 HB2 LYS 120 2HB LYS 120 -13.268 -0.677 4.988 1020 HB3 LYS 120 3HB LYS 120 -14.286 -0.849 3.557 1021 HG2 LYS 120 2HG LYS 120 -14.863 -3.157 4.233 1022 HG3 LYS 120 3HG LYS 120 -13.829 -3.002 5.655 1023 HD2 LYS 120 2HD LYS 120 -15.301 -1.201 6.519 1024 HD3 LYS 120 3HD LYS 120 -16.331 -1.368 5.092 1025 HE2 LYS 120 2HE LYS 120 -17.268 -2.562 7.042 1026 HE3 LYS 120 3HE LYS 120 -16.888 -3.673 5.726 1027 HZ1 LYS 120 3HZ LYS 120 -14.836 -4.272 6.882 1028 HZ2 LYS 120 1HZ LYS 120 -16.189 -4.557 7.861 1029 HZ3 LYS 120 2HZ LYS 120 -15.212 -3.206 8.144 1030 H GLU 121 H GLU 121 -13.385 -1.611 1.140 1031 HA GLU 121 HA GLU 121 -14.728 -3.985 0.545 1032 HB2 GLU 121 2HB GLU 121 -13.327 -2.079 -1.376 1033 HB3 GLU 121 3HB GLU 121 -14.535 -3.268 -1.843 1034 HG2 GLU 121 2HG GLU 121 -15.070 -1.010 0.090 1035 HG3 GLU 121 3HG GLU 121 -15.343 -0.887 -1.644 1036 H LEU 122 H LEU 122 -11.433 -3.016 -0.376 1037 HA LEU 122 HA LEU 122 -10.825 -5.454 -1.762 1038 HB2 LEU 122 2HB LEU 122 -9.011 -3.181 -0.843 1039 HB3 LEU 122 3HB LEU 122 -8.545 -4.460 -1.956 1040 HG LEU 122 HG LEU 122 -10.663 -2.334 -2.486 1041 HD11 LEU 122 1HD1 LEU 122 -9.103 -1.442 -4.163 1042 HD12 LEU 122 2HD1 LEU 122 -7.897 -2.643 -3.694 1043 HD13 LEU 122 3HD1 LEU 122 -8.404 -1.403 -2.545 1044 HD21 LEU 122 3HD2 LEU 122 -10.767 -3.230 -4.792 1045 HD22 LEU 122 1HD2 LEU 122 -11.291 -4.419 -3.599 1046 HD23 LEU 122 2HD2 LEU 122 -9.688 -4.548 -4.328 1047 H LEU 123 H LEU 123 -10.408 -4.238 1.477 1048 HA LEU 123 HA LEU 123 -8.298 -5.922 2.371 1049 HB2 LEU 123 2HB LEU 123 -8.971 -3.743 3.419 1050 HB3 LEU 123 3HB LEU 123 -10.439 -4.506 4.003 1051 HG LEU 123 HG LEU 123 -8.908 -6.135 5.281 1052 HD11 LEU 123 1HD1 LEU 123 -6.803 -4.063 4.624 1053 HD12 LEU 123 2HD1 LEU 123 -6.839 -5.735 4.058 1054 HD13 LEU 123 3HD1 LEU 123 -6.632 -5.395 5.773 1055 HD21 LEU 123 3HD2 LEU 123 -10.182 -4.385 6.393 1056 HD22 LEU 123 1HD2 LEU 123 -8.905 -3.210 6.065 1057 HD23 LEU 123 2HD2 LEU 123 -8.604 -4.570 7.150 1058 H GLU 124 H GLU 124 -11.840 -6.076 2.688 1059 HA GLU 124 HA GLU 124 -12.042 -8.319 4.361 1060 HB2 GLU 124 2HB GLU 124 -14.019 -7.252 2.310 1061 HB3 GLU 124 3HB GLU 124 -14.395 -8.534 3.458 1062 HG2 GLU 124 2HG GLU 124 -13.888 -6.951 5.327 1063 HG3 GLU 124 3HG GLU 124 -13.659 -5.674 4.137 1064 H LYS 125 H LYS 125 -11.569 -8.092 0.905 1065 HA LYS 125 HA LYS 125 -11.515 -11.008 0.590 1066 HB2 LYS 125 2HB LYS 125 -11.088 -8.732 -1.392 1067 HB3 LYS 125 3HB LYS 125 -10.924 -10.435 -1.816 1068 HG2 LYS 125 2HG LYS 125 -13.266 -10.846 -1.372 1069 HG3 LYS 125 3HG LYS 125 -13.474 -9.226 -0.704 1070 HD2 LYS 125 2HD LYS 125 -12.656 -9.748 -3.582 1071 HD3 LYS 125 3HD LYS 125 -14.332 -9.553 -3.076 1072 HE2 LYS 125 2HE LYS 125 -12.168 -7.451 -2.678 1073 HE3 LYS 125 3HE LYS 125 -13.324 -7.462 -4.011 1074 HZ1 LYS 125 3HZ LYS 125 -14.128 -6.015 -2.331 1075 HZ2 LYS 125 1HZ LYS 125 -13.936 -7.184 -1.123 1076 HZ3 LYS 125 2HZ LYS 125 -15.105 -7.391 -2.325 1077 H VAL 126 H VAL 126 -9.178 -8.717 -0.818 1078 HA VAL 126 HA VAL 126 -6.940 -9.572 0.803 1079 HB VAL 126 HB VAL 126 -5.635 -10.379 -1.319 1080 HG11 VAL 126 1HG1 VAL 126 -6.280 -12.730 -1.027 1081 HG12 VAL 126 2HG1 VAL 126 -7.724 -12.236 -0.140 1082 HG13 VAL 126 3HG1 VAL 126 -6.124 -11.905 0.526 1083 HG21 VAL 126 3HG2 VAL 126 -6.964 -11.465 -3.104 1084 HG22 VAL 126 1HG2 VAL 126 -7.297 -9.734 -3.021 1085 HG23 VAL 126 2HG2 VAL 126 -8.453 -10.886 -2.353 1086 H GLY 127 H GLY 127 -7.894 -8.034 -2.286 1087 HA2 GLY 127 2HA GLY 127 -7.310 -5.525 -2.250 1088 HA3 GLY 127 3HA GLY 127 -5.659 -6.112 -2.077 1089 H SER 128 H SER 128 -7.972 -5.150 -4.326 1090 HA SER 128 HA SER 128 -6.519 -6.318 -6.603 1091 HB2 SER 128 2HB SER 128 -8.744 -6.986 -7.654 1092 HB3 SER 128 3HB SER 128 -8.313 -7.923 -6.221 1093 HG SER 128 HG SER 128 -10.367 -6.102 -6.598 1094 H LEU 129 H LEU 129 -7.754 -5.439 -8.723 1095 HA LEU 129 HA LEU 129 -8.439 -2.580 -8.397 1096 HB2 LEU 129 2HB LEU 129 -6.060 -2.824 -9.124 1097 HB3 LEU 129 3HB LEU 129 -6.605 -3.737 -10.523 1098 HG LEU 129 HG LEU 129 -7.731 -1.762 -11.439 1099 HD11 LEU 129 1HD1 LEU 129 -8.471 -0.676 -9.386 1100 HD12 LEU 129 2HD1 LEU 129 -7.584 0.457 -10.402 1101 HD13 LEU 129 3HD1 LEU 129 -6.804 -0.248 -8.983 1102 HD21 LEU 129 3HD2 LEU 129 -5.770 -0.333 -11.921 1103 HD22 LEU 129 1HD2 LEU 129 -5.378 -2.048 -12.037 1104 HD23 LEU 129 2HD2 LEU 129 -4.873 -1.124 -10.620 1105 H GLU 130 H GLU 130 -9.974 -1.824 -9.788 1106 HA GLU 130 HA GLU 130 -11.165 -3.504 -11.831 1107 HB2 GLU 130 2HB GLU 130 -13.476 -2.968 -10.404 1108 HB3 GLU 130 3HB GLU 130 -12.605 -4.488 -10.422 1109 HG2 GLU 130 2HG GLU 130 -13.170 -3.968 -8.156 1110 HG3 GLU 130 3HG GLU 130 -11.426 -3.848 -8.349 1111 H HIS 131 H HIS 131 -11.603 -0.463 -9.939 1112 HA HIS 131 HA HIS 131 -12.557 0.946 -12.336 1113 HB2 HIS 131 2HB HIS 131 -12.088 1.972 -9.491 1114 HB3 HIS 131 3HB HIS 131 -12.795 2.908 -10.799 1115 HD1 HIS 131 HD1 HIS 131 -13.634 0.550 -8.109 1116 HD2 HIS 131 HD2 HIS 131 -15.463 2.002 -11.540 1117 HE1 HIS 131 HE1 HIS 131 -16.071 0.046 -7.832 1118 HE2 HIS 131 HE2 HIS 131 -17.168 0.998 -9.877 1119 H HIS 132 H HIS 132 -10.903 1.422 -13.751 1120 HA HIS 132 HA HIS 132 -8.520 2.835 -12.854 1121 HB2 HIS 132 2HB HIS 132 -6.949 1.172 -13.905 1122 HB3 HIS 132 3HB HIS 132 -7.786 0.566 -12.481 1123 HD1 HIS 132 HD1 HIS 132 -7.772 0.206 -16.237 1124 HD2 HIS 132 HD2 HIS 132 -9.310 -1.702 -12.886 1125 HE1 HIS 132 HE1 HIS 132 -8.732 -1.960 -17.070 1126 HE2 HIS 132 HE2 HIS 132 -9.550 -3.145 -15.011 1127 H HIS 133 H HIS 133 -10.847 3.228 -14.799 1128 HA HIS 133 HA HIS 133 -9.616 3.306 -17.419 1129 HB2 HIS 133 2HB HIS 133 -11.687 4.082 -18.271 1130 HB3 HIS 133 3HB HIS 133 -12.112 2.973 -16.984 1131 HD1 HIS 133 HD1 HIS 133 -13.406 3.951 -14.986 1132 HD2 HIS 133 HD2 HIS 133 -12.391 6.784 -17.841 1133 HE1 HIS 133 HE1 HIS 133 -14.767 5.985 -14.428 1134 HE2 HIS 133 HE2 HIS 133 -14.108 7.700 -16.141 1135 H HIS 134 H HIS 134 -9.434 5.373 -14.747 1136 HA HIS 134 HA HIS 134 -9.218 7.932 -15.906 1137 HB2 HIS 134 2HB HIS 134 -7.996 8.572 -13.788 1138 HB3 HIS 134 3HB HIS 134 -9.532 7.759 -13.513 1139 HD1 HIS 134 HD1 HIS 134 -5.984 7.589 -12.653 1140 HD2 HIS 134 HD2 HIS 134 -9.218 4.986 -12.628 1141 HE1 HIS 134 HE1 HIS 134 -5.292 5.654 -11.210 1142 HE2 HIS 134 HE2 HIS 134 -7.160 4.005 -11.409 1143 H HIS 135 H HIS 135 -7.984 8.031 -17.703 1144 HA HIS 135 HA HIS 135 -5.200 8.480 -17.498 1145 HB2 HIS 135 2HB HIS 135 -5.017 6.006 -17.499 1146 HB3 HIS 135 3HB HIS 135 -5.991 5.910 -18.961 1147 HD1 HIS 135 HD1 HIS 135 -2.607 7.200 -17.813 1148 HD2 HIS 135 HD2 HIS 135 -4.541 6.025 -21.302 1149 HE1 HIS 135 HE1 HIS 135 -0.831 7.162 -19.591 1150 HE2 HIS 135 HE2 HIS 135 -2.048 6.584 -21.713 1151 H HIS 136 H HIS 136 -5.581 10.374 -18.581 1152 HA HIS 136 HA HIS 136 -7.038 10.625 -21.016 1153 HB2 HIS 136 2HB HIS 136 -5.706 12.886 -21.180 1154 HB3 HIS 136 3HB HIS 136 -6.868 12.664 -19.882 1155 HD1 HIS 136 HD1 HIS 136 -5.981 12.564 -17.491 1156 HD2 HIS 136 HD2 HIS 136 -2.984 13.057 -20.331 1157 HE1 HIS 136 HE1 HIS 136 -3.910 13.116 -16.198 1158 HE2 HIS 136 HE2 HIS 136 -2.087 13.239 -17.904 Start of MODEL 12 1 H1 MET 1 1H MET 1 -6.811 -12.311 -0.697 2 H2 MET 1 2H MET 1 -6.389 -13.741 0.091 3 H3 MET 1 3H MET 1 -7.573 -13.754 -1.110 4 HA MET 1 HA MET 1 -5.477 -14.660 -1.874 5 HB2 MET 1 2HB MET 1 -7.155 -13.361 -3.356 6 HB3 MET 1 3HB MET 1 -6.046 -12.000 -3.258 7 HG2 MET 1 2HG MET 1 -5.612 -13.064 -5.331 8 HG3 MET 1 3HG MET 1 -4.279 -13.531 -4.281 9 HE1 MET 1 3HE MET 1 -4.785 -16.100 -2.727 10 HE2 MET 1 1HE MET 1 -3.540 -15.990 -3.972 11 HE3 MET 1 2HE MET 1 -4.650 -17.359 -3.955 12 H GLY 2 H GLY 2 -3.230 -14.096 -2.647 13 HA2 GLY 2 2HA GLY 2 -1.738 -12.742 -0.578 14 HA3 GLY 2 3HA GLY 2 -1.086 -13.576 -1.980 15 H THR 3 H THR 3 -2.591 -10.558 -0.912 16 HA THR 3 HA THR 3 -1.213 -9.094 -3.094 17 HB THR 3 HB THR 3 -3.829 -8.240 -1.780 18 HG1 THR 3 HG1 THR 3 -3.342 -9.942 -3.948 19 HG21 THR 3 3HG2 THR 3 -2.581 -6.383 -2.819 20 HG22 THR 3 1HG2 THR 3 -4.047 -6.743 -3.735 21 HG23 THR 3 2HG2 THR 3 -2.478 -7.288 -4.332 22 H VAL 4 H VAL 4 -0.156 -7.215 -2.520 23 HA VAL 4 HA VAL 4 0.006 -6.489 0.363 24 HB VAL 4 HB VAL 4 2.091 -6.080 -1.860 25 HG11 VAL 4 1HG1 VAL 4 2.312 -5.452 1.107 26 HG12 VAL 4 2HG1 VAL 4 2.200 -4.271 -0.199 27 HG13 VAL 4 3HG1 VAL 4 3.617 -5.314 -0.073 28 HG21 VAL 4 3HG2 VAL 4 2.168 -8.001 0.497 29 HG22 VAL 4 1HG2 VAL 4 3.469 -7.743 -0.670 30 HG23 VAL 4 2HG2 VAL 4 1.939 -8.447 -1.197 31 H VAL 5 H VAL 5 -1.173 -4.654 0.691 32 HA VAL 5 HA VAL 5 -1.671 -2.861 -1.608 33 HB VAL 5 HB VAL 5 -3.680 -2.039 -0.340 34 HG11 VAL 5 1HG1 VAL 5 -3.658 -5.020 -0.936 35 HG12 VAL 5 2HG1 VAL 5 -3.907 -3.727 -2.111 36 HG13 VAL 5 3HG1 VAL 5 -5.097 -3.996 -0.838 37 HG21 VAL 5 3HG2 VAL 5 -3.051 -2.650 1.963 38 HG22 VAL 5 1HG2 VAL 5 -3.127 -4.365 1.544 39 HG23 VAL 5 2HG2 VAL 5 -4.595 -3.381 1.525 40 H ILE 6 H ILE 6 -0.614 -1.007 -1.654 41 HA ILE 6 HA ILE 6 0.663 0.036 0.818 42 HB ILE 6 HB ILE 6 1.437 0.779 -2.038 43 HG12 ILE 6 2HG1 ILE 6 1.750 -1.695 -1.755 44 HG13 ILE 6 3HG1 ILE 6 3.262 -0.840 -2.015 45 HG21 ILE 6 1HG2 ILE 6 2.933 1.056 0.596 46 HG22 ILE 6 2HG2 ILE 6 2.185 2.359 -0.331 47 HG23 ILE 6 3HG2 ILE 6 3.574 1.495 -0.990 48 HD11 ILE 6 3HD1 ILE 6 3.505 -2.581 -0.373 49 HD12 ILE 6 1HD1 ILE 6 2.231 -1.874 0.618 50 HD13 ILE 6 2HD1 ILE 6 3.752 -1.007 0.379 51 H VAL 7 H VAL 7 -0.644 1.620 1.640 52 HA VAL 7 HA VAL 7 -2.189 3.363 -0.119 53 HB VAL 7 HB VAL 7 -2.042 3.370 2.923 54 HG11 VAL 7 1HG1 VAL 7 -4.136 4.680 2.821 55 HG12 VAL 7 2HG1 VAL 7 -4.060 4.690 1.058 56 HG13 VAL 7 3HG1 VAL 7 -2.828 5.533 1.998 57 HG21 VAL 7 3HG2 VAL 7 -4.097 2.099 1.096 58 HG22 VAL 7 1HG2 VAL 7 -4.154 2.147 2.858 59 HG23 VAL 7 2HG2 VAL 7 -2.881 1.236 2.043 60 H VAL 8 H VAL 8 -1.372 5.165 -0.856 61 HA VAL 8 HA VAL 8 0.650 6.648 0.707 62 HB VAL 8 HB VAL 8 0.457 6.500 -2.340 63 HG11 VAL 8 1HG1 VAL 8 2.513 7.877 -0.574 64 HG12 VAL 8 2HG1 VAL 8 1.267 8.686 -1.529 65 HG13 VAL 8 3HG1 VAL 8 2.553 7.791 -2.334 66 HG21 VAL 8 3HG2 VAL 8 2.525 5.260 -0.480 67 HG22 VAL 8 1HG2 VAL 8 2.603 5.257 -2.245 68 HG23 VAL 8 2HG2 VAL 8 1.314 4.381 -1.416 69 H SER 9 H SER 9 0.361 8.817 0.900 70 HA SER 9 HA SER 9 -1.624 10.256 -0.667 71 HB2 SER 9 2HB SER 9 -3.033 9.355 1.147 72 HB3 SER 9 3HB SER 9 -1.920 9.983 2.361 73 HG SER 9 HG SER 9 -3.952 11.228 1.111 74 H ASN 10 H ASN 10 -1.439 12.516 -0.496 75 HA ASN 10 HA ASN 10 1.201 13.506 0.201 76 HB2 ASN 10 2HB ASN 10 -1.226 14.966 -0.935 77 HB3 ASN 10 3HB ASN 10 0.379 15.670 -0.754 78 HD21 ASN 10 1HD2 ASN 10 -1.123 15.390 -3.196 79 HD22 ASN 10 2HD2 ASN 10 -0.217 14.373 -4.259 80 H ASP 11 H ASP 11 -1.384 12.863 2.071 81 HA ASP 11 HA ASP 11 -0.661 14.893 4.081 82 HB2 ASP 11 2HB ASP 11 -2.844 15.516 3.114 83 HB3 ASP 11 3HB ASP 11 -3.472 13.904 3.434 84 H GLU 12 H GLU 12 -0.412 14.141 6.116 85 HA GLU 12 HA GLU 12 0.125 11.345 6.491 86 HB2 GLU 12 2HB GLU 12 0.154 13.580 8.560 87 HB3 GLU 12 3HB GLU 12 0.906 11.996 8.731 88 HG2 GLU 12 2HG GLU 12 2.489 12.541 6.927 89 HG3 GLU 12 3HG GLU 12 1.708 14.105 6.707 90 H ARG 13 H ARG 13 -2.430 13.570 7.546 91 HA ARG 13 HA ARG 13 -3.565 11.822 9.502 92 HB2 ARG 13 2HB ARG 13 -4.301 14.459 8.335 93 HB3 ARG 13 3HB ARG 13 -5.657 13.491 8.890 94 HG2 ARG 13 2HG ARG 13 -4.134 13.277 11.095 95 HG3 ARG 13 3HG ARG 13 -3.481 14.802 10.483 96 HD2 ARG 13 2HD ARG 13 -5.444 15.023 12.099 97 HD3 ARG 13 3HD ARG 13 -5.638 15.858 10.556 98 HE ARG 13 HE ARG 13 -7.440 14.536 10.118 99 HH11 ARG 13 1HH1 ARG 13 -5.565 12.852 12.572 100 HH12 ARG 13 2HH1 ARG 13 -6.711 11.568 12.739 101 HH21 ARG 13 1HH2 ARG 13 -8.849 12.747 10.231 102 HH22 ARG 13 2HH2 ARG 13 -8.576 11.509 11.409 103 H ILE 14 H ILE 14 -4.051 12.184 6.027 104 HA ILE 14 HA ILE 14 -6.400 10.597 5.819 105 HB ILE 14 HB ILE 14 -4.140 10.993 3.800 106 HG12 ILE 14 2HG1 ILE 14 -5.255 13.106 4.350 107 HG13 ILE 14 3HG1 ILE 14 -5.704 12.623 2.722 108 HG21 ILE 14 1HG2 ILE 14 -5.380 8.945 3.239 109 HG22 ILE 14 2HG2 ILE 14 -5.723 10.211 2.059 110 HG23 ILE 14 3HG2 ILE 14 -6.909 9.826 3.309 111 HD11 ILE 14 3HD1 ILE 14 -7.875 11.832 3.576 112 HD12 ILE 14 1HD1 ILE 14 -7.592 13.540 3.903 113 HD13 ILE 14 2HD1 ILE 14 -7.414 12.358 5.198 114 H LEU 15 H LEU 15 -2.930 9.825 5.796 115 HA LEU 15 HA LEU 15 -3.146 7.016 5.494 116 HB2 LEU 15 2HB LEU 15 -0.965 8.691 6.788 117 HB3 LEU 15 3HB LEU 15 -0.800 6.987 6.381 118 HG LEU 15 HG LEU 15 -1.250 9.227 4.366 119 HD11 LEU 15 1HD1 LEU 15 0.978 9.351 5.381 120 HD12 LEU 15 2HD1 LEU 15 1.069 8.867 3.688 121 HD13 LEU 15 3HD1 LEU 15 1.278 7.661 4.962 122 HD21 LEU 15 3HD2 LEU 15 -0.763 7.487 2.665 123 HD22 LEU 15 1HD2 LEU 15 -2.233 7.144 3.579 124 HD23 LEU 15 2HD2 LEU 15 -0.750 6.258 3.938 125 H GLU 16 H GLU 16 -3.269 9.114 8.339 126 HA GLU 16 HA GLU 16 -2.989 7.058 10.325 127 HB2 GLU 16 2HB GLU 16 -2.388 9.441 10.732 128 HB3 GLU 16 3HB GLU 16 -4.083 9.896 10.585 129 HG2 GLU 16 2HG GLU 16 -4.585 8.448 12.577 130 HG3 GLU 16 3HG GLU 16 -2.856 8.146 12.749 131 H GLU 17 H GLU 17 -5.726 8.920 9.009 132 HA GLU 17 HA GLU 17 -7.825 7.789 10.498 133 HB2 GLU 17 2HB GLU 17 -7.937 9.882 9.093 134 HB3 GLU 17 3HB GLU 17 -7.914 8.882 7.646 135 HG2 GLU 17 2HG GLU 17 -10.183 9.603 8.123 136 HG3 GLU 17 3HG GLU 17 -10.054 7.855 8.323 137 H LEU 18 H LEU 18 -6.517 6.967 7.321 138 HA LEU 18 HA LEU 18 -8.189 4.757 6.748 139 HB2 LEU 18 2HB LEU 18 -5.696 5.947 5.584 140 HB3 LEU 18 3HB LEU 18 -6.084 4.305 5.115 141 HG LEU 18 HG LEU 18 -8.192 5.006 4.113 142 HD11 LEU 18 1HD1 LEU 18 -7.592 7.828 5.029 143 HD12 LEU 18 2HD1 LEU 18 -8.856 6.776 5.668 144 HD13 LEU 18 3HD1 LEU 18 -8.935 7.325 3.996 145 HD21 LEU 18 3HD2 LEU 18 -5.910 6.811 3.267 146 HD22 LEU 18 1HD2 LEU 18 -7.338 6.435 2.301 147 HD23 LEU 18 2HD2 LEU 18 -6.203 5.156 2.720 148 H LEU 19 H LEU 19 -5.117 5.045 8.468 149 HA LEU 19 HA LEU 19 -4.312 2.371 8.658 150 HB2 LEU 19 2HB LEU 19 -2.969 4.264 9.518 151 HB3 LEU 19 3HB LEU 19 -4.170 4.559 10.761 152 HG LEU 19 HG LEU 19 -3.606 2.096 11.548 153 HD11 LEU 19 1HD1 LEU 19 -2.247 1.441 9.656 154 HD12 LEU 19 2HD1 LEU 19 -1.291 1.414 11.135 155 HD13 LEU 19 3HD1 LEU 19 -1.102 2.741 9.987 156 HD21 LEU 19 3HD2 LEU 19 -1.853 2.924 13.031 157 HD22 LEU 19 1HD2 LEU 19 -3.182 4.074 12.894 158 HD23 LEU 19 2HD2 LEU 19 -1.667 4.368 12.032 159 H GLU 20 H GLU 20 -6.534 4.256 10.616 160 HA GLU 20 HA GLU 20 -7.156 2.193 12.489 161 HB2 GLU 20 2HB GLU 20 -8.660 4.782 11.953 162 HB3 GLU 20 3HB GLU 20 -8.732 3.798 13.416 163 HG2 GLU 20 2HG GLU 20 -6.319 4.273 13.822 164 HG3 GLU 20 3HG GLU 20 -6.302 5.305 12.393 165 H VAL 21 H VAL 21 -8.611 3.347 9.475 166 HA VAL 21 HA VAL 21 -11.058 1.965 9.547 167 HB VAL 21 HB VAL 21 -9.296 2.605 7.127 168 HG11 VAL 21 1HG1 VAL 21 -12.215 1.729 7.139 169 HG12 VAL 21 2HG1 VAL 21 -10.853 0.792 6.522 170 HG13 VAL 21 3HG1 VAL 21 -11.321 2.293 5.723 171 HG21 VAL 21 3HG2 VAL 21 -11.726 4.060 8.240 172 HG22 VAL 21 1HG2 VAL 21 -10.845 4.503 6.774 173 HG23 VAL 21 2HG2 VAL 21 -10.053 4.606 8.345 174 H VAL 22 H VAL 22 -7.792 0.861 8.685 175 HA VAL 22 HA VAL 22 -8.571 -1.770 7.819 176 HB VAL 22 HB VAL 22 -5.814 -0.740 8.640 177 HG11 VAL 22 1HG1 VAL 22 -6.535 -3.257 7.081 178 HG12 VAL 22 2HG1 VAL 22 -5.934 -3.213 8.738 179 HG13 VAL 22 3HG1 VAL 22 -4.900 -2.679 7.416 180 HG21 VAL 22 3HG2 VAL 22 -6.738 0.511 6.737 181 HG22 VAL 22 1HG2 VAL 22 -7.057 -0.997 5.877 182 HG23 VAL 22 2HG2 VAL 22 -5.394 -0.505 6.214 183 H LEU 23 H LEU 23 -7.096 -0.415 10.785 184 HA LEU 23 HA LEU 23 -6.730 -2.724 12.296 185 HB2 LEU 23 2HB LEU 23 -7.428 0.109 13.132 186 HB3 LEU 23 3HB LEU 23 -7.029 -1.134 14.300 187 HG LEU 23 HG LEU 23 -5.115 -0.241 12.111 188 HD11 LEU 23 1HD1 LEU 23 -5.607 1.660 13.589 189 HD12 LEU 23 2HD1 LEU 23 -3.957 1.088 13.806 190 HD13 LEU 23 3HD1 LEU 23 -5.194 0.685 15.002 191 HD21 LEU 23 3HD2 LEU 23 -4.654 -2.485 12.979 192 HD22 LEU 23 1HD2 LEU 23 -4.663 -1.871 14.637 193 HD23 LEU 23 2HD2 LEU 23 -3.412 -1.352 13.505 194 H LYS 24 H LYS 24 -9.593 -0.577 12.267 195 HA LYS 24 HA LYS 24 -11.055 -2.074 14.224 196 HB2 LYS 24 2HB LYS 24 -12.856 -0.501 13.861 197 HB3 LYS 24 3HB LYS 24 -11.339 0.382 13.852 198 HG2 LYS 24 2HG LYS 24 -11.482 0.213 11.263 199 HG3 LYS 24 3HG LYS 24 -13.169 -0.236 11.523 200 HD2 LYS 24 2HD LYS 24 -11.837 2.354 12.412 201 HD3 LYS 24 3HD LYS 24 -12.962 2.172 11.067 202 HE2 LYS 24 2HE LYS 24 -14.758 1.565 12.628 203 HE3 LYS 24 3HE LYS 24 -13.638 1.686 13.987 204 HZ1 LYS 24 3HZ LYS 24 -13.378 4.019 13.569 205 HZ2 LYS 24 1HZ LYS 24 -15.029 3.679 13.701 206 HZ3 LYS 24 2HZ LYS 24 -14.333 3.938 12.179 207 H SER 25 H SER 25 -10.849 -2.162 10.746 208 HA SER 25 HA SER 25 -13.215 -3.647 10.191 209 HB2 SER 25 2HB SER 25 -12.096 -2.395 8.417 210 HB3 SER 25 3HB SER 25 -10.624 -3.345 8.613 211 HG SER 25 HG SER 25 -11.671 -5.117 7.780 212 H ASP 26 H ASP 26 -9.759 -4.667 10.383 213 HA ASP 26 HA ASP 26 -10.388 -7.181 11.616 214 HB2 ASP 26 2HB ASP 26 -11.051 -7.729 9.299 215 HB3 ASP 26 3HB ASP 26 -9.469 -7.228 8.709 216 HA PRO 27 HA PRO 27 -6.124 -6.133 12.783 217 HB2 PRO 27 2HB PRO 27 -5.854 -7.842 14.880 218 HB3 PRO 27 3HB PRO 27 -6.919 -6.430 14.938 219 HG2 PRO 27 2HG PRO 27 -7.662 -9.288 14.400 220 HG3 PRO 27 3HG PRO 27 -8.431 -8.120 15.502 221 HD2 PRO 27 2HD PRO 27 -9.404 -8.631 13.001 222 HD3 PRO 27 3HD PRO 27 -9.573 -7.048 13.793 223 H ASN 28 H ASN 28 -7.024 -9.149 11.338 224 HA ASN 28 HA ASN 28 -4.520 -10.528 11.571 225 HB2 ASN 28 2HB ASN 28 -6.677 -10.743 9.440 226 HB3 ASN 28 3HB ASN 28 -5.257 -11.777 9.476 227 HD21 ASN 28 1HD2 ASN 28 -8.386 -11.223 10.737 228 HD22 ASN 28 2HD2 ASN 28 -8.437 -12.579 11.807 229 H VAL 29 H VAL 29 -5.847 -8.207 9.315 230 HA VAL 29 HA VAL 29 -3.716 -8.238 7.417 231 HB VAL 29 HB VAL 29 -5.717 -5.982 7.905 232 HG11 VAL 29 1HG1 VAL 29 -4.261 -6.839 5.378 233 HG12 VAL 29 2HG1 VAL 29 -3.890 -5.417 6.354 234 HG13 VAL 29 3HG1 VAL 29 -5.429 -5.521 5.498 235 HG21 VAL 29 3HG2 VAL 29 -7.222 -7.111 6.283 236 HG22 VAL 29 1HG2 VAL 29 -6.982 -8.078 7.738 237 HG23 VAL 29 2HG2 VAL 29 -6.137 -8.499 6.248 238 H LYS 30 H LYS 30 -1.696 -7.581 7.943 239 HA LYS 30 HA LYS 30 -1.095 -6.204 10.349 240 HB2 LYS 30 2HB LYS 30 0.437 -7.871 9.419 241 HB3 LYS 30 3HB LYS 30 0.693 -6.890 7.981 242 HG2 LYS 30 2HG LYS 30 2.604 -6.735 9.533 243 HG3 LYS 30 3HG LYS 30 1.821 -5.164 9.329 244 HD2 LYS 30 2HD LYS 30 0.557 -5.619 11.489 245 HD3 LYS 30 3HD LYS 30 1.553 -7.060 11.696 246 HE2 LYS 30 2HE LYS 30 3.564 -5.677 11.825 247 HE3 LYS 30 3HE LYS 30 2.611 -4.226 11.506 248 HZ1 LYS 30 3HZ LYS 30 2.358 -5.986 13.886 249 HZ2 LYS 30 1HZ LYS 30 1.400 -4.629 13.567 250 HZ3 LYS 30 2HZ LYS 30 3.054 -4.447 13.843 251 H THR 31 H THR 31 -1.199 -4.098 10.714 252 HA THR 31 HA THR 31 -1.020 -2.118 8.551 253 HB THR 31 HB THR 31 -1.701 -0.506 10.350 254 HG1 THR 31 HG1 THR 31 -0.890 -1.610 12.169 255 HG21 THR 31 3HG2 THR 31 -4.015 -1.292 10.617 256 HG22 THR 31 1HG2 THR 31 -3.535 -2.916 10.114 257 HG23 THR 31 2HG2 THR 31 -3.445 -1.574 8.970 258 H VAL 32 H VAL 32 0.969 -1.401 8.076 259 HA VAL 32 HA VAL 32 2.770 -0.552 10.283 260 HB VAL 32 HB VAL 32 3.667 -1.549 7.531 261 HG11 VAL 32 1HG1 VAL 32 5.970 -1.401 8.420 262 HG12 VAL 32 2HG1 VAL 32 5.346 -0.726 9.927 263 HG13 VAL 32 3HG1 VAL 32 5.174 0.175 8.420 264 HG21 VAL 32 3HG2 VAL 32 2.873 -3.433 8.890 265 HG22 VAL 32 1HG2 VAL 32 3.944 -2.954 10.209 266 HG23 VAL 32 2HG2 VAL 32 4.622 -3.512 8.677 267 H ARG 33 H ARG 33 2.575 1.637 10.324 268 HA ARG 33 HA ARG 33 2.621 3.099 7.745 269 HB2 ARG 33 2HB ARG 33 1.460 4.966 8.822 270 HB3 ARG 33 3HB ARG 33 0.522 3.494 8.926 271 HG2 ARG 33 2HG ARG 33 0.156 4.143 11.063 272 HG3 ARG 33 3HG ARG 33 1.744 3.446 11.371 273 HD2 ARG 33 2HD ARG 33 2.755 5.716 11.065 274 HD3 ARG 33 3HD ARG 33 1.134 6.377 10.831 275 HE ARG 33 HE ARG 33 0.969 5.091 13.214 276 HH11 ARG 33 1HH1 ARG 33 3.136 7.607 12.024 277 HH12 ARG 33 2HH1 ARG 33 3.378 8.291 13.600 278 HH21 ARG 33 1HH2 ARG 33 1.337 5.969 15.256 279 HH22 ARG 33 2HH2 ARG 33 2.358 7.363 15.427 280 H THR 34 H THR 34 4.642 3.559 7.350 281 HA THR 34 HA THR 34 6.112 5.509 8.663 282 HB THR 34 HB THR 34 6.583 3.811 10.444 283 HG1 THR 34 HG1 THR 34 9.026 3.828 10.037 284 HG21 THR 34 3HG2 THR 34 7.922 2.181 8.263 285 HG22 THR 34 1HG2 THR 34 6.448 1.736 9.124 286 HG23 THR 34 2HG2 THR 34 7.982 1.830 9.991 287 H ASP 35 H ASP 35 7.520 6.310 7.144 288 HA ASP 35 HA ASP 35 8.528 4.589 4.998 289 HB2 ASP 35 2HB ASP 35 8.024 6.901 4.357 290 HB3 ASP 35 3HB ASP 35 9.070 7.525 5.626 291 H ASP 36 H ASP 36 9.549 3.093 6.337 292 HA ASP 36 HA ASP 36 12.178 3.969 7.422 293 HB2 ASP 36 2HB ASP 36 10.532 2.889 9.073 294 HB3 ASP 36 3HB ASP 36 10.707 1.397 8.151 295 H LYS 37 H LYS 37 10.570 2.426 4.927 296 HA LYS 37 HA LYS 37 11.139 1.376 3.040 297 HB2 LYS 37 2HB LYS 37 14.082 1.667 3.723 298 HB3 LYS 37 3HB LYS 37 13.349 1.539 2.128 299 HG2 LYS 37 2HG LYS 37 12.376 3.800 2.404 300 HG3 LYS 37 3HG LYS 37 13.119 3.913 4.007 301 HD2 LYS 37 2HD LYS 37 15.378 3.562 2.859 302 HD3 LYS 37 3HD LYS 37 14.538 3.755 1.315 303 HE2 LYS 37 2HE LYS 37 13.803 6.011 2.024 304 HE3 LYS 37 3HE LYS 37 14.682 5.805 3.542 305 HZ1 LYS 37 3HZ LYS 37 16.737 5.614 2.277 306 HZ2 LYS 37 1HZ LYS 37 15.959 7.082 1.953 307 HZ3 LYS 37 2HZ LYS 37 15.887 5.825 0.828 308 H GLU 38 H GLU 38 13.895 0.317 5.018 309 HA GLU 38 HA GLU 38 13.911 -2.335 4.110 310 HB2 GLU 38 2HB GLU 38 15.630 -2.681 5.867 311 HB3 GLU 38 3HB GLU 38 15.905 -1.198 4.952 312 HG2 GLU 38 2HG GLU 38 14.978 0.141 6.778 313 HG3 GLU 38 3HG GLU 38 14.598 -1.317 7.690 314 H LYS 39 H LYS 39 12.444 -0.899 7.016 315 HA LYS 39 HA LYS 39 11.684 -3.224 8.398 316 HB2 LYS 39 2HB LYS 39 11.528 -1.052 9.458 317 HB3 LYS 39 3HB LYS 39 10.369 -0.487 8.261 318 HG2 LYS 39 2HG LYS 39 8.688 -2.069 9.114 319 HG3 LYS 39 3HG LYS 39 9.852 -2.692 10.288 320 HD2 LYS 39 2HD LYS 39 9.912 -0.529 11.426 321 HD3 LYS 39 3HD LYS 39 8.863 0.180 10.194 322 HE2 LYS 39 2HE LYS 39 7.568 -0.337 12.196 323 HE3 LYS 39 3HE LYS 39 7.052 -1.374 10.868 324 HZ1 LYS 39 3HZ LYS 39 7.270 -2.589 12.957 325 HZ2 LYS 39 1HZ LYS 39 8.906 -2.176 13.047 326 HZ3 LYS 39 2HZ LYS 39 8.358 -3.172 11.801 327 H VAL 40 H VAL 40 10.168 -1.555 5.685 328 HA VAL 40 HA VAL 40 7.660 -2.855 5.775 329 HB VAL 40 HB VAL 40 9.046 -1.637 3.336 330 HG11 VAL 40 1HG1 VAL 40 7.165 -3.049 2.694 331 HG12 VAL 40 2HG1 VAL 40 6.738 -1.351 2.473 332 HG13 VAL 40 3HG1 VAL 40 6.123 -2.239 3.864 333 HG21 VAL 40 3HG2 VAL 40 7.796 0.437 3.880 334 HG22 VAL 40 1HG2 VAL 40 8.903 -0.001 5.184 335 HG23 VAL 40 2HG2 VAL 40 7.174 -0.314 5.351 336 H LYS 41 H LYS 41 10.748 -3.719 4.273 337 HA LYS 41 HA LYS 41 9.849 -5.809 2.577 338 HB2 LYS 41 2HB LYS 41 12.578 -5.152 3.730 339 HB3 LYS 41 3HB LYS 41 12.334 -6.611 2.778 340 HG2 LYS 41 2HG LYS 41 13.253 -4.895 1.368 341 HG3 LYS 41 3HG LYS 41 11.595 -5.230 0.862 342 HD2 LYS 41 2HD LYS 41 10.806 -3.190 1.926 343 HD3 LYS 41 3HD LYS 41 12.399 -2.894 2.632 344 HE2 LYS 41 2HE LYS 41 11.711 -2.864 -0.323 345 HE3 LYS 41 3HE LYS 41 12.059 -1.461 0.686 346 HZ1 LYS 41 3HZ LYS 41 13.985 -2.048 -0.574 347 HZ2 LYS 41 1HZ LYS 41 13.950 -3.637 -0.020 348 HZ3 LYS 41 2HZ LYS 41 14.300 -2.376 1.049 349 H GLU 42 H GLU 42 11.163 -5.864 5.914 350 HA GLU 42 HA GLU 42 11.139 -8.694 6.201 351 HB2 GLU 42 2HB GLU 42 11.539 -8.374 8.561 352 HB3 GLU 42 3HB GLU 42 12.465 -7.155 7.696 353 HG2 GLU 42 2HG GLU 42 10.784 -5.461 8.253 354 HG3 GLU 42 3HG GLU 42 9.811 -6.671 9.079 355 H GLU 43 H GLU 43 8.683 -6.230 6.640 356 HA GLU 43 HA GLU 43 6.808 -7.882 8.052 357 HB2 GLU 43 2HB GLU 43 6.424 -5.270 6.536 358 HB3 GLU 43 3HB GLU 43 5.227 -6.011 7.594 359 HG2 GLU 43 2HG GLU 43 7.950 -5.008 8.466 360 HG3 GLU 43 3HG GLU 43 6.433 -4.140 8.666 361 H ILE 44 H ILE 44 7.485 -7.283 4.644 362 HA ILE 44 HA ILE 44 5.076 -8.263 3.486 363 HB ILE 44 HB ILE 44 7.904 -8.011 2.378 364 HG12 ILE 44 2HG1 ILE 44 5.413 -6.363 1.741 365 HG13 ILE 44 3HG1 ILE 44 6.654 -5.881 2.891 366 HG21 ILE 44 1HG2 ILE 44 7.005 -8.389 0.108 367 HG22 ILE 44 2HG2 ILE 44 5.426 -8.772 0.795 368 HG23 ILE 44 3HG2 ILE 44 6.808 -9.816 1.126 369 HD11 ILE 44 3HD1 ILE 44 6.915 -4.754 0.750 370 HD12 ILE 44 1HD1 ILE 44 7.084 -6.310 -0.069 371 HD13 ILE 44 2HD1 ILE 44 8.302 -5.785 1.099 372 H GLU 45 H GLU 45 8.248 -9.849 4.049 373 HA GLU 45 HA GLU 45 7.576 -12.392 3.017 374 HB2 GLU 45 2HB GLU 45 9.603 -13.212 4.194 375 HB3 GLU 45 3HB GLU 45 9.912 -11.717 3.318 376 HG2 GLU 45 2HG GLU 45 9.727 -10.444 5.433 377 HG3 GLU 45 3HG GLU 45 9.442 -11.947 6.304 378 H LYS 46 H LYS 46 7.113 -10.966 6.208 379 HA LYS 46 HA LYS 46 6.313 -13.330 7.602 380 HB2 LYS 46 2HB LYS 46 5.713 -10.395 8.155 381 HB3 LYS 46 3HB LYS 46 5.359 -11.709 9.279 382 HG2 LYS 46 2HG LYS 46 7.685 -12.196 9.580 383 HG3 LYS 46 3HG LYS 46 8.148 -11.121 8.258 384 HD2 LYS 46 2HD LYS 46 7.215 -9.189 9.619 385 HD3 LYS 46 3HD LYS 46 7.001 -10.318 10.964 386 HE2 LYS 46 2HE LYS 46 9.401 -10.740 11.039 387 HE3 LYS 46 3HE LYS 46 9.654 -9.750 9.601 388 HZ1 LYS 46 3HZ LYS 46 8.878 -7.837 10.839 389 HZ2 LYS 46 1HZ LYS 46 10.214 -8.543 11.586 390 HZ3 LYS 46 2HZ LYS 46 8.666 -8.779 12.222 391 H ALA 47 H ALA 47 4.596 -10.871 5.736 392 HA ALA 47 HA ALA 47 1.964 -11.441 6.514 393 HB1 ALA 47 3HB ALA 47 2.627 -9.369 5.374 394 HB2 ALA 47 1HB ALA 47 1.285 -10.159 4.544 395 HB3 ALA 47 2HB ALA 47 2.921 -10.271 3.886 396 H ARG 48 H ARG 48 3.820 -12.622 3.712 397 HA ARG 48 HA ARG 48 1.627 -13.995 2.540 398 HB2 ARG 48 2HB ARG 48 3.231 -14.901 0.942 399 HB3 ARG 48 3HB ARG 48 3.455 -13.175 1.178 400 HG2 ARG 48 2HG ARG 48 5.452 -13.577 2.541 401 HG3 ARG 48 3HG ARG 48 5.209 -15.324 2.413 402 HD2 ARG 48 2HD ARG 48 5.428 -15.101 -0.091 403 HD3 ARG 48 3HD ARG 48 5.838 -13.403 0.146 404 HE ARG 48 HE ARG 48 7.865 -14.061 1.204 405 HH11 ARG 48 1HH1 ARG 48 6.159 -16.762 -0.278 406 HH12 ARG 48 2HH1 ARG 48 7.569 -17.768 -0.337 407 HH21 ARG 48 1HH2 ARG 48 9.697 -15.352 1.076 408 HH22 ARG 48 2HH2 ARG 48 9.588 -16.959 0.434 409 H LYS 49 H LYS 49 4.355 -15.152 4.576 410 HA LYS 49 HA LYS 49 3.663 -17.908 4.329 411 HB2 LYS 49 2HB LYS 49 5.260 -18.341 6.163 412 HB3 LYS 49 3HB LYS 49 5.942 -17.309 4.926 413 HG2 LYS 49 2HG LYS 49 6.764 -16.473 6.969 414 HG3 LYS 49 3HG LYS 49 5.506 -15.338 6.488 415 HD2 LYS 49 2HD LYS 49 3.992 -16.167 8.148 416 HD3 LYS 49 3HD LYS 49 4.973 -17.598 8.452 417 HE2 LYS 49 2HE LYS 49 5.928 -14.788 9.057 418 HE3 LYS 49 3HE LYS 49 5.056 -15.778 10.226 419 HZ1 LYS 49 3HZ LYS 49 6.807 -17.447 10.059 420 HZ2 LYS 49 1HZ LYS 49 7.437 -15.951 10.541 421 HZ3 LYS 49 2HZ LYS 49 7.648 -16.487 8.954 422 H GLN 50 H GLN 50 2.554 -15.338 6.363 423 HA GLN 50 HA GLN 50 1.341 -17.034 8.381 424 HB2 GLN 50 2HB GLN 50 2.422 -14.741 8.778 425 HB3 GLN 50 3HB GLN 50 1.018 -14.028 7.993 426 HG2 GLN 50 2HG GLN 50 0.831 -13.924 10.432 427 HG3 GLN 50 3HG GLN 50 -0.442 -14.931 9.743 428 HE21 GLN 50 1HE2 GLN 50 -0.430 -17.147 10.167 429 HE22 GLN 50 2HE2 GLN 50 0.580 -17.867 11.371 430 H GLY 51 H GLY 51 0.473 -15.785 5.312 431 HA2 GLY 51 2HA GLY 51 -1.371 -16.183 4.012 432 HA3 GLY 51 3HA GLY 51 -2.091 -17.078 5.342 433 H ARG 52 H ARG 52 -0.973 -13.743 5.532 434 HA ARG 52 HA ARG 52 -3.715 -12.707 5.383 435 HB2 ARG 52 2HB ARG 52 -3.198 -11.224 7.435 436 HB3 ARG 52 3HB ARG 52 -3.560 -12.914 7.731 437 HG2 ARG 52 2HG ARG 52 -1.802 -12.510 9.195 438 HG3 ARG 52 3HG ARG 52 -0.997 -13.263 7.824 439 HD2 ARG 52 2HD ARG 52 -0.211 -11.059 7.053 440 HD3 ARG 52 3HD ARG 52 -1.083 -10.268 8.372 441 HE ARG 52 HE ARG 52 0.569 -12.088 9.601 442 HH11 ARG 52 1HH1 ARG 52 1.133 -9.342 7.463 443 HH12 ARG 52 2HH1 ARG 52 2.703 -9.013 8.123 444 HH21 ARG 52 1HH2 ARG 52 2.657 -11.648 10.401 445 HH22 ARG 52 2HH2 ARG 52 3.553 -10.308 9.768 446 HA PRO 53 HA PRO 53 -1.619 -9.630 2.952 447 HB2 PRO 53 2HB PRO 53 -3.544 -7.718 2.724 448 HB3 PRO 53 3HB PRO 53 -3.724 -9.311 1.958 449 HG2 PRO 53 2HG PRO 53 -4.940 -8.302 4.504 450 HG3 PRO 53 3HG PRO 53 -5.674 -9.286 3.219 451 HD2 PRO 53 2HD PRO 53 -4.694 -10.333 5.587 452 HD3 PRO 53 3HD PRO 53 -4.839 -11.261 4.079 453 H ILE 54 H ILE 54 -1.384 -7.053 3.007 454 HA ILE 54 HA ILE 54 -0.928 -6.073 5.718 455 HB ILE 54 HB ILE 54 1.057 -7.431 5.339 456 HG12 ILE 54 2HG1 ILE 54 1.753 -4.478 5.052 457 HG13 ILE 54 3HG1 ILE 54 1.357 -5.298 6.560 458 HG21 ILE 54 1HG2 ILE 54 1.561 -5.849 2.799 459 HG22 ILE 54 2HG2 ILE 54 1.053 -7.537 2.890 460 HG23 ILE 54 3HG2 ILE 54 2.641 -7.062 3.493 461 HD11 ILE 54 3HD1 ILE 54 3.346 -6.712 6.288 462 HD12 ILE 54 1HD1 ILE 54 3.723 -4.993 6.371 463 HD13 ILE 54 2HD1 ILE 54 3.757 -5.822 4.817 464 H VAL 55 H VAL 55 -1.016 -3.904 5.833 465 HA VAL 55 HA VAL 55 -1.301 -2.346 3.343 466 HB VAL 55 HB VAL 55 -2.492 -1.541 6.032 467 HG11 VAL 55 1HG1 VAL 55 -2.310 0.219 4.315 468 HG12 VAL 55 2HG1 VAL 55 -3.999 -0.182 4.635 469 HG13 VAL 55 3HG1 VAL 55 -3.212 -0.788 3.173 470 HG21 VAL 55 3HG2 VAL 55 -3.882 -3.204 3.903 471 HG22 VAL 55 1HG2 VAL 55 -4.661 -2.481 5.308 472 HG23 VAL 55 2HG2 VAL 55 -3.444 -3.739 5.523 473 H ILE 56 H ILE 56 0.337 -0.972 2.999 474 HA ILE 56 HA ILE 56 2.035 -0.061 5.260 475 HB ILE 56 HB ILE 56 2.748 -0.361 2.307 476 HG12 ILE 56 2HG1 ILE 56 2.481 -2.560 3.446 477 HG13 ILE 56 3HG1 ILE 56 4.156 -2.268 2.993 478 HG21 ILE 56 1HG2 ILE 56 4.528 0.420 4.646 479 HG22 ILE 56 2HG2 ILE 56 4.022 1.469 3.320 480 HG23 ILE 56 3HG2 ILE 56 5.083 0.098 3.000 481 HD11 ILE 56 3HD1 ILE 56 4.046 -3.278 5.159 482 HD12 ILE 56 1HD1 ILE 56 2.967 -2.019 5.751 483 HD13 ILE 56 2HD1 ILE 56 4.639 -1.630 5.330 484 H PHE 57 H PHE 57 1.865 2.050 5.738 485 HA PHE 57 HA PHE 57 0.632 3.900 3.802 486 HB2 PHE 57 2HB PHE 57 0.996 4.152 6.805 487 HB3 PHE 57 3HB PHE 57 0.236 5.363 5.781 488 HD1 PHE 57 HD2 PHE 57 -0.153 1.925 7.190 489 HD2 PHE 57 HD1 PHE 57 -2.020 5.086 4.985 490 HE1 PHE 57 HE2 PHE 57 -2.335 0.806 7.389 491 HE2 PHE 57 HE1 PHE 57 -4.175 3.953 5.202 492 HZ PHE 57 HZ PHE 57 -4.330 1.824 6.371 493 H ILE 58 H ILE 58 2.031 4.927 2.612 494 HA ILE 58 HA ILE 58 4.535 6.086 3.718 495 HB ILE 58 HB ILE 58 3.937 5.184 0.848 496 HG12 ILE 58 2HG1 ILE 58 4.276 3.261 2.402 497 HG13 ILE 58 3HG1 ILE 58 5.544 3.362 1.188 498 HG21 ILE 58 1HG2 ILE 58 6.521 6.298 1.995 499 HG22 ILE 58 2HG2 ILE 58 5.453 7.098 0.841 500 HG23 ILE 58 3HG2 ILE 58 6.323 5.639 0.369 501 HD11 ILE 58 3HD1 ILE 58 6.449 2.756 3.341 502 HD12 ILE 58 1HD1 ILE 58 5.772 4.207 4.078 503 HD13 ILE 58 2HD1 ILE 58 7.052 4.344 2.869 504 H ARG 59 H ARG 59 4.905 8.305 3.196 505 HA ARG 59 HA ARG 59 2.589 9.850 2.295 506 HB2 ARG 59 2HB ARG 59 4.220 10.432 4.233 507 HB3 ARG 59 3HB ARG 59 5.331 10.964 2.979 508 HG2 ARG 59 2HG ARG 59 3.567 12.591 2.207 509 HG3 ARG 59 3HG ARG 59 2.577 12.093 3.583 510 HD2 ARG 59 2HD ARG 59 5.301 13.430 3.692 511 HD3 ARG 59 3HD ARG 59 3.757 14.134 4.168 512 HE ARG 59 HE ARG 59 3.780 12.177 5.875 513 HH11 ARG 59 1HH1 ARG 59 6.632 14.007 4.918 514 HH12 ARG 59 2HH1 ARG 59 7.437 13.755 6.433 515 HH21 ARG 59 1HH2 ARG 59 4.855 11.892 7.855 516 HH22 ARG 59 2HH2 ARG 59 6.434 12.567 8.082 517 H GLY 60 H GLY 60 2.776 11.463 0.521 518 HA2 GLY 60 2HA GLY 60 3.365 10.139 -1.872 519 HA3 GLY 60 3HA GLY 60 2.933 11.827 -1.736 520 H ALA 61 H ALA 61 5.364 12.445 -0.121 521 HA ALA 61 HA ALA 61 7.186 12.984 -2.289 522 HB1 ALA 61 3HB ALA 61 7.538 13.394 0.698 523 HB2 ALA 61 1HB ALA 61 6.880 14.575 -0.436 524 HB3 ALA 61 2HB ALA 61 8.567 14.075 -0.566 525 H TYR 62 H TYR 62 7.039 10.784 0.422 526 HA TYR 62 HA TYR 62 9.591 9.548 0.087 527 HB2 TYR 62 2HB TYR 62 7.135 8.631 1.615 528 HB3 TYR 62 3HB TYR 62 8.713 7.855 1.702 529 HD1 TYR 62 HD2 TYR 62 10.639 9.961 2.045 530 HD2 TYR 62 HD1 TYR 62 6.680 9.722 3.614 531 HE1 TYR 62 HE2 TYR 62 11.289 11.410 3.919 532 HE2 TYR 62 HE1 TYR 62 7.330 11.150 5.488 533 HH TYR 62 HH TYR 62 9.344 11.824 6.691 534 H GLU 63 H GLU 63 6.503 9.157 -1.441 535 HA GLU 63 HA GLU 63 6.159 6.448 -1.753 536 HB2 GLU 63 2HB GLU 63 4.445 8.113 -2.396 537 HB3 GLU 63 3HB GLU 63 5.406 8.575 -3.799 538 HG2 GLU 63 2HG GLU 63 5.157 6.247 -4.687 539 HG3 GLU 63 3HG GLU 63 4.147 5.854 -3.304 540 H GLU 64 H GLU 64 8.463 8.417 -3.509 541 HA GLU 64 HA GLU 64 8.908 6.823 -5.742 542 HB2 GLU 64 2HB GLU 64 10.968 8.015 -6.048 543 HB3 GLU 64 3HB GLU 64 9.771 9.123 -5.415 544 HG2 GLU 64 2HG GLU 64 11.612 9.766 -4.188 545 HG3 GLU 64 3HG GLU 64 10.909 8.578 -3.090 546 H VAL 65 H VAL 65 9.945 6.254 -2.436 547 HA VAL 65 HA VAL 65 11.772 4.118 -2.826 548 HB VAL 65 HB VAL 65 9.925 4.571 -0.425 549 HG11 VAL 65 1HG1 VAL 65 11.593 3.284 0.866 550 HG12 VAL 65 2HG1 VAL 65 12.532 3.010 -0.600 551 HG13 VAL 65 3HG1 VAL 65 10.922 2.308 -0.443 552 HG21 VAL 65 3HG2 VAL 65 11.274 6.573 -0.867 553 HG22 VAL 65 1HG2 VAL 65 12.745 5.598 -0.888 554 HG23 VAL 65 2HG2 VAL 65 11.823 5.774 0.610 555 H VAL 66 H VAL 66 8.260 4.238 -2.763 556 HA VAL 66 HA VAL 66 7.583 1.692 -1.939 557 HB VAL 66 HB VAL 66 6.081 3.567 -3.822 558 HG11 VAL 66 1HG1 VAL 66 5.226 1.299 -4.248 559 HG12 VAL 66 2HG1 VAL 66 4.026 2.246 -3.369 560 HG13 VAL 66 3HG1 VAL 66 4.997 1.039 -2.519 561 HG21 VAL 66 3HG2 VAL 66 6.431 4.415 -1.539 562 HG22 VAL 66 1HG2 VAL 66 5.717 2.948 -0.866 563 HG23 VAL 66 2HG2 VAL 66 4.723 4.062 -1.809 564 H ARG 67 H ARG 67 8.598 2.649 -5.257 565 HA ARG 67 HA ARG 67 7.695 0.291 -6.581 566 HB2 ARG 67 2HB ARG 67 8.541 2.483 -7.662 567 HB3 ARG 67 3HB ARG 67 10.162 1.845 -7.448 568 HG2 ARG 67 2HG ARG 67 9.397 -0.183 -8.814 569 HG3 ARG 67 3HG ARG 67 7.928 0.728 -9.178 570 HD2 ARG 67 2HD ARG 67 9.469 1.014 -11.015 571 HD3 ARG 67 3HD ARG 67 9.381 2.545 -10.142 572 HE ARG 67 HE ARG 67 11.490 1.787 -8.993 573 HH11 ARG 67 1HH1 ARG 67 10.792 0.708 -12.281 574 HH12 ARG 67 2HH1 ARG 67 12.464 0.455 -12.667 575 HH21 ARG 67 1HH2 ARG 67 13.657 1.380 -9.507 576 HH22 ARG 67 2HH2 ARG 67 14.080 0.836 -11.099 577 H ASP 68 H ASP 68 10.625 1.023 -4.795 578 HA ASP 68 HA ASP 68 12.132 -1.336 -5.378 579 HB2 ASP 68 2HB ASP 68 13.225 0.709 -4.587 580 HB3 ASP 68 3HB ASP 68 12.275 0.698 -3.106 581 H ILE 69 H ILE 69 10.041 -0.341 -2.689 582 HA ILE 69 HA ILE 69 9.964 -2.664 -1.120 583 HB ILE 69 HB ILE 69 7.874 -0.510 -1.650 584 HG12 ILE 69 2HG1 ILE 69 9.735 -0.899 0.746 585 HG13 ILE 69 3HG1 ILE 69 9.988 0.256 -0.557 586 HG21 ILE 69 1HG2 ILE 69 6.663 -1.262 0.367 587 HG22 ILE 69 2HG2 ILE 69 7.741 -2.651 0.486 588 HG23 ILE 69 3HG2 ILE 69 6.667 -2.490 -0.902 589 HD11 ILE 69 3HD1 ILE 69 9.123 1.379 1.377 590 HD12 ILE 69 1HD1 ILE 69 7.740 0.286 1.455 591 HD13 ILE 69 2HD1 ILE 69 7.906 1.408 0.103 592 H VAL 70 H VAL 70 8.135 -1.734 -3.974 593 HA VAL 70 HA VAL 70 6.200 -3.787 -4.007 594 HB VAL 70 HB VAL 70 7.227 -1.865 -6.143 595 HG11 VAL 70 1HG1 VAL 70 5.026 -3.921 -6.493 596 HG12 VAL 70 2HG1 VAL 70 6.575 -3.898 -7.337 597 HG13 VAL 70 3HG1 VAL 70 5.396 -2.619 -7.622 598 HG21 VAL 70 3HG2 VAL 70 5.003 -0.822 -5.936 599 HG22 VAL 70 1HG2 VAL 70 5.806 -0.889 -4.368 600 HG23 VAL 70 2HG2 VAL 70 4.533 -2.039 -4.751 601 H GLU 71 H GLU 71 9.357 -3.330 -5.629 602 HA GLU 71 HA GLU 71 9.265 -5.579 -7.300 603 HB2 GLU 71 2HB GLU 71 10.914 -3.790 -7.659 604 HB3 GLU 71 3HB GLU 71 11.726 -4.194 -6.145 605 HG2 GLU 71 2HG GLU 71 12.236 -6.473 -7.087 606 HG3 GLU 71 3HG GLU 71 11.528 -5.968 -8.618 607 H TYR 72 H TYR 72 10.595 -5.181 -3.999 608 HA TYR 72 HA TYR 72 11.575 -7.742 -3.546 609 HB2 TYR 72 2HB TYR 72 11.902 -5.933 -1.913 610 HB3 TYR 72 3HB TYR 72 10.176 -5.866 -1.580 611 HD1 TYR 72 HD2 TYR 72 9.090 -7.674 -0.236 612 HD2 TYR 72 HD1 TYR 72 13.313 -7.681 -0.878 613 HE1 TYR 72 HE2 TYR 72 9.338 -9.334 1.541 614 HE2 TYR 72 HE1 TYR 72 13.576 -9.334 0.929 615 HH TYR 72 HH TYR 72 12.217 -10.024 3.026 616 H ALA 73 H ALA 73 8.289 -6.518 -2.833 617 HA ALA 73 HA ALA 73 7.161 -8.934 -1.946 618 HB1 ALA 73 3HB ALA 73 6.177 -6.743 -1.475 619 HB2 ALA 73 1HB ALA 73 4.996 -7.800 -2.251 620 HB3 ALA 73 2HB ALA 73 5.796 -6.529 -3.183 621 H GLN 74 H GLN 74 7.519 -7.589 -5.165 622 HA GLN 74 HA GLN 74 5.684 -9.299 -6.538 623 HB2 GLN 74 2HB GLN 74 6.444 -7.000 -7.298 624 HB3 GLN 74 3HB GLN 74 8.021 -7.686 -7.669 625 HG2 GLN 74 2HG GLN 74 6.952 -9.175 -9.334 626 HG3 GLN 74 3HG GLN 74 5.392 -8.453 -8.972 627 HE21 GLN 74 1HE2 GLN 74 4.953 -6.341 -9.742 628 HE22 GLN 74 2HE2 GLN 74 5.943 -5.579 -10.937 629 H LYS 75 H LYS 75 9.159 -9.371 -5.815 630 HA LYS 75 HA LYS 75 9.720 -11.783 -7.308 631 HB2 LYS 75 2HB LYS 75 11.389 -10.486 -5.108 632 HB3 LYS 75 3HB LYS 75 11.926 -11.754 -6.201 633 HG2 LYS 75 2HG LYS 75 11.343 -8.863 -6.861 634 HG3 LYS 75 3HG LYS 75 12.882 -9.711 -6.963 635 HD2 LYS 75 2HD LYS 75 11.968 -11.092 -8.827 636 HD3 LYS 75 3HD LYS 75 10.451 -10.189 -8.733 637 HE2 LYS 75 2HE LYS 75 11.793 -9.295 -10.546 638 HE3 LYS 75 3HE LYS 75 11.718 -8.093 -9.260 639 HZ1 LYS 75 3HZ LYS 75 13.946 -8.310 -10.162 640 HZ2 LYS 75 1HZ LYS 75 13.984 -9.950 -9.767 641 HZ3 LYS 75 2HZ LYS 75 13.923 -8.784 -8.543 642 H GLU 76 H GLU 76 8.609 -11.014 -4.070 643 HA GLU 76 HA GLU 76 8.982 -13.595 -2.863 644 HB2 GLU 76 2HB GLU 76 7.127 -11.272 -2.163 645 HB3 GLU 76 3HB GLU 76 7.259 -12.726 -1.183 646 HG2 GLU 76 2HG GLU 76 9.518 -10.798 -1.763 647 HG3 GLU 76 3HG GLU 76 8.553 -10.821 -0.293 648 H GLY 77 H GLY 77 7.055 -12.715 -5.419 649 HA2 GLY 77 2HA GLY 77 5.544 -13.957 -6.630 650 HA3 GLY 77 3HA GLY 77 5.496 -15.147 -5.333 651 H LEU 78 H LEU 78 4.974 -11.707 -4.893 652 HA LEU 78 HA LEU 78 2.144 -12.195 -4.165 653 HB2 LEU 78 2HB LEU 78 4.034 -10.069 -3.060 654 HB3 LEU 78 3HB LEU 78 2.370 -10.336 -2.557 655 HG LEU 78 HG LEU 78 4.708 -12.242 -2.103 656 HD11 LEU 78 1HD1 LEU 78 4.389 -11.752 0.275 657 HD12 LEU 78 2HD1 LEU 78 3.144 -10.566 -0.124 658 HD13 LEU 78 3HD1 LEU 78 4.813 -10.306 -0.640 659 HD21 LEU 78 3HD2 LEU 78 3.125 -13.632 -0.848 660 HD22 LEU 78 1HD2 LEU 78 2.622 -13.483 -2.526 661 HD23 LEU 78 2HD2 LEU 78 1.798 -12.550 -1.272 662 H ARG 79 H ARG 79 0.649 -11.060 -5.233 663 HA ARG 79 HA ARG 79 1.247 -9.139 -7.269 664 HB2 ARG 79 2HB ARG 79 -0.741 -10.699 -7.248 665 HB3 ARG 79 3HB ARG 79 -1.413 -9.796 -5.904 666 HG2 ARG 79 2HG ARG 79 -0.885 -8.532 -8.616 667 HG3 ARG 79 3HG ARG 79 -2.394 -9.351 -8.222 668 HD2 ARG 79 2HD ARG 79 -2.541 -7.717 -6.209 669 HD3 ARG 79 3HD ARG 79 -1.280 -6.801 -7.033 670 HE ARG 79 HE ARG 79 -2.836 -6.049 -8.513 671 HH11 ARG 79 1HH1 ARG 79 -4.200 -8.838 -6.903 672 HH12 ARG 79 2HH1 ARG 79 -5.773 -8.608 -7.595 673 HH21 ARG 79 1HH2 ARG 79 -4.953 -5.754 -9.376 674 HH22 ARG 79 2HH2 ARG 79 -6.189 -6.897 -8.970 675 H VAL 80 H VAL 80 1.440 -6.923 -7.004 676 HA VAL 80 HA VAL 80 0.967 -5.836 -4.287 677 HB VAL 80 HB VAL 80 2.887 -4.639 -6.337 678 HG11 VAL 80 1HG1 VAL 80 2.107 -3.083 -4.612 679 HG12 VAL 80 2HG1 VAL 80 3.803 -3.476 -4.335 680 HG13 VAL 80 3HG1 VAL 80 2.554 -4.224 -3.340 681 HG21 VAL 80 3HG2 VAL 80 4.746 -5.689 -5.104 682 HG22 VAL 80 1HG2 VAL 80 3.675 -6.918 -5.785 683 HG23 VAL 80 2HG2 VAL 80 3.596 -6.534 -4.064 684 H LEU 81 H LEU 81 -0.239 -4.044 -4.097 685 HA LEU 81 HA LEU 81 -1.486 -2.800 -6.456 686 HB2 LEU 81 2HB LEU 81 -2.891 -4.686 -5.642 687 HB3 LEU 81 3HB LEU 81 -2.879 -4.010 -4.023 688 HG LEU 81 HG LEU 81 -4.266 -2.139 -4.727 689 HD11 LEU 81 1HD1 LEU 81 -3.368 -1.750 -6.934 690 HD12 LEU 81 2HD1 LEU 81 -5.117 -1.947 -7.019 691 HD13 LEU 81 3HD1 LEU 81 -4.055 -3.269 -7.513 692 HD21 LEU 81 3HD2 LEU 81 -6.320 -3.354 -5.372 693 HD22 LEU 81 1HD2 LEU 81 -5.430 -4.197 -4.103 694 HD23 LEU 81 2HD2 LEU 81 -5.345 -4.774 -5.769 695 H VAL 82 H VAL 82 -0.835 -0.683 -6.169 696 HA VAL 82 HA VAL 82 -0.582 0.335 -3.405 697 HB VAL 82 HB VAL 82 0.725 2.185 -4.281 698 HG11 VAL 82 1HG1 VAL 82 1.653 -0.446 -5.501 699 HG12 VAL 82 2HG1 VAL 82 1.927 0.094 -3.846 700 HG13 VAL 82 3HG1 VAL 82 2.683 0.956 -5.185 701 HG21 VAL 82 3HG2 VAL 82 0.241 1.106 -7.081 702 HG22 VAL 82 1HG2 VAL 82 1.335 2.427 -6.660 703 HG23 VAL 82 2HG2 VAL 82 -0.400 2.610 -6.421 704 H ILE 83 H ILE 83 -2.245 1.370 -2.569 705 HA ILE 83 HA ILE 83 -4.347 2.547 -4.276 706 HB ILE 83 HB ILE 83 -4.305 2.045 -1.251 707 HG12 ILE 83 2HG1 ILE 83 -5.759 0.411 -3.384 708 HG13 ILE 83 3HG1 ILE 83 -4.221 -0.057 -2.666 709 HG21 ILE 83 1HG2 ILE 83 -6.751 2.429 -1.333 710 HG22 ILE 83 2HG2 ILE 83 -6.638 2.810 -3.052 711 HG23 ILE 83 3HG2 ILE 83 -5.858 3.857 -1.865 712 HD11 ILE 83 3HD1 ILE 83 -5.287 -0.167 -0.463 713 HD12 ILE 83 1HD1 ILE 83 -6.020 -1.257 -1.637 714 HD13 ILE 83 2HD1 ILE 83 -6.841 0.243 -1.204 715 H LYS 84 H LYS 84 -3.928 4.699 -4.704 716 HA LYS 84 HA LYS 84 -2.438 6.292 -2.718 717 HB2 LYS 84 2HB LYS 84 -0.877 7.019 -4.631 718 HB3 LYS 84 3HB LYS 84 -0.655 5.407 -3.975 719 HG2 LYS 84 2HG LYS 84 -0.544 4.815 -6.175 720 HG3 LYS 84 3HG LYS 84 -2.296 4.775 -6.033 721 HD2 LYS 84 2HD LYS 84 -1.940 5.973 -8.011 722 HD3 LYS 84 3HD LYS 84 -2.212 7.253 -6.831 723 HE2 LYS 84 2HE LYS 84 0.485 6.320 -7.876 724 HE3 LYS 84 3HE LYS 84 -0.354 7.802 -8.331 725 HZ1 LYS 84 3HZ LYS 84 -0.115 8.595 -6.064 726 HZ2 LYS 84 1HZ LYS 84 1.399 8.208 -6.708 727 HZ3 LYS 84 2HZ LYS 84 0.659 7.167 -5.609 728 H VAL 85 H VAL 85 -2.981 8.312 -2.571 729 HA VAL 85 HA VAL 85 -5.291 9.290 -4.030 730 HB VAL 85 HB VAL 85 -3.770 10.468 -1.647 731 HG11 VAL 85 1HG1 VAL 85 -6.524 11.213 -2.681 732 HG12 VAL 85 2HG1 VAL 85 -5.062 12.184 -2.857 733 HG13 VAL 85 3HG1 VAL 85 -5.729 11.882 -1.252 734 HG21 VAL 85 3HG2 VAL 85 -5.580 9.590 -0.224 735 HG22 VAL 85 1HG2 VAL 85 -4.768 8.279 -1.086 736 HG23 VAL 85 2HG2 VAL 85 -6.350 8.849 -1.632 737 H ALA 86 H ALA 86 -5.171 10.784 -5.638 738 HA ALA 86 HA ALA 86 -2.665 11.372 -6.826 739 HB1 ALA 86 3HB ALA 86 -3.956 12.463 -8.581 740 HB2 ALA 86 1HB ALA 86 -5.401 12.432 -7.566 741 HB3 ALA 86 2HB ALA 86 -4.693 10.921 -8.139 742 H GLN 87 H GLN 87 -5.198 13.755 -5.950 743 HA GLN 87 HA GLN 87 -5.196 15.924 -5.380 744 HB2 GLN 87 2HB GLN 87 -2.662 15.278 -3.831 745 HB3 GLN 87 3HB GLN 87 -3.703 16.666 -3.563 746 HG2 GLN 87 2HG GLN 87 -4.532 13.787 -3.155 747 HG3 GLN 87 3HG GLN 87 -3.949 14.854 -1.879 748 HE21 GLN 87 1HE2 GLN 87 -5.898 14.574 -0.748 749 HE22 GLN 87 2HE2 GLN 87 -7.369 15.327 -1.242 750 H ASP 88 H ASP 88 -1.668 15.595 -5.431 751 HA ASP 88 HA ASP 88 -0.989 17.839 -6.929 752 HB2 ASP 88 2HB ASP 88 0.652 16.671 -5.583 753 HB3 ASP 88 3HB ASP 88 0.415 15.174 -6.474 754 H GLN 89 H GLN 89 -1.249 14.456 -7.971 755 HA GLN 89 HA GLN 89 -1.814 13.404 -9.843 756 HB2 GLN 89 2HB GLN 89 -2.601 16.099 -11.004 757 HB3 GLN 89 3HB GLN 89 -2.921 14.546 -11.766 758 HG2 GLN 89 2HG GLN 89 -4.341 13.920 -9.811 759 HG3 GLN 89 3HG GLN 89 -4.070 15.527 -9.135 760 HE21 GLN 89 1HE2 GLN 89 -5.005 17.339 -10.219 761 HE22 GLN 89 2HE2 GLN 89 -6.341 17.150 -11.296 762 H GLU 90 H GLU 90 0.126 16.360 -10.565 763 HA GLU 90 HA GLU 90 0.917 15.439 -13.170 764 HB2 GLU 90 2HB GLU 90 0.581 17.805 -12.740 765 HB3 GLU 90 3HB GLU 90 1.789 17.798 -11.458 766 HG2 GLU 90 2HG GLU 90 3.536 17.257 -13.203 767 HG3 GLU 90 3HG GLU 90 2.292 17.468 -14.439 768 H LEU 91 H LEU 91 2.905 16.157 -10.246 769 HA LEU 91 HA LEU 91 5.289 14.915 -11.321 770 HB2 LEU 91 2HB LEU 91 4.737 15.652 -8.415 771 HB3 LEU 91 3HB LEU 91 6.309 15.420 -9.167 772 HG LEU 91 HG LEU 91 4.388 17.730 -9.642 773 HD11 LEU 91 1HD1 LEU 91 6.164 19.114 -8.650 774 HD12 LEU 91 2HD1 LEU 91 7.122 17.664 -8.333 775 HD13 LEU 91 3HD1 LEU 91 5.569 17.893 -7.525 776 HD21 LEU 91 3HD2 LEU 91 6.100 18.713 -11.106 777 HD22 LEU 91 1HD2 LEU 91 5.484 17.197 -11.757 778 HD23 LEU 91 2HD2 LEU 91 7.069 17.242 -10.982 779 H LEU 92 H LEU 92 2.649 14.053 -9.273 780 HA LEU 92 HA LEU 92 3.455 11.575 -8.243 781 HB2 LEU 92 2HB LEU 92 1.599 12.807 -7.346 782 HB3 LEU 92 3HB LEU 92 0.761 12.810 -8.880 783 HG LEU 92 HG LEU 92 1.240 10.069 -7.795 784 HD11 LEU 92 1HD1 LEU 92 -0.504 10.171 -6.079 785 HD12 LEU 92 2HD1 LEU 92 -0.633 11.917 -6.295 786 HD13 LEU 92 3HD1 LEU 92 0.859 11.212 -5.667 787 HD21 LEU 92 3HD2 LEU 92 -1.110 9.735 -8.479 788 HD22 LEU 92 1HD2 LEU 92 -0.170 10.468 -9.780 789 HD23 LEU 92 2HD2 LEU 92 -1.267 11.461 -8.818 790 H GLU 93 H GLU 93 1.989 12.503 -11.338 791 HA GLU 93 HA GLU 93 1.270 9.965 -12.333 792 HB2 GLU 93 2HB GLU 93 0.478 12.150 -13.238 793 HB3 GLU 93 3HB GLU 93 2.076 12.475 -13.874 794 HG2 GLU 93 2HG GLU 93 0.445 10.088 -14.790 795 HG3 GLU 93 3HG GLU 93 0.241 11.681 -15.509 796 H ARG 94 H ARG 94 4.305 11.719 -12.357 797 HA ARG 94 HA ARG 94 5.788 10.360 -14.266 798 HB2 ARG 94 2HB ARG 94 6.535 12.433 -13.184 799 HB3 ARG 94 3HB ARG 94 6.705 11.600 -11.644 800 HG2 ARG 94 2HG ARG 94 8.513 10.193 -12.649 801 HG3 ARG 94 3HG ARG 94 8.369 11.132 -14.139 802 HD2 ARG 94 2HD ARG 94 10.239 11.940 -12.768 803 HD3 ARG 94 3HD ARG 94 8.988 13.175 -12.925 804 HE ARG 94 HE ARG 94 8.704 11.570 -10.548 805 HH11 ARG 94 1HH1 ARG 94 10.361 14.392 -11.862 806 HH12 ARG 94 2HH1 ARG 94 10.612 15.114 -10.308 807 HH21 ARG 94 1HH2 ARG 94 9.034 12.528 -8.523 808 HH22 ARG 94 2HH2 ARG 94 9.857 14.052 -8.410 809 H PHE 95 H PHE 95 5.487 9.647 -10.796 810 HA PHE 95 HA PHE 95 7.042 7.218 -10.918 811 HB2 PHE 95 2HB PHE 95 7.023 8.698 -8.913 812 HB3 PHE 95 3HB PHE 95 5.314 8.344 -8.671 813 HD1 PHE 95 HD2 PHE 95 8.651 6.667 -8.943 814 HD2 PHE 95 HD1 PHE 95 4.700 6.493 -7.308 815 HE1 PHE 95 HE2 PHE 95 9.259 4.665 -7.662 816 HE2 PHE 95 HE1 PHE 95 5.323 4.485 -6.039 817 HZ PHE 95 HZ PHE 95 7.593 3.575 -6.216 818 H TYR 96 H TYR 96 3.647 8.101 -10.853 819 HA TYR 96 HA TYR 96 2.374 5.699 -10.277 820 HB2 TYR 96 2HB TYR 96 0.960 7.542 -10.211 821 HB3 TYR 96 3HB TYR 96 1.651 8.267 -11.646 822 HD1 TYR 96 HD1 TYR 96 -0.717 5.616 -10.494 823 HD2 TYR 96 HD2 TYR 96 0.570 8.045 -13.774 824 HE1 TYR 96 HE1 TYR 96 -2.687 4.935 -11.786 825 HE2 TYR 96 HE2 TYR 96 -1.405 7.350 -15.064 826 HH TYR 96 HH TYR 96 -4.059 5.798 -13.686 827 H GLU 97 H GLU 97 3.351 6.997 -13.452 828 HA GLU 97 HA GLU 97 2.330 4.909 -15.063 829 HB2 GLU 97 2HB GLU 97 2.917 7.116 -15.997 830 HB3 GLU 97 3HB GLU 97 4.617 6.854 -15.613 831 HG2 GLU 97 2HG GLU 97 4.713 4.988 -17.216 832 HG3 GLU 97 3HG GLU 97 2.997 5.179 -17.567 833 H GLN 98 H GLN 98 5.470 5.509 -13.565 834 HA GLN 98 HA GLN 98 6.959 3.479 -14.765 835 HB2 GLN 98 2HB GLN 98 7.389 5.485 -12.739 836 HB3 GLN 98 3HB GLN 98 7.964 3.967 -12.068 837 HG2 GLN 98 2HG GLN 98 9.748 5.232 -13.204 838 HG3 GLN 98 3HG GLN 98 9.476 3.654 -13.939 839 HE21 GLN 98 1HE2 GLN 98 10.421 4.297 -15.889 840 HE22 GLN 98 2HE2 GLN 98 9.646 5.370 -16.992 841 H LEU 99 H LEU 99 4.953 3.426 -11.852 842 HA LEU 99 HA LEU 99 5.506 0.856 -10.880 843 HB2 LEU 99 2HB LEU 99 2.969 2.523 -10.848 844 HB3 LEU 99 3HB LEU 99 3.107 1.007 -9.972 845 HG LEU 99 HG LEU 99 4.993 3.341 -9.477 846 HD11 LEU 99 1HD1 LEU 99 2.713 4.102 -9.019 847 HD12 LEU 99 2HD1 LEU 99 3.645 3.929 -7.535 848 HD13 LEU 99 3HD1 LEU 99 2.445 2.708 -7.968 849 HD21 LEU 99 3HD2 LEU 99 5.411 2.162 -7.348 850 HD22 LEU 99 1HD2 LEU 99 5.824 1.169 -8.746 851 HD23 LEU 99 2HD2 LEU 99 4.328 0.863 -7.860 852 H LYS 100 H LYS 100 2.957 1.907 -13.150 853 HA LYS 100 HA LYS 100 1.924 -0.696 -13.683 854 HB2 LYS 100 2HB LYS 100 1.642 1.938 -15.170 855 HB3 LYS 100 3HB LYS 100 0.749 0.484 -15.594 856 HG2 LYS 100 2HG LYS 100 0.378 0.973 -12.756 857 HG3 LYS 100 3HG LYS 100 0.072 2.475 -13.627 858 HD2 LYS 100 2HD LYS 100 -2.013 1.204 -13.374 859 HD3 LYS 100 3HD LYS 100 -1.574 1.311 -15.077 860 HE2 LYS 100 2HE LYS 100 -0.652 -1.002 -14.949 861 HE3 LYS 100 3HE LYS 100 -1.162 -1.091 -13.262 862 HZ1 LYS 100 3HZ LYS 100 -3.450 -0.824 -13.968 863 HZ2 LYS 100 1HZ LYS 100 -2.753 -2.152 -14.746 864 HZ3 LYS 100 2HZ LYS 100 -2.982 -0.703 -15.585 865 H LYS 101 H LYS 101 4.510 1.168 -15.034 866 HA LYS 101 HA LYS 101 4.745 -0.319 -17.504 867 HB2 LYS 101 2HB LYS 101 5.293 2.145 -17.171 868 HB3 LYS 101 3HB LYS 101 6.716 1.645 -16.265 869 HG2 LYS 101 2HG LYS 101 7.661 0.584 -18.236 870 HG3 LYS 101 3HG LYS 101 6.179 0.891 -19.154 871 HD2 LYS 101 2HD LYS 101 6.564 3.362 -18.857 872 HD3 LYS 101 3HD LYS 101 8.102 2.994 -18.067 873 HE2 LYS 101 2HE LYS 101 8.935 1.959 -20.110 874 HE3 LYS 101 3HE LYS 101 7.374 2.188 -20.896 875 HZ1 LYS 101 3HZ LYS 101 7.677 4.568 -20.738 876 HZ2 LYS 101 1HZ LYS 101 8.966 3.864 -21.568 877 HZ3 LYS 101 2HZ LYS 101 9.162 4.364 -19.965 878 H ASP 102 H ASP 102 6.095 -0.425 -14.278 879 HA ASP 102 HA ASP 102 7.988 -2.558 -14.837 880 HB2 ASP 102 2HB ASP 102 7.067 -1.115 -12.340 881 HB3 ASP 102 3HB ASP 102 7.897 -2.659 -12.164 882 H GLY 103 H GLY 103 4.698 -2.532 -14.790 883 HA2 GLY 103 2HA GLY 103 3.260 -4.308 -15.085 884 HA3 GLY 103 3HA GLY 103 4.552 -5.420 -14.655 885 H VAL 104 H VAL 104 3.165 -2.684 -12.886 886 HA VAL 104 HA VAL 104 2.378 -4.475 -10.649 887 HB VAL 104 HB VAL 104 3.296 -1.564 -10.426 888 HG11 VAL 104 1HG1 VAL 104 3.416 -1.991 -8.005 889 HG12 VAL 104 2HG1 VAL 104 2.832 -3.638 -8.251 890 HG13 VAL 104 3HG1 VAL 104 1.778 -2.265 -8.606 891 HG21 VAL 104 3HG2 VAL 104 5.174 -2.992 -11.162 892 HG22 VAL 104 1HG2 VAL 104 4.890 -4.076 -9.794 893 HG23 VAL 104 2HG2 VAL 104 5.415 -2.413 -9.512 894 H ASP 105 H ASP 105 0.428 -4.011 -9.606 895 HA ASP 105 HA ASP 105 -1.554 -2.626 -11.221 896 HB2 ASP 105 2HB ASP 105 -1.715 -4.957 -9.875 897 HB3 ASP 105 3HB ASP 105 -2.227 -3.907 -8.568 898 H VAL 106 H VAL 106 -2.601 -0.746 -10.617 899 HA VAL 106 HA VAL 106 -1.969 0.494 -8.016 900 HB VAL 106 HB VAL 106 -1.424 2.638 -8.907 901 HG11 VAL 106 1HG1 VAL 106 0.583 2.298 -10.296 902 HG12 VAL 106 2HG1 VAL 106 0.071 0.646 -10.648 903 HG13 VAL 106 3HG1 VAL 106 0.490 1.107 -8.997 904 HG21 VAL 106 3HG2 VAL 106 -2.198 1.645 -11.663 905 HG22 VAL 106 1HG2 VAL 106 -1.433 3.201 -11.336 906 HG23 VAL 106 2HG2 VAL 106 -3.038 2.855 -10.694 907 H ARG 107 H ARG 107 -3.643 1.679 -7.163 908 HA ARG 107 HA ARG 107 -6.048 2.201 -8.794 909 HB2 ARG 107 2HB ARG 107 -5.916 1.238 -5.908 910 HB3 ARG 107 3HB ARG 107 -7.359 1.986 -6.592 911 HG2 ARG 107 2HG ARG 107 -7.474 0.190 -8.299 912 HG3 ARG 107 3HG ARG 107 -6.048 -0.567 -7.587 913 HD2 ARG 107 2HD ARG 107 -7.281 -0.872 -5.477 914 HD3 ARG 107 3HD ARG 107 -8.713 -0.133 -6.192 915 HE ARG 107 HE ARG 107 -7.529 -2.594 -7.334 916 HH11 ARG 107 1HH1 ARG 107 -10.327 -0.937 -5.978 917 HH12 ARG 107 2HH1 ARG 107 -11.423 -2.228 -6.350 918 HH21 ARG 107 1HH2 ARG 107 -8.984 -4.277 -7.823 919 HH22 ARG 107 2HH2 ARG 107 -10.658 -4.123 -7.398 920 H VAL 108 H VAL 108 -6.013 4.298 -9.176 921 HA VAL 108 HA VAL 108 -5.095 6.255 -7.215 922 HB VAL 108 HB VAL 108 -5.663 7.990 -8.919 923 HG11 VAL 108 1HG1 VAL 108 -3.910 7.415 -10.559 924 HG12 VAL 108 2HG1 VAL 108 -3.934 5.740 -10.000 925 HG13 VAL 108 3HG1 VAL 108 -3.420 7.029 -8.910 926 HG21 VAL 108 3HG2 VAL 108 -7.545 6.918 -10.066 927 HG22 VAL 108 1HG2 VAL 108 -6.477 5.665 -10.704 928 HG23 VAL 108 2HG2 VAL 108 -6.291 7.341 -11.230 929 H THR 109 H THR 109 -6.393 7.310 -5.873 930 HA THR 109 HA THR 109 -9.300 6.778 -5.951 931 HB THR 109 HB THR 109 -9.162 7.215 -3.453 932 HG1 THR 109 HG1 THR 109 -6.583 6.736 -3.062 933 HG21 THR 109 3HG2 THR 109 -9.157 4.895 -4.315 934 HG22 THR 109 1HG2 THR 109 -8.120 5.034 -2.898 935 HG23 THR 109 2HG2 THR 109 -7.402 4.955 -4.509 936 H ASP 110 H ASP 110 -6.966 9.264 -4.868 937 HA ASP 110 HA ASP 110 -6.829 11.501 -5.062 938 HB2 ASP 110 2HB ASP 110 -7.414 11.302 -7.436 939 HB3 ASP 110 3HB ASP 110 -9.129 11.249 -7.044 940 H ASN 111 H ASN 111 -10.360 10.939 -5.183 941 HA ASN 111 HA ASN 111 -11.079 12.537 -2.971 942 HB2 ASN 111 2HB ASN 111 -12.728 11.732 -4.600 943 HB3 ASN 111 3HB ASN 111 -12.353 10.058 -4.202 944 HD21 ASN 111 1HD2 ASN 111 -14.538 9.676 -3.780 945 HD22 ASN 111 2HD2 ASN 111 -15.311 10.234 -2.340 946 H GLU 112 H GLU 112 -10.729 12.177 -0.834 947 HA GLU 112 HA GLU 112 -9.159 10.008 0.111 948 HB2 GLU 112 2HB GLU 112 -9.364 11.050 2.327 949 HB3 GLU 112 3HB GLU 112 -9.019 12.246 1.089 950 HG2 GLU 112 2HG GLU 112 -10.624 13.397 2.274 951 HG3 GLU 112 3HG GLU 112 -11.649 12.585 1.092 952 H ASP 113 H ASP 113 -12.601 10.494 -0.101 953 HA ASP 113 HA ASP 113 -13.490 8.525 1.740 954 HB2 ASP 113 2HB ASP 113 -14.982 10.282 0.822 955 HB3 ASP 113 3HB ASP 113 -14.857 9.572 -0.782 956 H GLU 114 H GLU 114 -12.748 8.453 -1.733 957 HA GLU 114 HA GLU 114 -13.369 5.764 -2.248 958 HB2 GLU 114 2HB GLU 114 -11.428 7.690 -3.570 959 HB3 GLU 114 3HB GLU 114 -11.637 6.044 -4.152 960 HG2 GLU 114 2HG GLU 114 -13.812 8.148 -4.003 961 HG3 GLU 114 3HG GLU 114 -12.944 7.657 -5.458 962 H ALA 115 H ALA 115 -10.399 7.297 -1.074 963 HA ALA 115 HA ALA 115 -8.750 4.974 -1.096 964 HB1 ALA 115 3HB ALA 115 -8.505 7.531 0.520 965 HB2 ALA 115 1HB ALA 115 -7.867 7.267 -1.103 966 HB3 ALA 115 2HB ALA 115 -7.222 6.345 0.255 967 H LYS 116 H LYS 116 -10.895 6.413 1.300 968 HA LYS 116 HA LYS 116 -10.123 4.931 3.587 969 HB2 LYS 116 2HB LYS 116 -11.284 7.118 3.600 970 HB3 LYS 116 3HB LYS 116 -12.692 6.381 2.847 971 HG2 LYS 116 2HG LYS 116 -12.862 4.911 4.943 972 HG3 LYS 116 3HG LYS 116 -11.663 5.988 5.670 973 HD2 LYS 116 2HD LYS 116 -14.363 6.800 4.554 974 HD3 LYS 116 3HD LYS 116 -13.957 6.677 6.268 975 HE2 LYS 116 2HE LYS 116 -12.769 8.643 4.273 976 HE3 LYS 116 3HE LYS 116 -13.960 9.017 5.514 977 HZ1 LYS 116 3HZ LYS 116 -11.850 9.696 6.290 978 HZ2 LYS 116 1HZ LYS 116 -11.144 8.199 5.935 979 HZ3 LYS 116 2HZ LYS 116 -12.282 8.322 7.176 980 H LYS 117 H LYS 117 -12.841 4.653 1.315 981 HA LYS 117 HA LYS 117 -14.007 2.355 2.518 982 HB2 LYS 117 2HB LYS 117 -15.555 2.331 0.666 983 HB3 LYS 117 3HB LYS 117 -15.316 3.994 1.183 984 HG2 LYS 117 2HG LYS 117 -13.855 4.423 -0.721 985 HG3 LYS 117 3HG LYS 117 -13.952 2.738 -1.222 986 HD2 LYS 117 2HD LYS 117 -16.353 4.602 -1.098 987 HD3 LYS 117 3HD LYS 117 -15.376 4.352 -2.546 988 HE2 LYS 117 2HE LYS 117 -17.283 2.940 -2.766 989 HE3 LYS 117 3HE LYS 117 -15.928 1.884 -2.386 990 HZ1 LYS 117 3HZ LYS 117 -17.932 2.838 -0.409 991 HZ2 LYS 117 1HZ LYS 117 -16.713 1.700 -0.138 992 HZ3 LYS 117 2HZ LYS 117 -17.989 1.339 -1.185 993 H ARG 118 H ARG 118 -11.592 2.847 0.032 994 HA ARG 118 HA ARG 118 -11.785 0.437 -1.382 995 HB2 ARG 118 2HB ARG 118 -10.354 2.599 -1.869 996 HB3 ARG 118 3HB ARG 118 -9.111 1.805 -0.919 997 HG2 ARG 118 2HG ARG 118 -8.528 1.161 -3.073 998 HG3 ARG 118 3HG ARG 118 -9.512 -0.213 -2.568 999 HD2 ARG 118 2HD ARG 118 -10.414 2.120 -4.290 1000 HD3 ARG 118 3HD ARG 118 -10.063 0.492 -4.852 1001 HE ARG 118 HE ARG 118 -12.022 -0.209 -3.409 1002 HH11 ARG 118 1HH1 ARG 118 -11.869 3.010 -4.855 1003 HH12 ARG 118 2HH1 ARG 118 -13.590 3.205 -4.914 1004 HH21 ARG 118 1HH2 ARG 118 -14.279 0.042 -3.541 1005 HH22 ARG 118 2HH2 ARG 118 -14.962 1.509 -4.166 1006 H LEU 119 H LEU 119 -10.015 1.297 1.552 1007 HA LEU 119 HA LEU 119 -8.494 -1.087 1.768 1008 HB2 LEU 119 2HB LEU 119 -9.236 1.076 3.761 1009 HB3 LEU 119 3HB LEU 119 -8.220 -0.295 4.205 1010 HG LEU 119 HG LEU 119 -7.574 1.708 2.007 1011 HD11 LEU 119 1HD1 LEU 119 -7.398 2.699 4.253 1012 HD12 LEU 119 2HD1 LEU 119 -5.831 2.543 3.465 1013 HD13 LEU 119 3HD1 LEU 119 -6.293 1.406 4.733 1014 HD21 LEU 119 3HD2 LEU 119 -5.913 -0.585 3.108 1015 HD22 LEU 119 1HD2 LEU 119 -5.425 0.565 1.866 1016 HD23 LEU 119 2HD2 LEU 119 -6.728 -0.565 1.539 1017 H LYS 120 H LYS 120 -11.434 -0.028 3.515 1018 HA LYS 120 HA LYS 120 -11.835 -2.413 4.961 1019 HB2 LYS 120 2HB LYS 120 -12.956 -0.253 5.470 1020 HB3 LYS 120 3HB LYS 120 -13.920 -0.410 4.007 1021 HG2 LYS 120 2HG LYS 120 -14.956 -2.488 4.948 1022 HG3 LYS 120 3HG LYS 120 -14.031 -2.251 6.433 1023 HD2 LYS 120 2HD LYS 120 -16.068 -0.288 5.303 1024 HD3 LYS 120 3HD LYS 120 -16.385 -1.428 6.612 1025 HE2 LYS 120 2HE LYS 120 -14.768 -0.303 8.044 1026 HE3 LYS 120 3HE LYS 120 -14.280 0.762 6.723 1027 HZ1 LYS 120 3HZ LYS 120 -16.955 0.685 8.013 1028 HZ2 LYS 120 1HZ LYS 120 -16.539 1.658 6.699 1029 HZ3 LYS 120 2HZ LYS 120 -15.791 1.893 8.189 1030 H GLU 121 H GLU 121 -12.754 -1.469 1.695 1031 HA GLU 121 HA GLU 121 -14.559 -3.574 1.084 1032 HB2 GLU 121 2HB GLU 121 -14.507 -1.518 -0.232 1033 HB3 GLU 121 3HB GLU 121 -12.844 -1.819 -0.719 1034 HG2 GLU 121 2HG GLU 121 -13.604 -3.859 -1.936 1035 HG3 GLU 121 3HG GLU 121 -15.268 -3.477 -1.495 1036 H LEU 122 H LEU 122 -11.115 -3.084 0.293 1037 HA LEU 122 HA LEU 122 -10.874 -5.542 -1.137 1038 HB2 LEU 122 2HB LEU 122 -8.737 -3.615 -0.137 1039 HB3 LEU 122 3HB LEU 122 -8.417 -4.999 -1.174 1040 HG LEU 122 HG LEU 122 -10.039 -2.524 -1.897 1041 HD11 LEU 122 1HD1 LEU 122 -7.437 -3.569 -3.040 1042 HD12 LEU 122 2HD1 LEU 122 -7.627 -2.182 -1.965 1043 HD13 LEU 122 3HD1 LEU 122 -8.316 -2.135 -3.585 1044 HD21 LEU 122 3HD2 LEU 122 -11.144 -4.432 -2.910 1045 HD22 LEU 122 1HD2 LEU 122 -9.614 -5.008 -3.579 1046 HD23 LEU 122 2HD2 LEU 122 -10.316 -3.490 -4.145 1047 H LEU 123 H LEU 123 -10.362 -4.585 2.191 1048 HA LEU 123 HA LEU 123 -8.980 -6.829 3.162 1049 HB2 LEU 123 2HB LEU 123 -10.645 -4.663 4.341 1050 HB3 LEU 123 3HB LEU 123 -10.615 -6.134 5.293 1051 HG LEU 123 HG LEU 123 -8.183 -6.016 5.517 1052 HD11 LEU 123 1HD1 LEU 123 -8.224 -3.486 3.868 1053 HD12 LEU 123 2HD1 LEU 123 -7.562 -5.041 3.366 1054 HD13 LEU 123 3HD1 LEU 123 -6.830 -4.170 4.711 1055 HD21 LEU 123 3HD2 LEU 123 -8.025 -3.996 6.895 1056 HD22 LEU 123 1HD2 LEU 123 -9.537 -4.858 7.164 1057 HD23 LEU 123 2HD2 LEU 123 -9.523 -3.389 6.184 1058 H GLU 124 H GLU 124 -12.449 -6.366 2.502 1059 HA GLU 124 HA GLU 124 -13.464 -8.789 3.562 1060 HB2 GLU 124 2HB GLU 124 -14.457 -7.337 1.061 1061 HB3 GLU 124 3HB GLU 124 -15.375 -8.486 2.029 1062 HG2 GLU 124 2HG GLU 124 -15.444 -6.920 3.898 1063 HG3 GLU 124 3HG GLU 124 -14.411 -5.790 3.022 1064 H LYS 125 H LYS 125 -12.222 -7.942 0.358 1065 HA LYS 125 HA LYS 125 -12.496 -10.575 -0.803 1066 HB2 LYS 125 2HB LYS 125 -11.122 -8.040 -1.802 1067 HB3 LYS 125 3HB LYS 125 -11.213 -9.520 -2.738 1068 HG2 LYS 125 2HG LYS 125 -12.895 -8.070 -3.589 1069 HG3 LYS 125 3HG LYS 125 -13.734 -9.320 -2.668 1070 HD2 LYS 125 2HD LYS 125 -13.887 -7.721 -0.741 1071 HD3 LYS 125 3HD LYS 125 -13.143 -6.482 -1.748 1072 HE2 LYS 125 2HE LYS 125 -15.045 -6.465 -3.236 1073 HE3 LYS 125 3HE LYS 125 -15.748 -7.868 -2.430 1074 HZ1 LYS 125 3HZ LYS 125 -16.780 -5.763 -1.772 1075 HZ2 LYS 125 1HZ LYS 125 -15.309 -5.235 -1.133 1076 HZ3 LYS 125 2HZ LYS 125 -16.089 -6.567 -0.456 1077 H VAL 126 H VAL 126 -10.262 -9.160 1.258 1078 HA VAL 126 HA VAL 126 -8.147 -9.398 1.907 1079 HB VAL 126 HB VAL 126 -8.335 -12.213 0.728 1080 HG11 VAL 126 1HG1 VAL 126 -6.579 -12.827 2.346 1081 HG12 VAL 126 2HG1 VAL 126 -6.475 -11.151 2.883 1082 HG13 VAL 126 3HG1 VAL 126 -6.002 -11.579 1.239 1083 HG21 VAL 126 3HG2 VAL 126 -9.001 -12.929 3.000 1084 HG22 VAL 126 1HG2 VAL 126 -10.161 -11.786 2.320 1085 HG23 VAL 126 2HG2 VAL 126 -8.999 -11.247 3.536 1086 H GLY 127 H GLY 127 -7.733 -7.734 0.358 1087 HA2 GLY 127 2HA GLY 127 -5.765 -7.010 -0.782 1088 HA3 GLY 127 3HA GLY 127 -5.717 -8.526 -1.655 1089 H SER 128 H SER 128 -8.106 -8.823 -2.851 1090 HA SER 128 HA SER 128 -9.191 -6.537 -4.148 1091 HB2 SER 128 2HB SER 128 -8.101 -6.889 -6.430 1092 HB3 SER 128 3HB SER 128 -7.015 -6.254 -5.191 1093 HG SER 128 HG SER 128 -5.971 -8.125 -5.104 1094 H LEU 129 H LEU 129 -8.144 -9.827 -5.018 1095 HA LEU 129 HA LEU 129 -9.091 -11.624 -5.951 1096 HB2 LEU 129 2HB LEU 129 -10.428 -11.387 -3.752 1097 HB3 LEU 129 3HB LEU 129 -11.742 -10.787 -4.751 1098 HG LEU 129 HG LEU 129 -11.747 -12.972 -6.006 1099 HD11 LEU 129 1HD1 LEU 129 -9.421 -13.642 -5.646 1100 HD12 LEU 129 2HD1 LEU 129 -10.529 -14.901 -5.114 1101 HD13 LEU 129 3HD1 LEU 129 -9.732 -13.871 -3.923 1102 HD21 LEU 129 3HD2 LEU 129 -13.307 -12.620 -4.137 1103 HD22 LEU 129 1HD2 LEU 129 -12.118 -13.285 -3.012 1104 HD23 LEU 129 2HD2 LEU 129 -12.818 -14.308 -4.272 1105 H GLU 130 H GLU 130 -9.046 -9.163 -7.445 1106 HA GLU 130 HA GLU 130 -9.473 -8.405 -9.500 1107 HB2 GLU 130 2HB GLU 130 -10.228 -11.303 -9.991 1108 HB3 GLU 130 3HB GLU 130 -9.836 -10.133 -11.248 1109 HG2 GLU 130 2HG GLU 130 -7.974 -11.219 -9.118 1110 HG3 GLU 130 3HG GLU 130 -7.911 -11.538 -10.849 1111 H HIS 131 H HIS 131 -11.588 -7.764 -7.846 1112 HA HIS 131 HA HIS 131 -13.373 -6.393 -8.178 1113 HB2 HIS 131 2HB HIS 131 -12.283 -5.766 -10.278 1114 HB3 HIS 131 3HB HIS 131 -12.948 -7.167 -11.094 1115 HD1 HIS 131 HD1 HIS 131 -13.879 -3.746 -9.865 1116 HD2 HIS 131 HD2 HIS 131 -15.495 -6.800 -12.159 1117 HE1 HIS 131 HE1 HIS 131 -15.893 -2.763 -10.973 1118 HE2 HIS 131 HE2 HIS 131 -16.678 -4.548 -12.551 1119 H HIS 132 H HIS 132 -13.554 -9.670 -8.523 1120 HA HIS 132 HA HIS 132 -15.109 -11.286 -8.555 1121 HB2 HIS 132 2HB HIS 132 -16.996 -9.052 -7.697 1122 HB3 HIS 132 3HB HIS 132 -17.432 -10.756 -7.705 1123 HD1 HIS 132 HD1 HIS 132 -17.580 -9.198 -5.112 1124 HD2 HIS 132 HD2 HIS 132 -14.198 -11.312 -6.278 1125 HE1 HIS 132 HE1 HIS 132 -16.352 -9.728 -2.997 1126 HE2 HIS 132 HE2 HIS 132 -14.472 -11.225 -3.715 1127 H HIS 133 H HIS 133 -17.678 -11.590 -9.396 1128 HA HIS 133 HA HIS 133 -17.483 -11.262 -12.283 1129 HB2 HIS 133 2HB HIS 133 -19.646 -12.591 -10.579 1130 HB3 HIS 133 3HB HIS 133 -19.612 -12.597 -12.338 1131 HD1 HIS 133 HD1 HIS 133 -19.260 -15.044 -12.764 1132 HD2 HIS 133 HD2 HIS 133 -16.511 -13.545 -10.041 1133 HE1 HIS 133 HE1 HIS 133 -17.629 -16.899 -12.352 1134 HE2 HIS 133 HE2 HIS 133 -15.868 -15.885 -10.886 1135 H HIS 134 H HIS 134 -17.550 -8.922 -12.236 1136 HA HIS 134 HA HIS 134 -20.282 -7.807 -12.118 1137 HB2 HIS 134 2HB HIS 134 -18.989 -7.295 -9.978 1138 HB3 HIS 134 3HB HIS 134 -17.844 -6.379 -10.948 1139 HD1 HIS 134 HD1 HIS 134 -18.591 -4.030 -11.744 1140 HD2 HIS 134 HD2 HIS 134 -21.532 -6.101 -9.669 1141 HE1 HIS 134 HE1 HIS 134 -20.392 -2.356 -11.267 1142 HE2 HIS 134 HE2 HIS 134 -22.113 -3.609 -9.940 1143 H HIS 135 H HIS 135 -20.283 -7.943 -14.366 1144 HA HIS 135 HA HIS 135 -18.489 -6.930 -16.220 1145 HB2 HIS 135 2HB HIS 135 -21.535 -7.018 -16.355 1146 HB3 HIS 135 3HB HIS 135 -20.502 -6.656 -17.735 1147 HD1 HIS 135 HD1 HIS 135 -22.099 -9.420 -16.021 1148 HD2 HIS 135 HD2 HIS 135 -18.745 -8.930 -18.431 1149 HE1 HIS 135 HE1 HIS 135 -21.532 -11.713 -16.858 1150 HE2 HIS 135 HE2 HIS 135 -19.443 -11.407 -18.227 1151 H HIS 136 H HIS 136 -17.604 -4.972 -16.162 1152 HA HIS 136 HA HIS 136 -17.144 -2.801 -15.835 1153 HB2 HIS 136 2HB HIS 136 -18.850 -2.555 -17.697 1154 HB3 HIS 136 3HB HIS 136 -20.077 -2.264 -16.472 1155 HD1 HIS 136 HD1 HIS 136 -17.823 -0.516 -18.637 1156 HD2 HIS 136 HD2 HIS 136 -19.366 0.198 -14.848 1157 HE1 HIS 136 HE1 HIS 136 -17.530 1.939 -18.236 1158 HE2 HIS 136 HE2 HIS 136 -18.254 2.285 -15.860 Start of MODEL 13 1 H1 MET 1 1H MET 1 -2.928 -15.656 -2.686 2 H2 MET 1 2H MET 1 -1.452 -15.995 -1.945 3 H3 MET 1 3H MET 1 -1.596 -14.652 -2.951 4 HA MET 1 HA MET 1 -3.169 -13.651 -1.428 5 HB2 MET 1 2HB MET 1 -2.476 -16.054 0.314 6 HB3 MET 1 3HB MET 1 -3.371 -14.648 0.870 7 HG2 MET 1 2HG MET 1 -5.125 -15.183 -0.856 8 HG3 MET 1 3HG MET 1 -4.262 -16.688 -1.176 9 HE1 MET 1 3HE MET 1 -6.271 -15.673 2.875 10 HE2 MET 1 1HE MET 1 -6.270 -14.592 1.481 11 HE3 MET 1 2HE MET 1 -4.776 -14.893 2.370 12 H GLY 2 H GLY 2 -2.305 -12.899 1.010 13 HA2 GLY 2 2HA GLY 2 -0.655 -11.719 2.106 14 HA3 GLY 2 3HA GLY 2 0.554 -12.627 1.206 15 H THR 3 H THR 3 -2.065 -10.655 -0.103 16 HA THR 3 HA THR 3 -0.450 -9.410 -2.060 17 HB THR 3 HB THR 3 -3.222 -8.542 -1.117 18 HG1 THR 3 HG1 THR 3 -4.016 -10.055 -2.565 19 HG21 THR 3 3HG2 THR 3 -2.168 -6.918 -2.657 20 HG22 THR 3 1HG2 THR 3 -3.501 -7.753 -3.459 21 HG23 THR 3 2HG2 THR 3 -1.835 -8.211 -3.809 22 H VAL 4 H VAL 4 0.409 -7.324 -2.160 23 HA VAL 4 HA VAL 4 0.784 -5.981 0.454 24 HB VAL 4 HB VAL 4 2.402 -5.554 -2.123 25 HG11 VAL 4 1HG1 VAL 4 3.060 -4.854 0.768 26 HG12 VAL 4 2HG1 VAL 4 2.587 -3.714 -0.494 27 HG13 VAL 4 3HG1 VAL 4 4.114 -4.589 -0.624 28 HG21 VAL 4 3HG2 VAL 4 3.083 -7.432 0.171 29 HG22 VAL 4 1HG2 VAL 4 4.132 -7.057 -1.200 30 HG23 VAL 4 2HG2 VAL 4 2.612 -7.916 -1.457 31 H VAL 5 H VAL 5 -0.627 -4.326 0.710 32 HA VAL 5 HA VAL 5 -1.498 -2.763 -1.664 33 HB VAL 5 HB VAL 5 -3.639 -2.291 -0.353 34 HG11 VAL 5 1HG1 VAL 5 -3.123 -5.205 -1.070 35 HG12 VAL 5 2HG1 VAL 5 -3.592 -3.926 -2.189 36 HG13 VAL 5 3HG1 VAL 5 -4.713 -4.441 -0.932 37 HG21 VAL 5 3HG2 VAL 5 -4.307 -3.843 1.463 38 HG22 VAL 5 1HG2 VAL 5 -2.884 -2.904 1.922 39 HG23 VAL 5 2HG2 VAL 5 -2.704 -4.587 1.426 40 H ILE 6 H ILE 6 -0.596 -0.794 -1.652 41 HA ILE 6 HA ILE 6 0.496 0.255 0.895 42 HB ILE 6 HB ILE 6 1.264 1.090 -1.953 43 HG12 ILE 6 2HG1 ILE 6 3.515 -0.074 -1.308 44 HG13 ILE 6 3HG1 ILE 6 2.596 -0.901 -0.060 45 HG21 ILE 6 1HG2 ILE 6 3.152 2.243 -0.843 46 HG22 ILE 6 2HG2 ILE 6 2.530 1.766 0.732 47 HG23 ILE 6 3HG2 ILE 6 1.600 2.866 -0.286 48 HD11 ILE 6 3HD1 ILE 6 2.109 -1.070 -3.031 49 HD12 ILE 6 1HD1 ILE 6 1.196 -1.925 -1.784 50 HD13 ILE 6 2HD1 ILE 6 2.907 -2.279 -2.028 51 H VAL 7 H VAL 7 -0.894 1.663 1.826 52 HA VAL 7 HA VAL 7 -2.566 3.468 0.240 53 HB VAL 7 HB VAL 7 -2.342 3.199 3.277 54 HG11 VAL 7 1HG1 VAL 7 -4.380 4.740 1.607 55 HG12 VAL 7 2HG1 VAL 7 -3.133 5.447 2.638 56 HG13 VAL 7 3HG1 VAL 7 -4.446 4.515 3.357 57 HG21 VAL 7 3HG2 VAL 7 -4.469 1.988 3.146 58 HG22 VAL 7 1HG2 VAL 7 -3.225 1.168 2.202 59 HG23 VAL 7 2HG2 VAL 7 -4.462 2.127 1.386 60 H VAL 8 H VAL 8 -1.811 5.324 -0.388 61 HA VAL 8 HA VAL 8 0.245 6.790 1.145 62 HB VAL 8 HB VAL 8 -0.056 6.668 -1.893 63 HG11 VAL 8 1HG1 VAL 8 2.017 7.977 -2.005 64 HG12 VAL 8 2HG1 VAL 8 2.071 8.074 -0.244 65 HG13 VAL 8 3HG1 VAL 8 0.766 8.865 -1.131 66 HG21 VAL 8 3HG2 VAL 8 2.116 5.453 -0.153 67 HG22 VAL 8 1HG2 VAL 8 2.076 5.444 -1.917 68 HG23 VAL 8 2HG2 VAL 8 0.853 4.562 -1.004 69 H SER 9 H SER 9 0.018 9.020 1.189 70 HA SER 9 HA SER 9 -2.084 10.413 -0.211 71 HB2 SER 9 2HB SER 9 -3.394 9.524 1.695 72 HB3 SER 9 3HB SER 9 -2.211 10.174 2.834 73 HG SER 9 HG SER 9 -4.239 11.446 1.463 74 H ASN 10 H ASN 10 -2.060 12.741 0.339 75 HA ASN 10 HA ASN 10 0.678 13.694 0.638 76 HB2 ASN 10 2HB ASN 10 -0.266 15.912 -0.034 77 HB3 ASN 10 3HB ASN 10 -0.568 14.641 -1.204 78 HD21 ASN 10 1HD2 ASN 10 -2.196 16.051 -2.050 79 HD22 ASN 10 2HD2 ASN 10 -3.758 16.131 -1.314 80 H ASP 11 H ASP 11 -1.480 12.816 2.890 81 HA ASP 11 HA ASP 11 -0.504 14.757 4.832 82 HB2 ASP 11 2HB ASP 11 -2.622 15.724 3.894 83 HB3 ASP 11 3HB ASP 11 -3.485 14.300 4.455 84 H GLU 12 H GLU 12 -0.748 14.136 6.998 85 HA GLU 12 HA GLU 12 -0.372 11.284 7.366 86 HB2 GLU 12 2HB GLU 12 -0.041 13.570 9.359 87 HB3 GLU 12 3HB GLU 12 0.444 11.900 9.630 88 HG2 GLU 12 2HG GLU 12 2.430 13.058 9.115 89 HG3 GLU 12 3HG GLU 12 2.027 12.154 7.662 90 H ARG 13 H ARG 13 -2.711 13.768 8.334 91 HA ARG 13 HA ARG 13 -4.162 12.075 10.156 92 HB2 ARG 13 2HB ARG 13 -5.141 14.573 8.716 93 HB3 ARG 13 3HB ARG 13 -6.004 13.726 9.994 94 HG2 ARG 13 2HG ARG 13 -3.960 14.258 11.483 95 HG3 ARG 13 3HG ARG 13 -3.484 15.382 10.205 96 HD2 ARG 13 2HD ARG 13 -6.024 15.444 11.871 97 HD3 ARG 13 3HD ARG 13 -4.722 16.635 11.856 98 HE ARG 13 HE ARG 13 -5.417 17.083 9.467 99 HH11 ARG 13 1HH1 ARG 13 -7.775 15.911 11.814 100 HH12 ARG 13 2HH1 ARG 13 -9.124 16.623 10.989 101 HH21 ARG 13 1HH2 ARG 13 -7.210 18.040 8.413 102 HH22 ARG 13 2HH2 ARG 13 -8.804 17.826 9.064 103 H ILE 14 H ILE 14 -4.201 12.623 6.683 104 HA ILE 14 HA ILE 14 -6.645 11.169 6.184 105 HB ILE 14 HB ILE 14 -4.369 11.798 4.239 106 HG12 ILE 14 2HG1 ILE 14 -5.303 13.874 5.110 107 HG13 ILE 14 3HG1 ILE 14 -5.877 13.660 3.461 108 HG21 ILE 14 1HG2 ILE 14 -6.033 11.396 2.444 109 HG22 ILE 14 2HG2 ILE 14 -7.223 10.899 3.648 110 HG23 ILE 14 3HG2 ILE 14 -5.760 9.942 3.405 111 HD11 ILE 14 3HD1 ILE 14 -8.044 12.864 4.351 112 HD12 ILE 14 1HD1 ILE 14 -7.639 14.504 4.859 113 HD13 ILE 14 2HD1 ILE 14 -7.454 13.165 5.990 114 H LEU 15 H LEU 15 -3.162 10.378 6.142 115 HA LEU 15 HA LEU 15 -3.381 7.624 5.573 116 HB2 LEU 15 2HB LEU 15 -1.342 9.187 7.197 117 HB3 LEU 15 3HB LEU 15 -1.184 7.456 6.927 118 HG LEU 15 HG LEU 15 -1.266 9.536 4.703 119 HD11 LEU 15 1HD1 LEU 15 1.134 9.161 4.450 120 HD12 LEU 15 2HD1 LEU 15 1.135 8.062 5.830 121 HD13 LEU 15 3HD1 LEU 15 0.770 9.774 6.062 122 HD21 LEU 15 3HD2 LEU 15 -0.671 6.549 4.602 123 HD22 LEU 15 1HD2 LEU 15 -0.529 7.673 3.245 124 HD23 LEU 15 2HD2 LEU 15 -2.107 7.351 3.961 125 H GLU 16 H GLU 16 -3.711 9.442 8.599 126 HA GLU 16 HA GLU 16 -3.907 7.170 10.333 127 HB2 GLU 16 2HB GLU 16 -3.215 9.569 10.954 128 HB3 GLU 16 3HB GLU 16 -4.918 9.999 10.865 129 HG2 GLU 16 2HG GLU 16 -4.590 9.635 13.138 130 HG3 GLU 16 3HG GLU 16 -5.274 8.102 12.602 131 H GLU 17 H GLU 17 -6.241 9.311 8.720 132 HA GLU 17 HA GLU 17 -8.676 8.432 9.841 133 HB2 GLU 17 2HB GLU 17 -8.512 10.482 8.485 134 HB3 GLU 17 3HB GLU 17 -8.024 9.557 7.073 135 HG2 GLU 17 2HG GLU 17 -10.323 10.279 6.826 136 HG3 GLU 17 3HG GLU 17 -10.266 8.525 6.974 137 H LEU 18 H LEU 18 -6.980 7.480 6.901 138 HA LEU 18 HA LEU 18 -8.727 5.350 6.171 139 HB2 LEU 18 2HB LEU 18 -6.074 6.414 5.192 140 HB3 LEU 18 3HB LEU 18 -6.603 4.838 4.639 141 HG LEU 18 HG LEU 18 -8.587 5.794 3.569 142 HD11 LEU 18 1HD1 LEU 18 -9.072 8.185 3.469 143 HD12 LEU 18 2HD1 LEU 18 -7.740 8.524 4.576 144 HD13 LEU 18 3HD1 LEU 18 -9.137 7.604 5.134 145 HD21 LEU 18 3HD2 LEU 18 -6.089 7.358 2.858 146 HD22 LEU 18 1HD2 LEU 18 -7.507 7.155 1.823 147 HD23 LEU 18 2HD2 LEU 18 -6.530 5.755 2.262 148 H LEU 19 H LEU 19 -5.822 5.596 8.161 149 HA LEU 19 HA LEU 19 -5.092 2.862 8.268 150 HB2 LEU 19 2HB LEU 19 -3.547 4.592 9.057 151 HB3 LEU 19 3HB LEU 19 -4.666 5.056 10.329 152 HG LEU 19 HG LEU 19 -4.329 2.826 11.423 153 HD11 LEU 19 1HD1 LEU 19 -2.498 1.359 10.731 154 HD12 LEU 19 2HD1 LEU 19 -2.221 2.358 9.301 155 HD13 LEU 19 3HD1 LEU 19 -3.739 1.475 9.485 156 HD21 LEU 19 3HD2 LEU 19 -2.081 3.241 12.273 157 HD22 LEU 19 1HD2 LEU 19 -3.014 4.732 12.157 158 HD23 LEU 19 2HD2 LEU 19 -1.773 4.372 10.953 159 H GLU 20 H GLU 20 -7.175 4.849 10.320 160 HA GLU 20 HA GLU 20 -7.707 2.762 12.193 161 HB2 GLU 20 2HB GLU 20 -9.059 5.464 11.799 162 HB3 GLU 20 3HB GLU 20 -9.381 4.358 13.137 163 HG2 GLU 20 2HG GLU 20 -6.818 4.486 13.592 164 HG3 GLU 20 3HG GLU 20 -6.850 5.892 12.529 165 H VAL 21 H VAL 21 -9.304 3.877 9.252 166 HA VAL 21 HA VAL 21 -11.648 2.292 9.427 167 HB VAL 21 HB VAL 21 -10.095 3.232 6.968 168 HG11 VAL 21 1HG1 VAL 21 -11.499 1.314 6.314 169 HG12 VAL 21 2HG1 VAL 21 -12.145 2.809 5.640 170 HG13 VAL 21 3HG1 VAL 21 -12.914 2.073 7.048 171 HG21 VAL 21 3HG2 VAL 21 -12.604 4.371 8.263 172 HG22 VAL 21 1HG2 VAL 21 -11.785 5.011 6.837 173 HG23 VAL 21 2HG2 VAL 21 -10.982 5.047 8.404 174 H VAL 22 H VAL 22 -8.344 1.549 8.292 175 HA VAL 22 HA VAL 22 -8.882 -1.144 7.444 176 HB VAL 22 HB VAL 22 -6.228 0.238 8.088 177 HG11 VAL 22 1HG1 VAL 22 -5.110 -1.576 6.842 178 HG12 VAL 22 2HG1 VAL 22 -6.655 -2.403 6.636 179 HG13 VAL 22 3HG1 VAL 22 -5.965 -2.216 8.248 180 HG21 VAL 22 3HG2 VAL 22 -7.442 1.258 6.190 181 HG22 VAL 22 1HG2 VAL 22 -7.551 -0.315 5.401 182 HG23 VAL 22 2HG2 VAL 22 -5.976 0.451 5.636 183 H LEU 23 H LEU 23 -7.606 0.323 10.436 184 HA LEU 23 HA LEU 23 -6.905 -2.016 11.833 185 HB2 LEU 23 2HB LEU 23 -7.737 0.732 12.831 186 HB3 LEU 23 3HB LEU 23 -7.156 -0.534 13.887 187 HG LEU 23 HG LEU 23 -5.542 0.812 11.697 188 HD11 LEU 23 1HD1 LEU 23 -5.950 2.271 13.626 189 HD12 LEU 23 2HD1 LEU 23 -4.256 1.802 13.530 190 HD13 LEU 23 3HD1 LEU 23 -5.316 1.033 14.717 191 HD21 LEU 23 3HD2 LEU 23 -4.667 -1.302 13.697 192 HD22 LEU 23 1HD2 LEU 23 -3.617 -0.440 12.570 193 HD23 LEU 23 2HD2 LEU 23 -4.856 -1.528 11.955 194 H LYS 24 H LYS 24 -9.882 -0.044 11.930 195 HA LYS 24 HA LYS 24 -11.163 -1.536 13.983 196 HB2 LYS 24 2HB LYS 24 -13.070 -0.128 13.659 197 HB3 LYS 24 3HB LYS 24 -11.664 0.883 13.356 198 HG2 LYS 24 2HG LYS 24 -12.064 0.445 10.860 199 HG3 LYS 24 3HG LYS 24 -13.620 -0.240 11.328 200 HD2 LYS 24 2HD LYS 24 -12.690 2.604 11.896 201 HD3 LYS 24 3HD LYS 24 -13.816 2.132 10.625 202 HE2 LYS 24 2HE LYS 24 -15.473 1.458 12.271 203 HE3 LYS 24 3HE LYS 24 -14.329 1.714 13.592 204 HZ1 LYS 24 3HZ LYS 24 -15.919 3.555 13.318 205 HZ2 LYS 24 1HZ LYS 24 -15.304 3.855 11.771 206 HZ3 LYS 24 2HZ LYS 24 -14.320 4.059 13.127 207 H SER 25 H SER 25 -11.140 -1.782 10.479 208 HA SER 25 HA SER 25 -13.303 -3.630 10.226 209 HB2 SER 25 2HB SER 25 -12.573 -2.226 8.331 210 HB3 SER 25 3HB SER 25 -11.007 -3.034 8.308 211 HG SER 25 HG SER 25 -11.950 -4.868 7.549 212 H ASP 26 H ASP 26 -9.762 -4.080 9.877 213 HA ASP 26 HA ASP 26 -9.933 -6.716 11.161 214 HB2 ASP 26 2HB ASP 26 -8.705 -6.263 8.410 215 HB3 ASP 26 3HB ASP 26 -8.390 -7.691 9.388 216 HA PRO 27 HA PRO 27 -5.931 -5.127 12.882 217 HB2 PRO 27 2HB PRO 27 -5.931 -6.911 14.967 218 HB3 PRO 27 3HB PRO 27 -6.895 -5.418 15.028 219 HG2 PRO 27 2HG PRO 27 -7.801 -8.185 14.197 220 HG3 PRO 27 3HG PRO 27 -8.525 -7.098 15.417 221 HD2 PRO 27 2HD PRO 27 -9.541 -7.202 12.954 222 HD3 PRO 27 3HD PRO 27 -9.372 -5.625 13.774 223 H ASN 28 H ASN 28 -7.213 -7.998 11.605 224 HA ASN 28 HA ASN 28 -5.148 -9.899 11.877 225 HB2 ASN 28 2HB ASN 28 -7.548 -10.402 11.444 226 HB3 ASN 28 3HB ASN 28 -7.417 -9.670 9.848 227 HD21 ASN 28 1HD2 ASN 28 -8.141 -11.607 8.977 228 HD22 ASN 28 2HD2 ASN 28 -7.101 -12.980 8.798 229 H VAL 29 H VAL 29 -5.841 -7.456 9.460 230 HA VAL 29 HA VAL 29 -3.839 -8.356 7.560 231 HB VAL 29 HB VAL 29 -5.465 -5.760 7.636 232 HG11 VAL 29 1HG1 VAL 29 -3.933 -7.012 5.326 233 HG12 VAL 29 2HG1 VAL 29 -3.470 -5.553 6.206 234 HG13 VAL 29 3HG1 VAL 29 -4.944 -5.568 5.235 235 HG21 VAL 29 3HG2 VAL 29 -6.966 -6.854 6.005 236 HG22 VAL 29 1HG2 VAL 29 -6.930 -7.737 7.533 237 HG23 VAL 29 2HG2 VAL 29 -6.038 -8.349 6.139 238 H LYS 30 H LYS 30 -1.724 -7.694 7.530 239 HA LYS 30 HA LYS 30 -0.498 -6.501 9.785 240 HB2 LYS 30 2HB LYS 30 0.559 -7.092 6.988 241 HB3 LYS 30 3HB LYS 30 1.592 -6.528 8.293 242 HG2 LYS 30 2HG LYS 30 -0.051 -9.058 8.529 243 HG3 LYS 30 3HG LYS 30 1.544 -9.052 7.785 244 HD2 LYS 30 2HD LYS 30 1.082 -8.011 10.603 245 HD3 LYS 30 3HD LYS 30 1.393 -9.713 10.271 246 HE2 LYS 30 2HE LYS 30 3.492 -8.727 10.890 247 HE3 LYS 30 3HE LYS 30 3.563 -9.019 9.155 248 HZ1 LYS 30 3HZ LYS 30 4.487 -6.858 9.750 249 HZ2 LYS 30 1HZ LYS 30 3.028 -6.394 10.457 250 HZ3 LYS 30 2HZ LYS 30 3.112 -6.656 8.795 251 H THR 31 H THR 31 -1.384 -4.426 10.132 252 HA THR 31 HA THR 31 -1.257 -2.327 8.131 253 HB THR 31 HB THR 31 -2.175 -0.860 9.934 254 HG1 THR 31 HG1 THR 31 -1.224 -1.791 11.772 255 HG21 THR 31 3HG2 THR 31 -4.344 -1.975 10.200 256 HG22 THR 31 1HG2 THR 31 -3.627 -3.524 9.754 257 HG23 THR 31 2HG2 THR 31 -3.732 -2.224 8.563 258 H VAL 32 H VAL 32 0.599 -1.396 7.691 259 HA VAL 32 HA VAL 32 2.784 -1.180 9.696 260 HB VAL 32 HB VAL 32 2.939 -1.459 6.644 261 HG11 VAL 32 1HG1 VAL 32 4.819 -0.137 7.513 262 HG12 VAL 32 2HG1 VAL 32 5.364 -1.703 6.912 263 HG13 VAL 32 3HG1 VAL 32 5.219 -1.429 8.650 264 HG21 VAL 32 3HG2 VAL 32 3.866 -3.719 7.053 265 HG22 VAL 32 1HG2 VAL 32 2.215 -3.560 7.662 266 HG23 VAL 32 2HG2 VAL 32 3.580 -3.522 8.783 267 H ARG 33 H ARG 33 3.374 0.906 10.160 268 HA ARG 33 HA ARG 33 3.077 2.982 8.042 269 HB2 ARG 33 2HB ARG 33 1.604 3.318 10.092 270 HB3 ARG 33 3HB ARG 33 3.062 3.433 11.069 271 HG2 ARG 33 2HG ARG 33 3.747 5.457 9.867 272 HG3 ARG 33 3HG ARG 33 2.355 5.315 8.792 273 HD2 ARG 33 2HD ARG 33 0.833 5.636 10.727 274 HD3 ARG 33 3HD ARG 33 2.234 5.786 11.795 275 HE ARG 33 HE ARG 33 2.689 7.722 9.963 276 HH11 ARG 33 1HH1 ARG 33 -0.141 7.001 11.935 277 HH12 ARG 33 2HH1 ARG 33 -0.656 8.657 12.022 278 HH21 ARG 33 1HH2 ARG 33 2.041 9.899 10.125 279 HH22 ARG 33 2HH2 ARG 33 0.589 10.305 10.989 280 H THR 34 H THR 34 5.066 2.808 7.151 281 HA THR 34 HA THR 34 7.504 3.202 8.671 282 HB THR 34 HB THR 34 6.840 0.483 7.462 283 HG1 THR 34 HG1 THR 34 6.972 1.472 9.983 284 HG21 THR 34 3HG2 THR 34 9.583 1.441 8.349 285 HG22 THR 34 1HG2 THR 34 9.105 1.063 6.691 286 HG23 THR 34 2HG2 THR 34 9.166 -0.215 7.903 287 H ASP 35 H ASP 35 8.641 4.520 7.415 288 HA ASP 35 HA ASP 35 8.814 4.066 4.482 289 HB2 ASP 35 2HB ASP 35 9.477 6.421 4.278 290 HB3 ASP 35 3HB ASP 35 7.954 6.312 5.150 291 H ASP 36 H ASP 36 10.306 2.989 7.026 292 HA ASP 36 HA ASP 36 13.049 3.702 6.788 293 HB2 ASP 36 2HB ASP 36 11.797 1.207 8.031 294 HB3 ASP 36 3HB ASP 36 13.467 1.721 8.255 295 H LYS 37 H LYS 37 11.161 1.932 4.674 296 HA LYS 37 HA LYS 37 11.578 1.017 2.674 297 HB2 LYS 37 2HB LYS 37 14.558 1.469 3.167 298 HB3 LYS 37 3HB LYS 37 13.794 1.133 1.620 299 HG2 LYS 37 2HG LYS 37 12.524 3.328 1.896 300 HG3 LYS 37 3HG LYS 37 13.561 3.652 3.284 301 HD2 LYS 37 2HD LYS 37 14.459 4.809 1.339 302 HD3 LYS 37 3HD LYS 37 15.563 3.507 1.784 303 HE2 LYS 37 2HE LYS 37 14.711 2.112 -0.033 304 HE3 LYS 37 3HE LYS 37 13.483 3.317 -0.425 305 HZ1 LYS 37 3HZ LYS 37 15.201 4.843 -1.092 306 HZ2 LYS 37 1HZ LYS 37 15.404 3.385 -1.921 307 HZ3 LYS 37 2HZ LYS 37 16.414 3.768 -0.622 308 H GLU 38 H GLU 38 14.493 -0.140 4.363 309 HA GLU 38 HA GLU 38 14.340 -2.784 3.416 310 HB2 GLU 38 2HB GLU 38 16.131 -3.269 5.053 311 HB3 GLU 38 3HB GLU 38 16.443 -1.776 4.175 312 HG2 GLU 38 2HG GLU 38 15.746 -0.441 6.087 313 HG3 GLU 38 3HG GLU 38 15.267 -1.888 6.970 314 H LYS 39 H LYS 39 13.068 -1.303 6.367 315 HA LYS 39 HA LYS 39 12.441 -3.657 7.800 316 HB2 LYS 39 2HB LYS 39 12.566 -1.514 8.949 317 HB3 LYS 39 3HB LYS 39 11.251 -0.862 7.976 318 HG2 LYS 39 2HG LYS 39 9.712 -2.564 8.998 319 HG3 LYS 39 3HG LYS 39 11.036 -3.083 10.043 320 HD2 LYS 39 2HD LYS 39 11.072 -0.959 11.187 321 HD3 LYS 39 3HD LYS 39 9.993 -0.228 9.994 322 HE2 LYS 39 2HE LYS 39 8.183 -1.775 10.723 323 HE3 LYS 39 3HE LYS 39 9.261 -2.426 11.962 324 HZ1 LYS 39 3HZ LYS 39 8.233 0.350 11.772 325 HZ2 LYS 39 1HZ LYS 39 9.394 -0.159 12.890 326 HZ3 LYS 39 2HZ LYS 39 7.841 -0.806 12.932 327 H VAL 40 H VAL 40 10.628 -1.776 5.404 328 HA VAL 40 HA VAL 40 8.099 -2.989 5.616 329 HB VAL 40 HB VAL 40 9.449 -1.898 3.087 330 HG11 VAL 40 1HG1 VAL 40 7.576 -3.353 2.488 331 HG12 VAL 40 2HG1 VAL 40 7.152 -1.671 2.169 332 HG13 VAL 40 3HG1 VAL 40 6.511 -2.487 3.597 333 HG21 VAL 40 3HG2 VAL 40 7.536 -0.502 5.004 334 HG22 VAL 40 1HG2 VAL 40 8.189 0.184 3.512 335 HG23 VAL 40 2HG2 VAL 40 9.266 -0.186 4.860 336 H LYS 41 H LYS 41 10.843 -3.744 3.472 337 HA LYS 41 HA LYS 41 9.876 -6.080 2.256 338 HB2 LYS 41 2HB LYS 41 12.754 -5.258 2.844 339 HB3 LYS 41 3HB LYS 41 12.287 -6.550 1.739 340 HG2 LYS 41 2HG LYS 41 11.115 -4.908 0.313 341 HG3 LYS 41 3HG LYS 41 11.608 -3.610 1.409 342 HD2 LYS 41 2HD LYS 41 13.966 -4.013 0.897 343 HD3 LYS 41 3HD LYS 41 13.550 -5.424 -0.081 344 HE2 LYS 41 2HE LYS 41 12.369 -3.965 -1.683 345 HE3 LYS 41 3HE LYS 41 12.773 -2.555 -0.703 346 HZ1 LYS 41 3HZ LYS 41 14.298 -2.714 -2.506 347 HZ2 LYS 41 1HZ LYS 41 14.674 -4.319 -2.145 348 HZ3 LYS 41 2HZ LYS 41 15.140 -3.084 -1.093 349 H GLU 42 H GLU 42 11.595 -5.596 5.279 350 HA GLU 42 HA GLU 42 12.434 -8.229 5.822 351 HB2 GLU 42 2HB GLU 42 13.329 -6.152 6.870 352 HB3 GLU 42 3HB GLU 42 11.819 -5.915 7.724 353 HG2 GLU 42 2HG GLU 42 13.532 -8.365 8.162 354 HG3 GLU 42 3HG GLU 42 13.839 -6.858 9.014 355 H GLU 43 H GLU 43 9.616 -6.395 6.975 356 HA GLU 43 HA GLU 43 8.468 -8.649 8.327 357 HB2 GLU 43 2HB GLU 43 6.766 -7.177 9.118 358 HB3 GLU 43 3HB GLU 43 8.344 -6.425 9.294 359 HG2 GLU 43 2HG GLU 43 7.889 -5.005 7.327 360 HG3 GLU 43 3HG GLU 43 6.298 -5.755 7.162 361 H ILE 44 H ILE 44 8.070 -7.337 5.117 362 HA ILE 44 HA ILE 44 5.614 -8.392 4.348 363 HB ILE 44 HB ILE 44 8.208 -8.109 2.787 364 HG12 ILE 44 2HG1 ILE 44 5.471 -6.784 2.474 365 HG13 ILE 44 3HG1 ILE 44 6.889 -6.049 3.210 366 HG21 ILE 44 1HG2 ILE 44 5.652 -9.274 1.625 367 HG22 ILE 44 2HG2 ILE 44 7.188 -10.120 1.822 368 HG23 ILE 44 3HG2 ILE 44 7.063 -8.777 0.688 369 HD11 ILE 44 3HD1 ILE 44 6.506 -5.226 0.950 370 HD12 ILE 44 1HD1 ILE 44 6.642 -6.868 0.309 371 HD13 ILE 44 2HD1 ILE 44 8.040 -6.088 1.058 372 H GLU 45 H GLU 45 8.689 -10.152 4.842 373 HA GLU 45 HA GLU 45 7.990 -12.695 3.946 374 HB2 GLU 45 2HB GLU 45 10.282 -12.189 4.665 375 HB3 GLU 45 3HB GLU 45 9.749 -11.966 6.330 376 HG2 GLU 45 2HG GLU 45 9.049 -14.377 6.369 377 HG3 GLU 45 3HG GLU 45 9.728 -14.558 4.755 378 H LYS 46 H LYS 46 7.350 -11.217 7.131 379 HA LYS 46 HA LYS 46 6.099 -13.403 8.410 380 HB2 LYS 46 2HB LYS 46 5.700 -10.404 8.789 381 HB3 LYS 46 3HB LYS 46 5.057 -11.623 9.885 382 HG2 LYS 46 2HG LYS 46 7.263 -12.300 10.569 383 HG3 LYS 46 3HG LYS 46 8.021 -11.328 9.300 384 HD2 LYS 46 2HD LYS 46 7.343 -9.263 10.387 385 HD3 LYS 46 3HD LYS 46 6.361 -10.143 11.562 386 HE2 LYS 46 2HE LYS 46 8.499 -9.354 12.526 387 HE3 LYS 46 3HE LYS 46 8.366 -11.112 12.566 388 HZ1 LYS 46 3HZ LYS 46 10.561 -10.369 11.880 389 HZ2 LYS 46 1HZ LYS 46 9.904 -9.550 10.557 390 HZ3 LYS 46 2HZ LYS 46 9.809 -11.234 10.643 391 H ALA 47 H ALA 47 4.800 -10.850 6.332 392 HA ALA 47 HA ALA 47 2.031 -11.357 6.720 393 HB1 ALA 47 3HB ALA 47 3.435 -9.986 4.404 394 HB2 ALA 47 1HB ALA 47 2.890 -9.212 5.891 395 HB3 ALA 47 2HB ALA 47 1.708 -9.891 4.770 396 H ARG 48 H ARG 48 4.247 -12.256 4.053 397 HA ARG 48 HA ARG 48 2.316 -13.786 2.613 398 HB2 ARG 48 2HB ARG 48 4.163 -14.500 1.181 399 HB3 ARG 48 3HB ARG 48 4.244 -12.767 1.470 400 HG2 ARG 48 2HG ARG 48 6.109 -13.010 2.962 401 HG3 ARG 48 3HG ARG 48 5.924 -14.764 3.015 402 HD2 ARG 48 2HD ARG 48 6.712 -13.160 0.555 403 HD3 ARG 48 3HD ARG 48 7.821 -14.067 1.592 404 HE ARG 48 HE ARG 48 5.693 -15.699 0.592 405 HH11 ARG 48 1HH1 ARG 48 8.832 -14.370 -0.305 406 HH12 ARG 48 2HH1 ARG 48 9.149 -15.619 -1.475 407 HH21 ARG 48 1HH2 ARG 48 6.128 -17.327 -0.923 408 HH22 ARG 48 2HH2 ARG 48 7.615 -17.290 -1.824 409 H LYS 49 H LYS 49 4.646 -14.570 5.126 410 HA LYS 49 HA LYS 49 4.752 -17.361 5.102 411 HB2 LYS 49 2HB LYS 49 6.127 -16.074 6.647 412 HB3 LYS 49 3HB LYS 49 4.709 -15.390 7.428 413 HG2 LYS 49 2HG LYS 49 4.152 -17.782 8.186 414 HG3 LYS 49 3HG LYS 49 5.774 -18.227 7.647 415 HD2 LYS 49 2HD LYS 49 5.113 -16.108 9.728 416 HD3 LYS 49 3HD LYS 49 5.682 -17.737 10.087 417 HE2 LYS 49 2HE LYS 49 7.249 -15.659 8.517 418 HE3 LYS 49 3HE LYS 49 7.477 -16.015 10.229 419 HZ1 LYS 49 3HZ LYS 49 8.133 -18.245 9.667 420 HZ2 LYS 49 1HZ LYS 49 9.092 -17.146 8.822 421 HZ3 LYS 49 2HZ LYS 49 7.855 -17.969 8.024 422 H GLN 50 H GLN 50 2.457 -15.204 6.663 423 HA GLN 50 HA GLN 50 0.647 -17.278 7.547 424 HB2 GLN 50 2HB GLN 50 0.463 -14.236 7.534 425 HB3 GLN 50 3HB GLN 50 -0.712 -15.299 8.297 426 HG2 GLN 50 2HG GLN 50 2.218 -15.229 9.070 427 HG3 GLN 50 3HG GLN 50 0.980 -14.249 9.854 428 HE21 GLN 50 1HE2 GLN 50 2.719 -16.344 10.971 429 HE22 GLN 50 2HE2 GLN 50 1.660 -17.511 11.677 430 H GLY 51 H GLY 51 1.032 -15.270 4.724 431 HA2 GLY 51 2HA GLY 51 -0.100 -15.251 2.703 432 HA3 GLY 51 3HA GLY 51 -1.257 -16.405 3.350 433 H ARG 52 H ARG 52 -0.652 -13.608 5.241 434 HA ARG 52 HA ARG 52 -3.368 -12.591 4.718 435 HB2 ARG 52 2HB ARG 52 -1.455 -11.994 7.025 436 HB3 ARG 52 3HB ARG 52 -3.141 -11.477 6.917 437 HG2 ARG 52 2HG ARG 52 -3.905 -13.789 7.029 438 HG3 ARG 52 3HG ARG 52 -2.243 -14.374 6.974 439 HD2 ARG 52 2HD ARG 52 -1.860 -13.142 9.165 440 HD3 ARG 52 3HD ARG 52 -3.606 -12.884 9.240 441 HE ARG 52 HE ARG 52 -2.164 -15.424 9.530 442 HH11 ARG 52 1HH1 ARG 52 -5.287 -13.838 9.407 443 HH12 ARG 52 2HH1 ARG 52 -6.124 -15.186 10.104 444 HH21 ARG 52 1HH2 ARG 52 -3.282 -17.182 10.436 445 HH22 ARG 52 2HH2 ARG 52 -4.998 -17.074 10.689 446 HA PRO 53 HA PRO 53 -1.707 -9.159 2.341 447 HB2 PRO 53 2HB PRO 53 -4.002 -7.565 3.486 448 HB3 PRO 53 3HB PRO 53 -3.552 -7.838 1.787 449 HG2 PRO 53 2HG PRO 53 -5.642 -9.105 2.825 450 HG3 PRO 53 3HG PRO 53 -4.542 -9.953 1.713 451 HD2 PRO 53 2HD PRO 53 -4.692 -10.132 4.724 452 HD3 PRO 53 3HD PRO 53 -4.462 -11.426 3.522 453 H ILE 54 H ILE 54 -0.603 -7.174 2.589 454 HA ILE 54 HA ILE 54 -0.174 -6.200 5.348 455 HB ILE 54 HB ILE 54 1.739 -7.582 4.845 456 HG12 ILE 54 2HG1 ILE 54 2.595 -4.678 4.493 457 HG13 ILE 54 3HG1 ILE 54 2.139 -5.399 6.030 458 HG21 ILE 54 1HG2 ILE 54 3.249 -7.254 2.921 459 HG22 ILE 54 2HG2 ILE 54 2.167 -6.016 2.284 460 HG23 ILE 54 3HG2 ILE 54 1.614 -7.686 2.400 461 HD11 ILE 54 3HD1 ILE 54 4.530 -5.261 5.848 462 HD12 ILE 54 1HD1 ILE 54 4.511 -6.160 4.331 463 HD13 ILE 54 2HD1 ILE 54 4.043 -6.954 5.837 464 H VAL 55 H VAL 55 -0.733 -4.142 5.496 465 HA VAL 55 HA VAL 55 -0.961 -2.473 3.100 466 HB VAL 55 HB VAL 55 -1.952 -1.616 5.854 467 HG11 VAL 55 1HG1 VAL 55 -3.565 -0.311 4.532 468 HG12 VAL 55 2HG1 VAL 55 -2.915 -0.985 3.035 469 HG13 VAL 55 3HG1 VAL 55 -1.908 0.061 4.044 470 HG21 VAL 55 3HG2 VAL 55 -4.162 -2.585 5.374 471 HG22 VAL 55 1HG2 VAL 55 -2.927 -3.838 5.515 472 HG23 VAL 55 2HG2 VAL 55 -3.520 -3.361 3.925 473 H ILE 56 H ILE 56 0.396 -0.744 2.754 474 HA ILE 56 HA ILE 56 2.372 -0.062 4.881 475 HB ILE 56 HB ILE 56 2.725 0.290 1.858 476 HG12 ILE 56 2HG1 ILE 56 2.615 -2.120 2.322 477 HG13 ILE 56 3HG1 ILE 56 4.272 -1.675 1.942 478 HG21 ILE 56 1HG2 ILE 56 4.751 0.517 4.123 479 HG22 ILE 56 2HG2 ILE 56 4.103 1.845 3.158 480 HG23 ILE 56 3HG2 ILE 56 5.124 0.623 2.401 481 HD11 ILE 56 3HD1 ILE 56 4.816 -1.733 4.346 482 HD12 ILE 56 1HD1 ILE 56 4.208 -3.276 3.743 483 HD13 ILE 56 2HD1 ILE 56 3.156 -2.227 4.691 484 H PHE 57 H PHE 57 1.988 1.875 5.760 485 HA PHE 57 HA PHE 57 0.450 3.942 4.324 486 HB2 PHE 57 2HB PHE 57 0.850 3.345 7.279 487 HB3 PHE 57 3HB PHE 57 0.325 4.945 6.757 488 HD1 PHE 57 HD2 PHE 57 -0.617 1.343 6.805 489 HD2 PHE 57 HD1 PHE 57 -1.905 5.341 5.996 490 HE1 PHE 57 HE2 PHE 57 -2.949 0.573 6.627 491 HE2 PHE 57 HE1 PHE 57 -4.224 4.557 5.833 492 HZ PHE 57 HZ PHE 57 -4.738 2.179 6.114 493 H ILE 58 H ILE 58 1.654 5.346 3.340 494 HA ILE 58 HA ILE 58 3.838 6.754 4.673 495 HB ILE 58 HB ILE 58 5.199 6.566 2.419 496 HG12 ILE 58 2HG1 ILE 58 3.512 4.027 2.239 497 HG13 ILE 58 3HG1 ILE 58 3.522 5.365 1.090 498 HG21 ILE 58 1HG2 ILE 58 6.476 4.644 3.279 499 HG22 ILE 58 2HG2 ILE 58 5.143 4.213 4.350 500 HG23 ILE 58 3HG2 ILE 58 6.015 5.728 4.592 501 HD11 ILE 58 3HD1 ILE 58 5.845 4.866 0.524 502 HD12 ILE 58 1HD1 ILE 58 4.784 3.484 0.265 503 HD13 ILE 58 2HD1 ILE 58 5.836 3.522 1.674 504 H ARG 59 H ARG 59 4.516 8.662 3.480 505 HA ARG 59 HA ARG 59 2.205 10.100 2.428 506 HB2 ARG 59 2HB ARG 59 3.828 10.911 4.265 507 HB3 ARG 59 3HB ARG 59 5.007 11.164 2.985 508 HG2 ARG 59 2HG ARG 59 3.455 12.807 1.931 509 HG3 ARG 59 3HG ARG 59 2.321 12.553 3.264 510 HD2 ARG 59 2HD ARG 59 5.140 13.677 3.473 511 HD3 ARG 59 3HD ARG 59 3.626 14.557 3.722 512 HE ARG 59 HE ARG 59 3.247 12.949 5.631 513 HH11 ARG 59 1HH1 ARG 59 6.517 13.882 4.713 514 HH12 ARG 59 2HH1 ARG 59 7.159 13.603 6.300 515 HH21 ARG 59 1HH2 ARG 59 4.116 12.525 7.665 516 HH22 ARG 59 2HH2 ARG 59 5.793 12.832 7.970 517 H GLY 60 H GLY 60 2.639 11.647 0.538 518 HA2 GLY 60 2HA GLY 60 3.051 10.240 -1.813 519 HA3 GLY 60 3HA GLY 60 3.046 11.987 -1.683 520 H ALA 61 H ALA 61 5.479 12.040 0.043 521 HA ALA 61 HA ALA 61 7.513 12.013 -1.998 522 HB1 ALA 61 3HB ALA 61 9.051 12.686 -0.177 523 HB2 ALA 61 1HB ALA 61 7.773 12.367 1.012 524 HB3 ALA 61 2HB ALA 61 7.580 13.657 -0.171 525 H TYR 62 H TYR 62 6.859 10.142 0.909 526 HA TYR 62 HA TYR 62 8.990 8.316 0.759 527 HB2 TYR 62 2HB TYR 62 6.317 8.003 2.176 528 HB3 TYR 62 3HB TYR 62 7.755 7.027 2.472 529 HD1 TYR 62 HD2 TYR 62 9.944 8.946 2.670 530 HD2 TYR 62 HD1 TYR 62 5.929 9.324 4.081 531 HE1 TYR 62 HE2 TYR 62 10.693 10.541 4.387 532 HE2 TYR 62 HE1 TYR 62 6.681 10.912 5.802 533 HH TYR 62 HH TYR 62 8.836 11.418 7.032 534 H GLU 63 H GLU 63 5.903 8.358 -0.846 535 HA GLU 63 HA GLU 63 5.474 5.698 -1.504 536 HB2 GLU 63 2HB GLU 63 3.895 7.554 -1.932 537 HB3 GLU 63 3HB GLU 63 4.909 8.110 -3.261 538 HG2 GLU 63 2HG GLU 63 4.533 5.863 -4.376 539 HG3 GLU 63 3HG GLU 63 3.382 5.487 -3.097 540 H GLU 64 H GLU 64 7.883 7.890 -2.839 541 HA GLU 64 HA GLU 64 8.665 6.675 -5.207 542 HB2 GLU 64 2HB GLU 64 9.657 8.763 -4.390 543 HB3 GLU 64 3HB GLU 64 10.392 7.929 -3.026 544 HG2 GLU 64 2HG GLU 64 11.793 6.629 -4.647 545 HG3 GLU 64 3HG GLU 64 11.110 7.594 -5.955 546 H VAL 65 H VAL 65 9.348 5.722 -1.904 547 HA VAL 65 HA VAL 65 11.281 3.720 -2.226 548 HB VAL 65 HB VAL 65 9.123 4.041 -0.086 549 HG11 VAL 65 1HG1 VAL 65 11.611 2.298 0.009 550 HG12 VAL 65 2HG1 VAL 65 9.940 1.732 -0.036 551 HG13 VAL 65 3HG1 VAL 65 10.533 2.616 1.371 552 HG21 VAL 65 3HG2 VAL 65 10.625 5.982 -0.238 553 HG22 VAL 65 1HG2 VAL 65 12.035 4.930 -0.102 554 HG23 VAL 65 2HG2 VAL 65 10.924 5.097 1.260 555 H VAL 66 H VAL 66 7.763 3.595 -2.626 556 HA VAL 66 HA VAL 66 7.250 0.902 -2.179 557 HB VAL 66 HB VAL 66 5.820 2.683 -4.196 558 HG11 VAL 66 1HG1 VAL 66 4.848 0.111 -2.894 559 HG12 VAL 66 2HG1 VAL 66 5.241 0.336 -4.599 560 HG13 VAL 66 3HG1 VAL 66 3.864 1.183 -3.897 561 HG21 VAL 66 3HG2 VAL 66 5.180 2.169 -1.286 562 HG22 VAL 66 1HG2 VAL 66 4.222 3.153 -2.400 563 HG23 VAL 66 2HG2 VAL 66 5.854 3.655 -1.953 564 H ARG 67 H ARG 67 8.374 2.433 -5.227 565 HA ARG 67 HA ARG 67 7.947 0.226 -6.947 566 HB2 ARG 67 2HB ARG 67 8.571 2.692 -7.524 567 HB3 ARG 67 3HB ARG 67 10.243 2.202 -7.331 568 HG2 ARG 67 2HG ARG 67 8.349 0.849 -9.289 569 HG3 ARG 67 3HG ARG 67 9.298 2.265 -9.716 570 HD2 ARG 67 2HD ARG 67 11.376 1.000 -9.281 571 HD3 ARG 67 3HD ARG 67 10.421 -0.422 -8.856 572 HE ARG 67 HE ARG 67 9.555 0.172 -11.364 573 HH11 ARG 67 1HH1 ARG 67 12.741 -0.455 -9.987 574 HH12 ARG 67 2HH1 ARG 67 13.383 -1.087 -11.474 575 HH21 ARG 67 1HH2 ARG 67 10.407 -0.641 -13.285 576 HH22 ARG 67 2HH2 ARG 67 12.055 -1.193 -13.350 577 H ASP 68 H ASP 68 10.635 1.041 -4.831 578 HA ASP 68 HA ASP 68 12.412 -1.070 -5.596 579 HB2 ASP 68 2HB ASP 68 13.140 1.061 -4.505 580 HB3 ASP 68 3HB ASP 68 12.317 0.576 -3.028 581 H ILE 69 H ILE 69 9.923 -0.676 -3.116 582 HA ILE 69 HA ILE 69 10.209 -3.181 -1.777 583 HB ILE 69 HB ILE 69 7.705 -1.456 -2.067 584 HG12 ILE 69 2HG1 ILE 69 9.467 -0.070 -1.143 585 HG13 ILE 69 3HG1 ILE 69 8.337 -0.452 0.143 586 HG21 ILE 69 1HG2 ILE 69 8.339 -3.549 0.038 587 HG22 ILE 69 2HG2 ILE 69 7.135 -3.685 -1.246 588 HG23 ILE 69 3HG2 ILE 69 6.928 -2.490 0.035 589 HD11 ILE 69 3HD1 ILE 69 9.936 -2.140 0.996 590 HD12 ILE 69 1HD1 ILE 69 10.594 -0.503 0.960 591 HD13 ILE 69 2HD1 ILE 69 11.069 -1.667 -0.274 592 H VAL 70 H VAL 70 8.521 -2.132 -4.677 593 HA VAL 70 HA VAL 70 6.856 -4.409 -5.099 594 HB VAL 70 HB VAL 70 7.848 -2.274 -7.069 595 HG11 VAL 70 1HG1 VAL 70 6.143 -3.090 -8.636 596 HG12 VAL 70 2HG1 VAL 70 5.720 -4.397 -7.528 597 HG13 VAL 70 3HG1 VAL 70 7.316 -4.360 -8.281 598 HG21 VAL 70 3HG2 VAL 70 5.123 -2.612 -5.764 599 HG22 VAL 70 1HG2 VAL 70 5.554 -1.369 -6.937 600 HG23 VAL 70 2HG2 VAL 70 6.315 -1.388 -5.350 601 H GLU 71 H GLU 71 10.052 -3.376 -6.246 602 HA GLU 71 HA GLU 71 10.649 -5.446 -8.030 603 HB2 GLU 71 2HB GLU 71 11.923 -3.301 -7.781 604 HB3 GLU 71 3HB GLU 71 12.589 -3.881 -6.256 605 HG2 GLU 71 2HG GLU 71 13.761 -5.686 -7.427 606 HG3 GLU 71 3HG GLU 71 13.024 -5.201 -8.953 607 H TYR 72 H TYR 72 11.135 -5.212 -4.531 608 HA TYR 72 HA TYR 72 12.250 -7.753 -4.002 609 HB2 TYR 72 2HB TYR 72 12.237 -5.989 -2.318 610 HB3 TYR 72 3HB TYR 72 10.483 -5.919 -2.325 611 HD1 TYR 72 HD1 TYR 72 13.416 -7.940 -1.218 612 HD2 TYR 72 HD2 TYR 72 9.182 -7.444 -0.954 613 HE1 TYR 72 HE1 TYR 72 13.347 -9.495 0.686 614 HE2 TYR 72 HE2 TYR 72 9.128 -8.999 0.934 615 HH TYR 72 HH TYR 72 11.786 -9.915 2.674 616 H ALA 73 H ALA 73 8.843 -6.662 -3.929 617 HA ALA 73 HA ALA 73 7.666 -9.116 -3.215 618 HB1 ALA 73 3HB ALA 73 6.402 -6.766 -4.649 619 HB2 ALA 73 1HB ALA 73 6.561 -6.951 -2.902 620 HB3 ALA 73 2HB ALA 73 5.537 -8.060 -3.816 621 H GLN 74 H GLN 74 8.628 -7.878 -6.347 622 HA GLN 74 HA GLN 74 7.132 -9.572 -8.048 623 HB2 GLN 74 2HB GLN 74 9.769 -8.097 -8.446 624 HB3 GLN 74 3HB GLN 74 9.060 -9.084 -9.721 625 HG2 GLN 74 2HG GLN 74 7.046 -7.656 -9.719 626 HG3 GLN 74 3HG GLN 74 7.746 -6.668 -8.437 627 HE21 GLN 74 1HE2 GLN 74 7.513 -4.846 -9.895 628 HE22 GLN 74 2HE2 GLN 74 8.666 -4.573 -11.147 629 H LYS 75 H LYS 75 10.410 -9.931 -6.627 630 HA LYS 75 HA LYS 75 10.718 -12.606 -7.713 631 HB2 LYS 75 2HB LYS 75 12.913 -12.656 -6.608 632 HB3 LYS 75 3HB LYS 75 12.705 -11.192 -7.547 633 HG2 LYS 75 2HG LYS 75 13.769 -10.388 -5.655 634 HG3 LYS 75 3HG LYS 75 12.076 -10.088 -5.269 635 HD2 LYS 75 2HD LYS 75 12.037 -12.144 -3.871 636 HD3 LYS 75 3HD LYS 75 13.731 -12.444 -4.271 637 HE2 LYS 75 2HE LYS 75 14.360 -10.328 -3.163 638 HE3 LYS 75 3HE LYS 75 12.664 -10.032 -2.770 639 HZ1 LYS 75 3HZ LYS 75 12.695 -12.111 -1.474 640 HZ2 LYS 75 1HZ LYS 75 13.773 -10.952 -0.886 641 HZ3 LYS 75 2HZ LYS 75 14.353 -12.262 -1.777 642 H GLU 76 H GLU 76 9.219 -11.294 -4.948 643 HA GLU 76 HA GLU 76 9.274 -13.706 -3.340 644 HB2 GLU 76 2HB GLU 76 7.541 -11.191 -3.201 645 HB3 GLU 76 3HB GLU 76 7.449 -12.509 -2.040 646 HG2 GLU 76 2HG GLU 76 9.941 -10.882 -2.580 647 HG3 GLU 76 3HG GLU 76 8.800 -10.559 -1.278 648 H GLY 77 H GLY 77 7.423 -12.520 -6.019 649 HA2 GLY 77 2HA GLY 77 5.869 -13.646 -7.334 650 HA3 GLY 77 3HA GLY 77 5.753 -14.910 -6.118 651 H LEU 78 H LEU 78 5.473 -11.705 -4.960 652 HA LEU 78 HA LEU 78 2.702 -12.125 -4.185 653 HB2 LEU 78 2HB LEU 78 4.701 -9.926 -3.519 654 HB3 LEU 78 3HB LEU 78 3.067 -9.996 -2.868 655 HG LEU 78 HG LEU 78 5.202 -12.116 -2.397 656 HD11 LEU 78 1HD1 LEU 78 4.206 -9.952 -0.525 657 HD12 LEU 78 2HD1 LEU 78 5.790 -10.007 -1.306 658 HD13 LEU 78 3HD1 LEU 78 5.350 -11.240 -0.127 659 HD21 LEU 78 3HD2 LEU 78 2.944 -13.040 -2.302 660 HD22 LEU 78 1HD2 LEU 78 2.450 -11.786 -1.163 661 HD23 LEU 78 2HD2 LEU 78 3.658 -12.987 -0.695 662 H ARG 79 H ARG 79 1.015 -10.823 -4.702 663 HA ARG 79 HA ARG 79 1.154 -9.117 -7.059 664 HB2 ARG 79 2HB ARG 79 -0.732 -10.805 -6.471 665 HB3 ARG 79 3HB ARG 79 -1.271 -9.642 -5.271 666 HG2 ARG 79 2HG ARG 79 -1.017 -8.947 -8.210 667 HG3 ARG 79 3HG ARG 79 -2.474 -9.664 -7.538 668 HD2 ARG 79 2HD ARG 79 -2.680 -7.684 -6.001 669 HD3 ARG 79 3HD ARG 79 -1.278 -6.971 -6.800 670 HE ARG 79 HE ARG 79 -2.533 -6.637 -8.743 671 HH11 ARG 79 1HH1 ARG 79 -4.506 -8.041 -6.211 672 HH12 ARG 79 2HH1 ARG 79 -6.001 -7.650 -7.000 673 HH21 ARG 79 1HH2 ARG 79 -4.469 -6.206 -9.791 674 HH22 ARG 79 2HH2 ARG 79 -5.979 -6.605 -9.036 675 H VAL 80 H VAL 80 0.962 -6.880 -6.973 676 HA VAL 80 HA VAL 80 1.060 -5.560 -4.324 677 HB VAL 80 HB VAL 80 2.589 -4.664 -6.831 678 HG11 VAL 80 1HG1 VAL 80 1.947 -2.800 -5.362 679 HG12 VAL 80 2HG1 VAL 80 3.691 -3.057 -5.307 680 HG13 VAL 80 3HG1 VAL 80 2.678 -3.617 -3.977 681 HG21 VAL 80 3HG2 VAL 80 4.660 -5.349 -5.665 682 HG22 VAL 80 1HG2 VAL 80 3.598 -6.730 -5.953 683 HG23 VAL 80 2HG2 VAL 80 3.699 -6.018 -4.342 684 H LEU 81 H LEU 81 -0.246 -3.823 -4.135 685 HA LEU 81 HA LEU 81 -1.760 -2.773 -6.425 686 HB2 LEU 81 2HB LEU 81 -2.943 -4.677 -5.038 687 HB3 LEU 81 3HB LEU 81 -3.049 -3.481 -3.761 688 HG LEU 81 HG LEU 81 -4.383 -2.009 -5.324 689 HD11 LEU 81 1HD1 LEU 81 -4.308 -4.463 -7.097 690 HD12 LEU 81 2HD1 LEU 81 -3.614 -2.877 -7.450 691 HD13 LEU 81 3HD1 LEU 81 -5.363 -3.062 -7.337 692 HD21 LEU 81 3HD2 LEU 81 -6.472 -3.283 -5.113 693 HD22 LEU 81 1HD2 LEU 81 -5.506 -3.411 -3.643 694 HD23 LEU 81 2HD2 LEU 81 -5.556 -4.758 -4.786 695 H VAL 82 H VAL 82 -1.033 -0.649 -6.357 696 HA VAL 82 HA VAL 82 -0.444 0.548 -3.713 697 HB VAL 82 HB VAL 82 0.334 1.567 -6.488 698 HG11 VAL 82 1HG1 VAL 82 1.900 3.070 -5.269 699 HG12 VAL 82 2HG1 VAL 82 1.230 2.515 -3.733 700 HG13 VAL 82 3HG1 VAL 82 0.215 3.410 -4.864 701 HG21 VAL 82 3HG2 VAL 82 2.608 0.740 -5.907 702 HG22 VAL 82 1HG2 VAL 82 1.427 -0.568 -6.006 703 HG23 VAL 82 2HG2 VAL 82 1.960 0.026 -4.431 704 H ILE 83 H ILE 83 -2.045 1.564 -2.851 705 HA ILE 83 HA ILE 83 -4.166 2.874 -4.426 706 HB ILE 83 HB ILE 83 -4.173 2.230 -1.432 707 HG12 ILE 83 2HG1 ILE 83 -5.367 0.497 -3.646 708 HG13 ILE 83 3HG1 ILE 83 -3.839 0.146 -2.845 709 HG21 ILE 83 1HG2 ILE 83 -6.641 2.422 -1.655 710 HG22 ILE 83 2HG2 ILE 83 -6.460 2.818 -3.364 711 HG23 ILE 83 3HG2 ILE 83 -5.834 3.919 -2.135 712 HD11 ILE 83 3HD1 ILE 83 -5.591 -1.182 -1.920 713 HD12 ILE 83 1HD1 ILE 83 -6.557 0.250 -1.563 714 HD13 ILE 83 2HD1 ILE 83 -5.029 -0.029 -0.709 715 H LYS 84 H LYS 84 -3.723 5.056 -4.678 716 HA LYS 84 HA LYS 84 -2.805 6.541 -2.303 717 HB2 LYS 84 2HB LYS 84 -1.196 7.865 -3.508 718 HB3 LYS 84 3HB LYS 84 -0.786 6.170 -3.675 719 HG2 LYS 84 2HG LYS 84 -2.223 7.728 -5.828 720 HG3 LYS 84 3HG LYS 84 -0.466 7.649 -5.697 721 HD2 LYS 84 2HD LYS 84 -0.760 5.071 -5.793 722 HD3 LYS 84 3HD LYS 84 -2.407 5.415 -6.349 723 HE2 LYS 84 2HE LYS 84 -0.926 5.110 -8.266 724 HE3 LYS 84 3HE LYS 84 -1.478 6.790 -8.181 725 HZ1 LYS 84 3HZ LYS 84 0.927 6.606 -8.646 726 HZ2 LYS 84 1HZ LYS 84 1.160 5.816 -7.165 727 HZ3 LYS 84 2HZ LYS 84 0.629 7.416 -7.193 728 H VAL 85 H VAL 85 -3.536 8.510 -2.047 729 HA VAL 85 HA VAL 85 -5.892 9.290 -3.525 730 HB VAL 85 HB VAL 85 -4.528 10.512 -1.064 731 HG11 VAL 85 1HG1 VAL 85 -5.855 12.213 -2.229 732 HG12 VAL 85 2HG1 VAL 85 -6.600 11.789 -0.688 733 HG13 VAL 85 3HG1 VAL 85 -7.270 11.160 -2.195 734 HG21 VAL 85 3HG2 VAL 85 -6.326 9.456 0.265 735 HG22 VAL 85 1HG2 VAL 85 -5.389 8.247 -0.616 736 HG23 VAL 85 2HG2 VAL 85 -6.985 8.721 -1.199 737 H ALA 86 H ALA 86 -5.669 10.467 -5.292 738 HA ALA 86 HA ALA 86 -3.218 11.644 -6.124 739 HB1 ALA 86 3HB ALA 86 -4.817 10.643 -7.712 740 HB2 ALA 86 1HB ALA 86 -4.457 12.320 -8.126 741 HB3 ALA 86 2HB ALA 86 -5.987 11.912 -7.343 742 H GLN 87 H GLN 87 -6.384 13.047 -5.281 743 HA GLN 87 HA GLN 87 -7.187 15.130 -5.047 744 HB2 GLN 87 2HB GLN 87 -4.454 15.641 -3.802 745 HB3 GLN 87 3HB GLN 87 -5.796 16.773 -3.725 746 HG2 GLN 87 2HG GLN 87 -5.793 13.983 -2.546 747 HG3 GLN 87 3HG GLN 87 -5.522 15.472 -1.647 748 HE21 GLN 87 1HE2 GLN 87 -7.280 16.903 -1.333 749 HE22 GLN 87 2HE2 GLN 87 -8.917 16.367 -1.468 750 H ASP 88 H ASP 88 -3.849 16.233 -5.591 751 HA ASP 88 HA ASP 88 -3.895 16.238 -8.412 752 HB2 ASP 88 2HB ASP 88 -5.441 18.219 -7.995 753 HB3 ASP 88 3HB ASP 88 -4.100 19.045 -7.209 754 H GLN 89 H GLN 89 -1.941 15.234 -8.076 755 HA GLN 89 HA GLN 89 0.317 16.825 -6.965 756 HB2 GLN 89 2HB GLN 89 -0.149 13.808 -6.804 757 HB3 GLN 89 3HB GLN 89 1.326 14.611 -6.297 758 HG2 GLN 89 2HG GLN 89 -1.394 15.090 -5.054 759 HG3 GLN 89 3HG GLN 89 -0.197 13.962 -4.424 760 HE21 GLN 89 1HE2 GLN 89 1.746 14.825 -3.500 761 HE22 GLN 89 2HE2 GLN 89 1.819 16.460 -2.941 762 H GLU 90 H GLU 90 1.810 17.240 -8.454 763 HA GLU 90 HA GLU 90 1.658 16.317 -11.150 764 HB2 GLU 90 2HB GLU 90 3.918 17.846 -9.775 765 HB3 GLU 90 3HB GLU 90 3.686 17.683 -11.517 766 HG2 GLU 90 2HG GLU 90 1.568 18.934 -11.361 767 HG3 GLU 90 3HG GLU 90 1.792 19.102 -9.618 768 H LEU 91 H LEU 91 4.099 15.883 -8.613 769 HA LEU 91 HA LEU 91 5.848 14.139 -9.873 770 HB2 LEU 91 2HB LEU 91 6.456 13.463 -7.419 771 HB3 LEU 91 3HB LEU 91 6.717 15.109 -7.958 772 HG LEU 91 HG LEU 91 4.535 15.753 -6.805 773 HD11 LEU 91 1HD1 LEU 91 4.723 13.005 -5.541 774 HD12 LEU 91 2HD1 LEU 91 3.460 13.570 -6.637 775 HD13 LEU 91 3HD1 LEU 91 3.634 14.306 -5.047 776 HD21 LEU 91 3HD2 LEU 91 6.745 14.673 -5.026 777 HD22 LEU 91 1HD2 LEU 91 5.525 15.862 -4.556 778 HD23 LEU 91 2HD2 LEU 91 6.708 16.259 -5.800 779 H LEU 92 H LEU 92 2.751 13.422 -8.529 780 HA LEU 92 HA LEU 92 2.944 10.725 -7.809 781 HB2 LEU 92 2HB LEU 92 1.023 12.405 -7.430 782 HB3 LEU 92 3HB LEU 92 0.496 12.017 -9.053 783 HG LEU 92 HG LEU 92 0.462 9.525 -8.179 784 HD11 LEU 92 1HD1 LEU 92 -0.044 9.326 -5.776 785 HD12 LEU 92 2HD1 LEU 92 0.356 11.027 -5.548 786 HD13 LEU 92 3HD1 LEU 92 1.599 9.885 -6.070 787 HD21 LEU 92 3HD2 LEU 92 -1.633 11.521 -7.277 788 HD22 LEU 92 1HD2 LEU 92 -1.856 9.775 -7.424 789 HD23 LEU 92 2HD2 LEU 92 -1.540 10.745 -8.859 790 H GLU 93 H GLU 93 2.425 12.245 -10.916 791 HA GLU 93 HA GLU 93 1.255 10.092 -12.323 792 HB2 GLU 93 2HB GLU 93 2.716 12.557 -13.353 793 HB3 GLU 93 3HB GLU 93 1.705 11.499 -14.336 794 HG2 GLU 93 2HG GLU 93 -0.277 12.115 -13.066 795 HG3 GLU 93 3HG GLU 93 0.695 13.047 -11.927 796 H ARG 94 H ARG 94 4.667 11.171 -12.074 797 HA ARG 94 HA ARG 94 5.679 9.433 -14.100 798 HB2 ARG 94 2HB ARG 94 7.887 10.080 -13.410 799 HB3 ARG 94 3HB ARG 94 6.866 11.500 -13.238 800 HG2 ARG 94 2HG ARG 94 6.694 10.967 -10.766 801 HG3 ARG 94 3HG ARG 94 7.907 9.713 -11.018 802 HD2 ARG 94 2HD ARG 94 8.978 11.709 -10.153 803 HD3 ARG 94 3HD ARG 94 9.492 11.473 -11.828 804 HE ARG 94 HE ARG 94 7.492 13.141 -12.235 805 HH11 ARG 94 1HH1 ARG 94 9.938 13.384 -9.694 806 HH12 ARG 94 2HH1 ARG 94 9.828 15.114 -9.615 807 HH21 ARG 94 1HH2 ARG 94 7.340 15.386 -12.052 808 HH22 ARG 94 2HH2 ARG 94 8.364 16.241 -10.942 809 H PHE 95 H PHE 95 5.146 9.061 -10.643 810 HA PHE 95 HA PHE 95 6.512 6.550 -10.364 811 HB2 PHE 95 2HB PHE 95 6.138 8.078 -8.425 812 HB3 PHE 95 3HB PHE 95 4.399 7.796 -8.540 813 HD1 PHE 95 HD2 PHE 95 7.671 6.150 -7.885 814 HD2 PHE 95 HD1 PHE 95 3.417 5.800 -7.585 815 HE1 PHE 95 HE2 PHE 95 7.925 4.108 -6.552 816 HE2 PHE 95 HE1 PHE 95 3.688 3.746 -6.261 817 HZ PHE 95 HZ PHE 95 5.940 2.907 -5.757 818 H TYR 96 H TYR 96 3.121 7.535 -10.622 819 HA TYR 96 HA TYR 96 1.785 5.114 -10.513 820 HB2 TYR 96 2HB TYR 96 0.406 7.030 -10.449 821 HB3 TYR 96 3HB TYR 96 1.223 7.798 -11.803 822 HD1 TYR 96 HD1 TYR 96 -1.311 5.216 -10.892 823 HD2 TYR 96 HD2 TYR 96 0.429 7.473 -14.085 824 HE1 TYR 96 HE1 TYR 96 -3.106 4.485 -12.403 825 HE2 TYR 96 HE2 TYR 96 -1.371 6.727 -15.587 826 HH TYR 96 HH TYR 96 -2.963 4.914 -15.784 827 H GLU 97 H GLU 97 3.272 6.746 -13.267 828 HA GLU 97 HA GLU 97 2.379 4.950 -15.302 829 HB2 GLU 97 2HB GLU 97 3.067 7.463 -15.400 830 HB3 GLU 97 3HB GLU 97 4.721 6.886 -15.500 831 HG2 GLU 97 2HG GLU 97 2.601 6.033 -17.481 832 HG3 GLU 97 3HG GLU 97 3.482 7.539 -17.670 833 H GLN 98 H GLN 98 5.335 5.273 -13.378 834 HA GLN 98 HA GLN 98 7.078 3.540 -14.708 835 HB2 GLN 98 2HB GLN 98 7.870 5.033 -12.967 836 HB3 GLN 98 3HB GLN 98 6.834 4.277 -11.766 837 HG2 GLN 98 2HG GLN 98 9.180 3.660 -11.441 838 HG3 GLN 98 3HG GLN 98 8.201 2.244 -11.822 839 HE21 GLN 98 1HE2 GLN 98 8.585 1.135 -13.757 840 HE22 GLN 98 2HE2 GLN 98 9.961 1.454 -14.754 841 H LEU 99 H LEU 99 4.687 2.818 -12.168 842 HA LEU 99 HA LEU 99 5.410 0.077 -11.815 843 HB2 LEU 99 2HB LEU 99 3.064 1.769 -10.947 844 HB3 LEU 99 3HB LEU 99 2.997 0.026 -10.725 845 HG LEU 99 HG LEU 99 4.960 0.069 -9.266 846 HD11 LEU 99 1HD1 LEU 99 6.042 2.168 -8.577 847 HD12 LEU 99 2HD1 LEU 99 5.072 3.046 -9.765 848 HD13 LEU 99 3HD1 LEU 99 6.248 1.851 -10.301 849 HD21 LEU 99 3HD2 LEU 99 2.778 0.441 -8.235 850 HD22 LEU 99 1HD2 LEU 99 2.946 2.184 -8.472 851 HD23 LEU 99 2HD2 LEU 99 4.036 1.328 -7.377 852 H LYS 100 H LYS 100 3.253 1.725 -13.983 853 HA LYS 100 HA LYS 100 1.713 -0.497 -14.861 854 HB2 LYS 100 2HB LYS 100 2.385 2.009 -16.445 855 HB3 LYS 100 3HB LYS 100 0.997 0.955 -16.674 856 HG2 LYS 100 2HG LYS 100 1.354 2.367 -14.028 857 HG3 LYS 100 3HG LYS 100 0.772 3.279 -15.417 858 HD2 LYS 100 2HD LYS 100 -1.158 2.643 -14.204 859 HD3 LYS 100 3HD LYS 100 -1.126 1.574 -15.602 860 HE2 LYS 100 2HE LYS 100 0.035 0.654 -12.969 861 HE3 LYS 100 3HE LYS 100 -1.707 0.627 -13.218 862 HZ1 LYS 100 3HZ LYS 100 -0.571 -1.483 -13.732 863 HZ2 LYS 100 1HZ LYS 100 0.217 -0.726 -15.017 864 HZ3 LYS 100 2HZ LYS 100 -1.462 -0.864 -15.026 865 H LYS 101 H LYS 101 4.879 0.753 -15.741 866 HA LYS 101 HA LYS 101 5.407 -0.805 -18.065 867 HB2 LYS 101 2HB LYS 101 7.450 0.137 -15.996 868 HB3 LYS 101 3HB LYS 101 7.769 -0.277 -17.680 869 HG2 LYS 101 2HG LYS 101 6.463 1.675 -18.419 870 HG3 LYS 101 3HG LYS 101 6.108 2.079 -16.733 871 HD2 LYS 101 2HD LYS 101 8.547 2.376 -16.310 872 HD3 LYS 101 3HD LYS 101 8.876 2.018 -18.009 873 HE2 LYS 101 2HE LYS 101 7.311 4.379 -16.919 874 HE3 LYS 101 3HE LYS 101 8.912 4.420 -17.664 875 HZ1 LYS 101 3HZ LYS 101 6.356 3.713 -19.001 876 HZ2 LYS 101 1HZ LYS 101 7.879 3.626 -19.735 877 HZ3 LYS 101 2HZ LYS 101 7.261 5.116 -19.229 878 H ASP 102 H ASP 102 6.085 -1.266 -14.623 879 HA ASP 102 HA ASP 102 7.305 -3.831 -14.760 880 HB2 ASP 102 2HB ASP 102 5.971 -2.332 -12.464 881 HB3 ASP 102 3HB ASP 102 6.846 -3.846 -12.252 882 H GLY 103 H GLY 103 4.015 -2.815 -14.875 883 HA2 GLY 103 2HA GLY 103 2.201 -4.141 -15.579 884 HA3 GLY 103 3HA GLY 103 3.072 -5.593 -15.109 885 H VAL 104 H VAL 104 3.151 -3.134 -12.819 886 HA VAL 104 HA VAL 104 1.711 -4.629 -10.837 887 HB VAL 104 HB VAL 104 2.942 -1.834 -10.711 888 HG11 VAL 104 1HG1 VAL 104 3.011 -2.135 -8.264 889 HG12 VAL 104 2HG1 VAL 104 2.176 -3.683 -8.415 890 HG13 VAL 104 3HG1 VAL 104 1.350 -2.189 -8.859 891 HG21 VAL 104 3HG2 VAL 104 4.922 -2.905 -9.792 892 HG22 VAL 104 1HG2 VAL 104 4.551 -3.583 -11.378 893 HG23 VAL 104 2HG2 VAL 104 4.162 -4.494 -9.915 894 H ASP 105 H ASP 105 -0.320 -4.305 -10.132 895 HA ASP 105 HA ASP 105 -2.097 -2.440 -11.446 896 HB2 ASP 105 2HB ASP 105 -2.633 -4.322 -9.100 897 HB3 ASP 105 3HB ASP 105 -3.856 -3.491 -10.060 898 H VAL 106 H VAL 106 -2.818 -0.546 -10.642 899 HA VAL 106 HA VAL 106 -2.175 0.260 -7.858 900 HB VAL 106 HB VAL 106 -1.800 2.599 -8.643 901 HG11 VAL 106 1HG1 VAL 106 0.049 0.613 -10.013 902 HG12 VAL 106 2HG1 VAL 106 0.176 1.187 -8.348 903 HG13 VAL 106 3HG1 VAL 106 0.421 2.310 -9.688 904 HG21 VAL 106 3HG2 VAL 106 -1.495 3.092 -11.064 905 HG22 VAL 106 1HG2 VAL 106 -3.146 2.607 -10.676 906 HG23 VAL 106 2HG2 VAL 106 -2.050 1.463 -11.449 907 H ARG 107 H ARG 107 -3.849 1.272 -6.789 908 HA ARG 107 HA ARG 107 -6.358 1.780 -8.280 909 HB2 ARG 107 2HB ARG 107 -5.931 1.453 -5.274 910 HB3 ARG 107 3HB ARG 107 -7.478 1.738 -6.062 911 HG2 ARG 107 2HG ARG 107 -5.747 -0.733 -6.389 912 HG3 ARG 107 3HG ARG 107 -7.214 -0.617 -5.418 913 HD2 ARG 107 2HD ARG 107 -8.529 -0.166 -7.470 914 HD3 ARG 107 3HD ARG 107 -7.056 -0.303 -8.439 915 HE ARG 107 HE ARG 107 -7.176 -2.670 -7.073 916 HH11 ARG 107 1HH1 ARG 107 -9.408 -1.021 -9.248 917 HH12 ARG 107 2HH1 ARG 107 -10.113 -2.496 -9.820 918 HH21 ARG 107 1HH2 ARG 107 -8.127 -4.583 -7.850 919 HH22 ARG 107 2HH2 ARG 107 -9.388 -4.500 -9.034 920 H VAL 108 H VAL 108 -6.150 3.840 -9.034 921 HA VAL 108 HA VAL 108 -5.547 6.014 -7.156 922 HB VAL 108 HB VAL 108 -5.918 7.555 -9.121 923 HG11 VAL 108 1HG1 VAL 108 -3.820 5.394 -9.582 924 HG12 VAL 108 2HG1 VAL 108 -3.652 6.802 -8.533 925 HG13 VAL 108 3HG1 VAL 108 -3.801 7.022 -10.275 926 HG21 VAL 108 3HG2 VAL 108 -6.144 4.998 -10.773 927 HG22 VAL 108 1HG2 VAL 108 -6.013 6.635 -11.427 928 HG23 VAL 108 2HG2 VAL 108 -7.433 6.167 -10.492 929 H THR 109 H THR 109 -7.107 6.723 -5.911 930 HA THR 109 HA THR 109 -9.954 6.253 -6.589 931 HB THR 109 HB THR 109 -10.310 6.661 -4.141 932 HG1 THR 109 HG1 THR 109 -8.709 7.743 -3.262 933 HG21 THR 109 3HG2 THR 109 -10.018 4.341 -4.935 934 HG22 THR 109 1HG2 THR 109 -9.290 4.542 -3.341 935 HG23 THR 109 2HG2 THR 109 -8.266 4.494 -4.776 936 H ASP 110 H ASP 110 -7.551 8.650 -6.271 937 HA ASP 110 HA ASP 110 -7.399 10.836 -6.650 938 HB2 ASP 110 2HB ASP 110 -10.354 10.827 -7.371 939 HB3 ASP 110 3HB ASP 110 -9.218 12.134 -7.696 940 H ASN 111 H ASN 111 -10.643 10.562 -5.187 941 HA ASN 111 HA ASN 111 -10.074 12.653 -3.250 942 HB2 ASN 111 2HB ASN 111 -12.325 12.270 -4.418 943 HB3 ASN 111 3HB ASN 111 -12.536 10.848 -3.406 944 HD21 ASN 111 1HD2 ASN 111 -14.089 13.348 -3.613 945 HD22 ASN 111 2HD2 ASN 111 -14.183 13.972 -2.003 946 H GLU 112 H GLU 112 -9.753 12.395 -1.113 947 HA GLU 112 HA GLU 112 -8.523 10.161 0.043 948 HB2 GLU 112 2HB GLU 112 -8.796 11.489 2.189 949 HB3 GLU 112 3HB GLU 112 -8.082 12.390 0.855 950 HG2 GLU 112 2HG GLU 112 -10.398 13.328 0.383 951 HG3 GLU 112 3HG GLU 112 -10.921 12.587 1.893 952 H ASP 113 H ASP 113 -11.847 11.294 0.254 953 HA ASP 113 HA ASP 113 -12.854 9.487 2.197 954 HB2 ASP 113 2HB ASP 113 -13.932 11.616 1.753 955 HB3 ASP 113 3HB ASP 113 -14.163 11.212 0.063 956 H GLU 114 H GLU 114 -12.510 9.355 -1.280 957 HA GLU 114 HA GLU 114 -14.177 7.128 -1.852 958 HB2 GLU 114 2HB GLU 114 -13.423 8.792 -3.530 959 HB3 GLU 114 3HB GLU 114 -11.767 8.231 -3.353 960 HG2 GLU 114 2HG GLU 114 -12.588 7.293 -5.374 961 HG3 GLU 114 3HG GLU 114 -12.544 5.972 -4.208 962 H ALA 115 H ALA 115 -10.690 7.455 -1.189 963 HA ALA 115 HA ALA 115 -9.861 4.812 -1.673 964 HB1 ALA 115 3HB ALA 115 -7.828 5.410 -0.435 965 HB2 ALA 115 1HB ALA 115 -8.631 6.849 0.210 966 HB3 ALA 115 2HB ALA 115 -8.312 6.713 -1.518 967 H LYS 116 H LYS 116 -11.015 6.385 1.238 968 HA LYS 116 HA LYS 116 -10.552 4.610 3.294 969 HB2 LYS 116 2HB LYS 116 -11.417 6.832 3.636 970 HB3 LYS 116 3HB LYS 116 -12.805 6.525 2.603 971 HG2 LYS 116 2HG LYS 116 -13.463 4.783 4.468 972 HG3 LYS 116 3HG LYS 116 -12.361 5.729 5.471 973 HD2 LYS 116 2HD LYS 116 -14.759 6.803 3.949 974 HD3 LYS 116 3HD LYS 116 -14.693 6.521 5.690 975 HE2 LYS 116 2HE LYS 116 -12.961 8.272 5.906 976 HE3 LYS 116 3HE LYS 116 -13.001 8.531 4.157 977 HZ1 LYS 116 3HZ LYS 116 -14.336 10.175 5.278 978 HZ2 LYS 116 1HZ LYS 116 -15.254 8.979 6.047 979 HZ3 LYS 116 2HZ LYS 116 -15.346 9.170 4.369 980 H LYS 117 H LYS 117 -13.243 4.686 1.010 981 HA LYS 117 HA LYS 117 -14.847 2.661 2.246 982 HB2 LYS 117 2HB LYS 117 -14.987 3.926 -0.529 983 HB3 LYS 117 3HB LYS 117 -16.278 2.990 0.227 984 HG2 LYS 117 2HG LYS 117 -16.676 4.663 1.877 985 HG3 LYS 117 3HG LYS 117 -15.167 5.503 1.508 986 HD2 LYS 117 2HD LYS 117 -16.059 6.208 -0.678 987 HD3 LYS 117 3HD LYS 117 -17.558 5.310 -0.374 988 HE2 LYS 117 2HE LYS 117 -18.063 6.770 1.539 989 HE3 LYS 117 3HE LYS 117 -16.538 7.626 1.308 990 HZ1 LYS 117 3HZ LYS 117 -17.324 8.416 -0.814 991 HZ2 LYS 117 1HZ LYS 117 -18.418 8.834 0.398 992 HZ3 LYS 117 2HZ LYS 117 -18.771 7.557 -0.651 993 H ARG 118 H ARG 118 -12.628 2.783 -0.491 994 HA ARG 118 HA ARG 118 -13.103 0.173 -1.529 995 HB2 ARG 118 2HB ARG 118 -11.012 2.310 -1.969 996 HB3 ARG 118 3HB ARG 118 -10.667 0.689 -2.549 997 HG2 ARG 118 2HG ARG 118 -11.583 2.210 -4.294 998 HG3 ARG 118 3HG ARG 118 -12.523 0.739 -4.071 999 HD2 ARG 118 2HD ARG 118 -13.338 3.297 -2.691 1000 HD3 ARG 118 3HD ARG 118 -13.757 3.016 -4.382 1001 HE ARG 118 HE ARG 118 -14.526 0.767 -2.883 1002 HH11 ARG 118 1HH1 ARG 118 -15.558 4.114 -3.239 1003 HH12 ARG 118 2HH1 ARG 118 -17.201 3.767 -2.813 1004 HH21 ARG 118 1HH2 ARG 118 -16.692 0.351 -2.339 1005 HH22 ARG 118 2HH2 ARG 118 -17.840 1.659 -2.307 1006 H LEU 119 H LEU 119 -10.896 1.488 0.898 1007 HA LEU 119 HA LEU 119 -9.076 -0.617 1.167 1008 HB2 LEU 119 2HB LEU 119 -10.044 1.458 3.162 1009 HB3 LEU 119 3HB LEU 119 -8.807 0.280 3.586 1010 HG LEU 119 HG LEU 119 -8.593 2.375 1.392 1011 HD11 LEU 119 1HD1 LEU 119 -6.848 3.368 2.787 1012 HD12 LEU 119 2HD1 LEU 119 -7.132 2.154 4.037 1013 HD13 LEU 119 3HD1 LEU 119 -8.391 3.325 3.637 1014 HD21 LEU 119 3HD2 LEU 119 -7.446 0.322 0.718 1015 HD22 LEU 119 1HD2 LEU 119 -6.571 0.286 2.256 1016 HD23 LEU 119 2HD2 LEU 119 -6.286 1.589 1.097 1017 H LYS 120 H LYS 120 -12.108 -0.048 2.959 1018 HA LYS 120 HA LYS 120 -11.916 -2.238 4.710 1019 HB2 LYS 120 2HB LYS 120 -13.498 -0.395 5.100 1020 HB3 LYS 120 3HB LYS 120 -14.409 -0.837 3.655 1021 HG2 LYS 120 2HG LYS 120 -14.982 -3.019 4.698 1022 HG3 LYS 120 3HG LYS 120 -14.100 -2.544 6.155 1023 HD2 LYS 120 2HD LYS 120 -15.689 -0.732 6.576 1024 HD3 LYS 120 3HD LYS 120 -16.510 -1.048 5.042 1025 HE2 LYS 120 2HE LYS 120 -17.205 -3.260 5.845 1026 HE3 LYS 120 3HE LYS 120 -16.341 -3.000 7.360 1027 HZ1 LYS 120 3HZ LYS 120 -18.715 -2.601 7.565 1028 HZ2 LYS 120 1HZ LYS 120 -18.630 -1.373 6.406 1029 HZ3 LYS 120 2HZ LYS 120 -17.829 -1.196 7.882 1030 H GLU 121 H GLU 121 -13.357 -1.957 1.475 1031 HA GLU 121 HA GLU 121 -14.554 -4.525 1.298 1032 HB2 GLU 121 2HB GLU 121 -13.524 -2.748 -0.950 1033 HB3 GLU 121 3HB GLU 121 -14.657 -4.087 -1.135 1034 HG2 GLU 121 2HG GLU 121 -16.325 -2.910 0.199 1035 HG3 GLU 121 3HG GLU 121 -15.196 -1.584 0.495 1036 H LEU 122 H LEU 122 -11.338 -3.336 0.583 1037 HA LEU 122 HA LEU 122 -10.321 -5.700 -0.676 1038 HB2 LEU 122 2HB LEU 122 -8.955 -3.312 0.615 1039 HB3 LEU 122 3HB LEU 122 -8.075 -4.588 -0.222 1040 HG LEU 122 HG LEU 122 -10.204 -2.852 -1.528 1041 HD11 LEU 122 1HD1 LEU 122 -7.201 -2.630 -1.766 1042 HD12 LEU 122 2HD1 LEU 122 -8.264 -1.505 -0.915 1043 HD13 LEU 122 3HD1 LEU 122 -8.399 -1.692 -2.662 1044 HD21 LEU 122 3HD2 LEU 122 -10.015 -5.019 -2.597 1045 HD22 LEU 122 1HD2 LEU 122 -8.259 -4.846 -2.717 1046 HD23 LEU 122 2HD2 LEU 122 -9.324 -3.777 -3.633 1047 H LEU 123 H LEU 123 -10.538 -4.586 2.644 1048 HA LEU 123 HA LEU 123 -8.956 -6.707 3.782 1049 HB2 LEU 123 2HB LEU 123 -10.758 -4.547 4.851 1050 HB3 LEU 123 3HB LEU 123 -10.435 -5.925 5.891 1051 HG LEU 123 HG LEU 123 -7.994 -5.478 5.736 1052 HD11 LEU 123 1HD1 LEU 123 -7.881 -4.339 3.564 1053 HD12 LEU 123 2HD1 LEU 123 -7.119 -3.393 4.841 1054 HD13 LEU 123 3HD1 LEU 123 -8.721 -2.945 4.250 1055 HD21 LEU 123 3HD2 LEU 123 -9.344 -4.620 7.584 1056 HD22 LEU 123 1HD2 LEU 123 -9.626 -3.123 6.690 1057 HD23 LEU 123 2HD2 LEU 123 -7.992 -3.555 7.210 1058 H GLU 124 H GLU 124 -12.364 -6.239 3.019 1059 HA GLU 124 HA GLU 124 -13.345 -8.690 4.131 1060 HB2 GLU 124 2HB GLU 124 -14.472 -6.898 1.923 1061 HB3 GLU 124 3HB GLU 124 -15.351 -8.226 2.680 1062 HG2 GLU 124 2HG GLU 124 -15.244 -7.095 4.859 1063 HG3 GLU 124 3HG GLU 124 -14.298 -5.793 4.153 1064 H LYS 125 H LYS 125 -11.732 -7.828 1.183 1065 HA LYS 125 HA LYS 125 -11.915 -10.562 0.060 1066 HB2 LYS 125 2HB LYS 125 -10.924 -7.928 -1.148 1067 HB3 LYS 125 3HB LYS 125 -10.943 -9.474 -1.997 1068 HG2 LYS 125 2HG LYS 125 -13.386 -9.563 -1.862 1069 HG3 LYS 125 3HG LYS 125 -13.407 -8.075 -0.911 1070 HD2 LYS 125 2HD LYS 125 -12.494 -6.822 -2.841 1071 HD3 LYS 125 3HD LYS 125 -12.450 -8.311 -3.792 1072 HE2 LYS 125 2HE LYS 125 -14.929 -6.922 -2.712 1073 HE3 LYS 125 3HE LYS 125 -14.420 -7.022 -4.399 1074 HZ1 LYS 125 3HZ LYS 125 -14.702 -9.447 -4.262 1075 HZ2 LYS 125 1HZ LYS 125 -16.144 -8.614 -3.975 1076 HZ3 LYS 125 2HZ LYS 125 -15.290 -9.289 -2.685 1077 H VAL 126 H VAL 126 -9.427 -10.588 -1.326 1078 HA VAL 126 HA VAL 126 -7.412 -10.614 0.852 1079 HB VAL 126 HB VAL 126 -7.142 -11.941 -1.895 1080 HG11 VAL 126 1HG1 VAL 126 -5.004 -11.596 -0.712 1081 HG12 VAL 126 2HG1 VAL 126 -5.391 -13.311 -0.807 1082 HG13 VAL 126 3HG1 VAL 126 -5.632 -12.437 0.707 1083 HG21 VAL 126 3HG2 VAL 126 -7.796 -14.082 -0.856 1084 HG22 VAL 126 1HG2 VAL 126 -9.111 -12.907 -0.756 1085 HG23 VAL 126 2HG2 VAL 126 -8.129 -13.258 0.668 1086 H GLY 127 H GLY 127 -8.074 -8.149 0.003 1087 HA2 GLY 127 2HA GLY 127 -7.238 -6.130 -0.659 1088 HA3 GLY 127 3HA GLY 127 -5.656 -6.875 -0.508 1089 H SER 128 H SER 128 -8.338 -7.454 -2.813 1090 HA SER 128 HA SER 128 -6.401 -7.092 -5.041 1091 HB2 SER 128 2HB SER 128 -6.903 -9.481 -4.561 1092 HB3 SER 128 3HB SER 128 -8.618 -9.166 -4.839 1093 HG SER 128 HG SER 128 -7.423 -10.020 -6.671 1094 H LEU 129 H LEU 129 -9.952 -7.469 -4.605 1095 HA LEU 129 HA LEU 129 -11.788 -6.500 -5.496 1096 HB2 LEU 129 2HB LEU 129 -10.574 -4.334 -4.771 1097 HB3 LEU 129 3HB LEU 129 -10.088 -4.156 -6.440 1098 HG LEU 129 HG LEU 129 -12.513 -3.999 -7.086 1099 HD11 LEU 129 1HD1 LEU 129 -14.224 -3.638 -5.353 1100 HD12 LEU 129 2HD1 LEU 129 -13.042 -4.001 -4.095 1101 HD13 LEU 129 3HD1 LEU 129 -13.525 -5.254 -5.242 1102 HD21 LEU 129 3HD2 LEU 129 -12.849 -1.712 -6.261 1103 HD22 LEU 129 1HD2 LEU 129 -11.160 -1.968 -6.706 1104 HD23 LEU 129 2HD2 LEU 129 -11.634 -1.962 -5.005 1105 H GLU 130 H GLU 130 -12.810 -5.916 -7.643 1106 HA GLU 130 HA GLU 130 -11.555 -7.292 -9.877 1107 HB2 GLU 130 2HB GLU 130 -14.237 -5.874 -9.606 1108 HB3 GLU 130 3HB GLU 130 -13.718 -6.734 -11.056 1109 HG2 GLU 130 2HG GLU 130 -13.607 -8.843 -9.771 1110 HG3 GLU 130 3HG GLU 130 -14.104 -7.980 -8.316 1111 H HIS 131 H HIS 131 -11.717 -6.204 -12.074 1112 HA HIS 131 HA HIS 131 -10.238 -3.689 -12.028 1113 HB2 HIS 131 2HB HIS 131 -9.561 -5.674 -13.449 1114 HB3 HIS 131 3HB HIS 131 -11.016 -5.442 -14.410 1115 HD1 HIS 131 HD1 HIS 131 -10.625 -4.127 -16.482 1116 HD2 HIS 131 HD2 HIS 131 -7.850 -3.191 -13.537 1117 HE1 HIS 131 HE1 HIS 131 -9.055 -2.474 -17.530 1118 HE2 HIS 131 HE2 HIS 131 -7.252 -2.148 -15.816 1119 H HIS 132 H HIS 132 -13.350 -4.120 -11.653 1120 HA HIS 132 HA HIS 132 -14.647 -2.689 -13.729 1121 HB2 HIS 132 2HB HIS 132 -15.469 -3.575 -10.951 1122 HB3 HIS 132 3HB HIS 132 -16.508 -2.486 -11.870 1123 HD1 HIS 132 HD1 HIS 132 -18.291 -3.743 -13.026 1124 HD2 HIS 132 HD2 HIS 132 -14.753 -5.926 -12.878 1125 HE1 HIS 132 HE1 HIS 132 -18.764 -5.888 -14.245 1126 HE2 HIS 132 HE2 HIS 132 -16.653 -7.237 -14.030 1127 H HIS 133 H HIS 133 -14.313 -0.688 -14.174 1128 HA HIS 133 HA HIS 133 -14.667 1.560 -12.492 1129 HB2 HIS 133 2HB HIS 133 -12.407 1.066 -11.642 1130 HB3 HIS 133 3HB HIS 133 -11.771 0.898 -13.275 1131 HD1 HIS 133 HD1 HIS 133 -10.839 2.965 -14.339 1132 HD2 HIS 133 HD2 HIS 133 -13.142 3.844 -10.994 1133 HE1 HIS 133 HE1 HIS 133 -10.602 5.434 -13.990 1134 HE2 HIS 133 HE2 HIS 133 -12.151 5.965 -12.089 1135 H HIS 134 H HIS 134 -13.748 0.010 -15.454 1136 HA HIS 134 HA HIS 134 -13.462 0.533 -17.613 1137 HB2 HIS 134 2HB HIS 134 -14.812 3.188 -16.926 1138 HB3 HIS 134 3HB HIS 134 -14.305 2.753 -18.557 1139 HD1 HIS 134 HD1 HIS 134 -17.186 2.731 -16.482 1140 HD2 HIS 134 HD2 HIS 134 -15.673 0.202 -19.406 1141 HE1 HIS 134 HE1 HIS 134 -19.141 1.369 -17.266 1142 HE2 HIS 134 HE2 HIS 134 -18.239 0.040 -19.204 1143 H HIS 135 H HIS 135 -12.405 2.704 -18.936 1144 HA HIS 135 HA HIS 135 -9.945 3.349 -17.437 1145 HB2 HIS 135 2HB HIS 135 -10.645 3.929 -20.353 1146 HB3 HIS 135 3HB HIS 135 -9.086 4.217 -19.587 1147 HD1 HIS 135 HD1 HIS 135 -9.552 2.347 -22.085 1148 HD2 HIS 135 HD2 HIS 135 -9.139 1.080 -18.148 1149 HE1 HIS 135 HE1 HIS 135 -8.804 -0.044 -22.217 1150 HE2 HIS 135 HE2 HIS 135 -8.745 -0.832 -19.834 1151 H HIS 136 H HIS 136 -11.739 5.316 -19.785 1152 HA HIS 136 HA HIS 136 -12.984 7.147 -18.108 1153 HB2 HIS 136 2HB HIS 136 -11.466 9.207 -18.679 1154 HB3 HIS 136 3HB HIS 136 -10.982 8.165 -17.350 1155 HD1 HIS 136 HD1 HIS 136 -8.794 6.844 -17.606 1156 HD2 HIS 136 HD2 HIS 136 -9.711 9.177 -20.927 1157 HE1 HIS 136 HE1 HIS 136 -6.701 6.899 -18.994 1158 HE2 HIS 136 HE2 HIS 136 -7.234 8.449 -20.901 Start of MODEL 14 1 H1 MET 1 1H MET 1 2.898 -16.296 1.591 2 H2 MET 1 2H MET 1 3.305 -15.185 0.386 3 H3 MET 1 3H MET 1 3.343 -16.839 0.055 4 HA MET 1 HA MET 1 1.397 -15.834 -0.912 5 HB2 MET 1 2HB MET 1 0.720 -17.619 1.476 6 HB3 MET 1 3HB MET 1 -0.313 -17.354 0.072 7 HG2 MET 1 2HG MET 1 0.793 -19.498 -0.133 8 HG3 MET 1 3HG MET 1 1.422 -18.402 -1.368 9 HE1 MET 1 3HE MET 1 2.934 -21.083 -0.709 10 HE2 MET 1 1HE MET 1 4.608 -20.553 -0.529 11 HE3 MET 1 2HE MET 1 3.612 -19.900 -1.827 12 H GLY 2 H GLY 2 0.361 -13.924 -0.819 13 HA2 GLY 2 2HA GLY 2 -1.532 -13.066 0.947 14 HA3 GLY 2 3HA GLY 2 -0.036 -12.455 1.650 15 H THR 3 H THR 3 -2.162 -10.797 0.679 16 HA THR 3 HA THR 3 -1.097 -9.570 -1.785 17 HB THR 3 HB THR 3 -3.121 -8.081 -1.634 18 HG1 THR 3 HG1 THR 3 -4.471 -9.625 0.183 19 HG21 THR 3 3HG2 THR 3 -3.258 -10.166 -2.954 20 HG22 THR 3 1HG2 THR 3 -4.807 -9.792 -2.195 21 HG23 THR 3 2HG2 THR 3 -3.773 -11.051 -1.517 22 H VAL 4 H VAL 4 -0.609 -7.266 -1.803 23 HA VAL 4 HA VAL 4 0.201 -6.129 0.808 24 HB VAL 4 HB VAL 4 1.938 -5.917 -1.719 25 HG11 VAL 4 1HG1 VAL 4 2.559 -5.204 1.179 26 HG12 VAL 4 2HG1 VAL 4 2.192 -4.059 -0.111 27 HG13 VAL 4 3HG1 VAL 4 3.660 -5.029 -0.192 28 HG21 VAL 4 3HG2 VAL 4 1.953 -8.273 -0.981 29 HG22 VAL 4 1HG2 VAL 4 2.424 -7.775 0.646 30 HG23 VAL 4 2HG2 VAL 4 3.524 -7.516 -0.714 31 H VAL 5 H VAL 5 -0.958 -4.309 0.996 32 HA VAL 5 HA VAL 5 -1.534 -2.668 -1.396 33 HB VAL 5 HB VAL 5 -3.703 -1.973 -0.297 34 HG11 VAL 5 1HG1 VAL 5 -3.691 -3.628 -2.104 35 HG12 VAL 5 2HG1 VAL 5 -4.959 -4.006 -0.940 36 HG13 VAL 5 3HG1 VAL 5 -3.456 -4.937 -0.944 37 HG21 VAL 5 3HG2 VAL 5 -4.706 -3.413 1.454 38 HG22 VAL 5 1HG2 VAL 5 -3.249 -2.606 2.039 39 HG23 VAL 5 2HG2 VAL 5 -3.189 -4.311 1.587 40 H ILE 6 H ILE 6 -0.500 -0.803 -1.303 41 HA ILE 6 HA ILE 6 0.598 0.129 1.281 42 HB ILE 6 HB ILE 6 1.434 0.860 -1.575 43 HG12 ILE 6 2HG1 ILE 6 3.638 -0.331 -0.842 44 HG13 ILE 6 3HG1 ILE 6 2.689 -1.044 0.454 45 HG21 ILE 6 1HG2 ILE 6 1.838 2.741 -0.047 46 HG22 ILE 6 2HG2 ILE 6 3.365 2.016 -0.542 47 HG23 ILE 6 3HG2 ILE 6 2.717 1.682 1.064 48 HD11 ILE 6 3HD1 ILE 6 1.265 -2.147 -1.207 49 HD12 ILE 6 1HD1 ILE 6 2.964 -2.565 -1.423 50 HD13 ILE 6 2HD1 ILE 6 2.200 -1.403 -2.506 51 H VAL 7 H VAL 7 -0.568 1.712 2.245 52 HA VAL 7 HA VAL 7 -2.306 3.501 0.720 53 HB VAL 7 HB VAL 7 -1.775 3.397 3.735 54 HG11 VAL 7 1HG1 VAL 7 -3.918 4.930 2.201 55 HG12 VAL 7 2HG1 VAL 7 -2.538 5.639 3.044 56 HG13 VAL 7 3HG1 VAL 7 -3.795 4.808 3.960 57 HG21 VAL 7 3HG2 VAL 7 -3.947 2.299 3.901 58 HG22 VAL 7 1HG2 VAL 7 -2.858 1.367 2.872 59 HG23 VAL 7 2HG2 VAL 7 -4.131 2.348 2.145 60 H VAL 8 H VAL 8 -1.321 5.091 -0.245 61 HA VAL 8 HA VAL 8 0.816 6.666 1.025 62 HB VAL 8 HB VAL 8 -0.089 6.610 -1.900 63 HG11 VAL 8 1HG1 VAL 8 0.870 8.771 -1.225 64 HG12 VAL 8 2HG1 VAL 8 1.911 7.927 -2.365 65 HG13 VAL 8 3HG1 VAL 8 2.330 7.954 -0.654 66 HG21 VAL 8 3HG2 VAL 8 2.382 5.323 -0.680 67 HG22 VAL 8 1HG2 VAL 8 1.990 5.390 -2.402 68 HG23 VAL 8 2HG2 VAL 8 0.966 4.471 -1.297 69 H SER 9 H SER 9 0.385 8.778 1.511 70 HA SER 9 HA SER 9 -1.408 10.429 0.041 71 HB2 SER 9 2HB SER 9 -2.944 11.063 1.887 72 HB3 SER 9 3HB SER 9 -3.140 9.364 1.467 73 HG SER 9 HG SER 9 -1.440 9.167 3.277 74 H ASN 10 H ASN 10 -0.918 12.588 0.375 75 HA ASN 10 HA ASN 10 1.642 13.151 1.505 76 HB2 ASN 10 2HB ASN 10 0.776 14.308 -0.524 77 HB3 ASN 10 3HB ASN 10 -0.464 15.092 0.447 78 HD21 ASN 10 1HD2 ASN 10 2.961 14.985 -0.293 79 HD22 ASN 10 2HD2 ASN 10 3.362 16.501 0.435 80 H ASP 11 H ASP 11 -1.664 13.524 2.640 81 HA ASP 11 HA ASP 11 -0.890 15.182 4.936 82 HB2 ASP 11 2HB ASP 11 -2.974 15.750 3.800 83 HB3 ASP 11 3HB ASP 11 -3.600 14.128 4.052 84 H GLU 12 H GLU 12 -0.928 14.578 7.014 85 HA GLU 12 HA GLU 12 -0.280 11.914 7.770 86 HB2 GLU 12 2HB GLU 12 0.653 13.880 8.891 87 HB3 GLU 12 3HB GLU 12 -0.948 14.415 9.375 88 HG2 GLU 12 2HG GLU 12 -1.096 12.293 10.786 89 HG3 GLU 12 3HG GLU 12 0.617 12.049 10.436 90 H ARG 13 H ARG 13 -3.190 13.911 8.106 91 HA ARG 13 HA ARG 13 -4.426 12.158 10.029 92 HB2 ARG 13 2HB ARG 13 -5.596 14.573 8.591 93 HB3 ARG 13 3HB ARG 13 -6.382 13.672 9.886 94 HG2 ARG 13 2HG ARG 13 -5.476 15.564 10.969 95 HG3 ARG 13 3HG ARG 13 -4.350 14.264 11.349 96 HD2 ARG 13 2HD ARG 13 -2.924 15.107 9.392 97 HD3 ARG 13 3HD ARG 13 -3.973 16.527 9.353 98 HE ARG 13 HE ARG 13 -2.496 15.776 11.806 99 HH11 ARG 13 1HH1 ARG 13 -3.110 18.163 9.271 100 HH12 ARG 13 2HH1 ARG 13 -2.201 19.403 10.074 101 HH21 ARG 13 1HH2 ARG 13 -1.277 17.397 12.791 102 HH22 ARG 13 2HH2 ARG 13 -1.166 18.968 12.058 103 H ILE 14 H ILE 14 -4.573 12.545 6.547 104 HA ILE 14 HA ILE 14 -6.788 10.875 6.026 105 HB ILE 14 HB ILE 14 -4.251 11.227 4.341 106 HG12 ILE 14 2HG1 ILE 14 -6.985 12.577 4.078 107 HG13 ILE 14 3HG1 ILE 14 -5.525 13.348 4.686 108 HG21 ILE 14 1HG2 ILE 14 -6.930 10.032 3.525 109 HG22 ILE 14 2HG2 ILE 14 -5.414 9.150 3.712 110 HG23 ILE 14 3HG2 ILE 14 -5.577 10.352 2.435 111 HD11 ILE 14 3HD1 ILE 14 -5.953 12.326 1.880 112 HD12 ILE 14 1HD1 ILE 14 -4.470 13.067 2.489 113 HD13 ILE 14 2HD1 ILE 14 -5.958 14.009 2.406 114 H LEU 15 H LEU 15 -3.297 10.091 6.445 115 HA LEU 15 HA LEU 15 -3.440 7.300 6.187 116 HB2 LEU 15 2HB LEU 15 -1.522 9.036 7.789 117 HB3 LEU 15 3HB LEU 15 -1.329 7.294 7.677 118 HG LEU 15 HG LEU 15 -1.255 9.202 5.305 119 HD11 LEU 15 1HD1 LEU 15 1.040 7.764 6.679 120 HD12 LEU 15 2HD1 LEU 15 0.703 9.494 6.757 121 HD13 LEU 15 3HD1 LEU 15 1.152 8.759 5.222 122 HD21 LEU 15 3HD2 LEU 15 -2.086 6.998 4.645 123 HD22 LEU 15 1HD2 LEU 15 -0.715 6.210 5.431 124 HD23 LEU 15 2HD2 LEU 15 -0.457 7.243 4.020 125 H GLU 16 H GLU 16 -3.970 9.344 9.037 126 HA GLU 16 HA GLU 16 -4.184 7.251 10.981 127 HB2 GLU 16 2HB GLU 16 -5.182 10.130 11.062 128 HB3 GLU 16 3HB GLU 16 -5.090 9.058 12.457 129 HG2 GLU 16 2HG GLU 16 -2.625 8.915 12.168 130 HG3 GLU 16 3HG GLU 16 -2.734 10.022 10.801 131 H GLU 17 H GLU 17 -6.632 9.201 9.267 132 HA GLU 17 HA GLU 17 -9.014 8.101 10.230 133 HB2 GLU 17 2HB GLU 17 -9.011 10.100 8.840 134 HB3 GLU 17 3HB GLU 17 -8.240 9.251 7.511 135 HG2 GLU 17 2HG GLU 17 -10.537 9.642 6.934 136 HG3 GLU 17 3HG GLU 17 -10.315 7.916 7.196 137 H LEU 18 H LEU 18 -7.065 7.175 7.421 138 HA LEU 18 HA LEU 18 -8.698 5.047 6.491 139 HB2 LEU 18 2HB LEU 18 -5.954 6.126 5.869 140 HB3 LEU 18 3HB LEU 18 -6.352 4.528 5.268 141 HG LEU 18 HG LEU 18 -8.089 5.371 3.835 142 HD11 LEU 18 1HD1 LEU 18 -8.819 7.703 3.713 143 HD12 LEU 18 2HD1 LEU 18 -7.810 8.108 5.104 144 HD13 LEU 18 3HD1 LEU 18 -9.174 7.004 5.292 145 HD21 LEU 18 3HD2 LEU 18 -5.858 5.622 2.942 146 HD22 LEU 18 1HD2 LEU 18 -5.668 7.190 3.732 147 HD23 LEU 18 2HD2 LEU 18 -6.832 6.994 2.424 148 H LEU 19 H LEU 19 -5.957 5.236 8.703 149 HA LEU 19 HA LEU 19 -5.158 2.559 8.828 150 HB2 LEU 19 2HB LEU 19 -3.885 4.415 9.872 151 HB3 LEU 19 3HB LEU 19 -5.167 4.637 11.050 152 HG LEU 19 HG LEU 19 -4.674 2.214 11.819 153 HD11 LEU 19 1HD1 LEU 19 -2.132 2.649 10.227 154 HD12 LEU 19 2HD1 LEU 19 -3.385 1.446 9.907 155 HD13 LEU 19 3HD1 LEU 19 -2.426 1.341 11.379 156 HD21 LEU 19 3HD2 LEU 19 -2.566 4.339 12.268 157 HD22 LEU 19 1HD2 LEU 19 -2.830 2.908 13.270 158 HD23 LEU 19 2HD2 LEU 19 -4.078 4.144 13.159 159 H GLU 20 H GLU 20 -7.457 4.343 10.821 160 HA GLU 20 HA GLU 20 -8.158 2.214 12.550 161 HB2 GLU 20 2HB GLU 20 -9.702 4.757 11.922 162 HB3 GLU 20 3HB GLU 20 -9.922 3.733 13.341 163 HG2 GLU 20 2HG GLU 20 -7.654 4.283 14.120 164 HG3 GLU 20 3HG GLU 20 -7.374 5.246 12.666 165 H VAL 21 H VAL 21 -9.463 3.328 9.464 166 HA VAL 21 HA VAL 21 -11.848 1.792 9.402 167 HB VAL 21 HB VAL 21 -10.135 2.784 7.071 168 HG11 VAL 21 1HG1 VAL 21 -13.014 1.785 7.013 169 HG12 VAL 21 2HG1 VAL 21 -11.617 0.988 6.285 170 HG13 VAL 21 3HG1 VAL 21 -12.165 2.544 5.662 171 HG21 VAL 21 3HG2 VAL 21 -10.939 4.607 8.510 172 HG22 VAL 21 1HG2 VAL 21 -12.596 4.028 8.348 173 HG23 VAL 21 2HG2 VAL 21 -11.736 4.653 6.940 174 H VAL 22 H VAL 22 -8.489 1.053 8.442 175 HA VAL 22 HA VAL 22 -9.021 -1.500 7.255 176 HB VAL 22 HB VAL 22 -6.387 -0.482 8.444 177 HG11 VAL 22 1HG1 VAL 22 -5.304 -2.166 6.989 178 HG12 VAL 22 2HG1 VAL 22 -6.887 -2.751 6.478 179 HG13 VAL 22 3HG1 VAL 22 -6.382 -2.928 8.160 180 HG21 VAL 22 3HG2 VAL 22 -7.359 -0.365 5.564 181 HG22 VAL 22 1HG2 VAL 22 -5.768 0.144 6.142 182 HG23 VAL 22 2HG2 VAL 22 -7.216 1.006 6.662 183 H LEU 23 H LEU 23 -7.787 -0.485 10.468 184 HA LEU 23 HA LEU 23 -7.689 -3.008 11.713 185 HB2 LEU 23 2HB LEU 23 -7.924 -0.176 12.731 186 HB3 LEU 23 3HB LEU 23 -8.094 -1.503 13.861 187 HG LEU 23 HG LEU 23 -5.806 -2.295 13.293 188 HD11 LEU 23 1HD1 LEU 23 -5.584 0.184 11.579 189 HD12 LEU 23 2HD1 LEU 23 -5.607 -1.485 11.006 190 HD13 LEU 23 3HD1 LEU 23 -4.266 -0.915 11.998 191 HD21 LEU 23 3HD2 LEU 23 -5.938 0.604 14.168 192 HD22 LEU 23 1HD2 LEU 23 -4.578 -0.493 14.431 193 HD23 LEU 23 2HD2 LEU 23 -6.128 -0.815 15.202 194 H LYS 24 H LYS 24 -10.376 -0.812 11.200 195 HA LYS 24 HA LYS 24 -12.276 -2.076 12.934 196 HB2 LYS 24 2HB LYS 24 -12.512 0.284 12.290 197 HB3 LYS 24 3HB LYS 24 -12.640 -0.156 10.589 198 HG2 LYS 24 2HG LYS 24 -14.782 -1.276 11.019 199 HG3 LYS 24 3HG LYS 24 -14.654 -0.893 12.740 200 HD2 LYS 24 2HD LYS 24 -14.682 1.548 12.165 201 HD3 LYS 24 3HD LYS 24 -14.880 1.116 10.462 202 HE2 LYS 24 2HE LYS 24 -17.028 1.735 11.465 203 HE3 LYS 24 3HE LYS 24 -17.036 0.036 10.983 204 HZ1 LYS 24 3HZ LYS 24 -16.680 -0.604 13.266 205 HZ2 LYS 24 1HZ LYS 24 -18.025 0.414 13.187 206 HZ3 LYS 24 2HZ LYS 24 -16.551 1.008 13.757 207 H SER 25 H SER 25 -11.598 -2.211 9.455 208 HA SER 25 HA SER 25 -13.780 -3.877 8.704 209 HB2 SER 25 2HB SER 25 -12.662 -2.413 7.084 210 HB3 SER 25 3HB SER 25 -11.144 -3.284 7.289 211 HG SER 25 HG SER 25 -13.469 -4.668 6.468 212 H ASP 26 H ASP 26 -10.547 -4.505 9.897 213 HA ASP 26 HA ASP 26 -11.064 -7.315 10.283 214 HB2 ASP 26 2HB ASP 26 -10.446 -7.106 7.789 215 HB3 ASP 26 3HB ASP 26 -8.835 -6.638 8.313 216 HA PRO 27 HA PRO 27 -8.233 -5.939 13.494 217 HB2 PRO 27 2HB PRO 27 -8.364 -8.080 15.151 218 HB3 PRO 27 3HB PRO 27 -9.772 -7.033 14.872 219 HG2 PRO 27 2HG PRO 27 -9.147 -9.698 13.645 220 HG3 PRO 27 3HG PRO 27 -10.682 -9.108 14.322 221 HD2 PRO 27 2HD PRO 27 -10.118 -9.098 11.629 222 HD3 PRO 27 3HD PRO 27 -11.235 -7.945 12.394 223 H ASN 28 H ASN 28 -7.540 -8.719 11.491 224 HA ASN 28 HA ASN 28 -4.857 -9.047 12.718 225 HB2 ASN 28 2HB ASN 28 -4.856 -11.360 11.791 226 HB3 ASN 28 3HB ASN 28 -6.172 -11.088 12.924 227 HD21 ASN 28 1HD2 ASN 28 -5.361 -11.532 9.546 228 HD22 ASN 28 2HD2 ASN 28 -6.966 -11.902 9.017 229 H VAL 29 H VAL 29 -6.305 -7.730 9.937 230 HA VAL 29 HA VAL 29 -4.176 -8.221 8.093 231 HB VAL 29 HB VAL 29 -6.141 -5.884 8.236 232 HG11 VAL 29 1HG1 VAL 29 -5.408 -5.302 5.941 233 HG12 VAL 29 2HG1 VAL 29 -4.133 -6.522 6.039 234 HG13 VAL 29 3HG1 VAL 29 -4.096 -5.117 7.107 235 HG21 VAL 29 3HG2 VAL 29 -7.208 -6.972 6.309 236 HG22 VAL 29 1HG2 VAL 29 -7.131 -8.080 7.675 237 HG23 VAL 29 2HG2 VAL 29 -5.997 -8.253 6.343 238 H LYS 30 H LYS 30 -2.118 -7.614 8.296 239 HA LYS 30 HA LYS 30 -1.273 -6.138 10.615 240 HB2 LYS 30 2HB LYS 30 -0.096 -8.170 9.800 241 HB3 LYS 30 3HB LYS 30 0.352 -7.323 8.322 242 HG2 LYS 30 2HG LYS 30 2.233 -7.414 9.873 243 HG3 LYS 30 3HG LYS 30 1.719 -5.741 9.634 244 HD2 LYS 30 2HD LYS 30 0.468 -5.844 11.789 245 HD3 LYS 30 3HD LYS 30 1.030 -7.502 12.017 246 HE2 LYS 30 2HE LYS 30 3.384 -6.651 12.017 247 HE3 LYS 30 3HE LYS 30 2.752 -5.007 11.915 248 HZ1 LYS 30 3HZ LYS 30 2.213 -6.918 14.127 249 HZ2 LYS 30 1HZ LYS 30 1.645 -5.332 14.033 250 HZ3 LYS 30 2HZ LYS 30 3.295 -5.627 14.186 251 H THR 31 H THR 31 -1.336 -3.965 10.618 252 HA THR 31 HA THR 31 -0.747 -2.425 8.166 253 HB THR 31 HB THR 31 -1.860 -0.529 9.347 254 HG1 THR 31 HG1 THR 31 -1.637 -0.991 11.496 255 HG21 THR 31 3HG2 THR 31 -4.159 -1.397 9.224 256 HG22 THR 31 1HG2 THR 31 -3.542 -3.050 9.226 257 HG23 THR 31 2HG2 THR 31 -3.190 -1.979 7.867 258 H VAL 32 H VAL 32 1.316 -1.853 8.043 259 HA VAL 32 HA VAL 32 2.762 -0.869 10.442 260 HB VAL 32 HB VAL 32 4.023 -2.208 7.991 261 HG11 VAL 32 1HG1 VAL 32 6.068 -2.285 9.392 262 HG12 VAL 32 2HG1 VAL 32 5.230 -1.400 10.666 263 HG13 VAL 32 3HG1 VAL 32 5.525 -0.633 9.103 264 HG21 VAL 32 3HG2 VAL 32 2.674 -3.847 9.240 265 HG22 VAL 32 1HG2 VAL 32 3.526 -3.431 10.730 266 HG23 VAL 32 2HG2 VAL 32 4.397 -4.192 9.395 267 H ARG 33 H ARG 33 3.343 1.255 10.299 268 HA ARG 33 HA ARG 33 3.499 2.517 7.633 269 HB2 ARG 33 2HB ARG 33 3.627 4.725 8.965 270 HB3 ARG 33 3HB ARG 33 2.082 3.908 8.873 271 HG2 ARG 33 2HG ARG 33 3.883 3.580 11.278 272 HG3 ARG 33 3HG ARG 33 2.791 4.955 11.117 273 HD2 ARG 33 2HD ARG 33 0.904 3.242 10.802 274 HD3 ARG 33 3HD ARG 33 2.065 2.016 11.330 275 HE ARG 33 HE ARG 33 2.006 4.147 13.189 276 HH11 ARG 33 1HH1 ARG 33 0.058 1.396 12.158 277 HH12 ARG 33 2HH1 ARG 33 -0.735 1.235 13.690 278 HH21 ARG 33 1HH2 ARG 33 0.890 3.970 15.158 279 HH22 ARG 33 2HH2 ARG 33 -0.262 2.693 15.384 280 H THR 34 H THR 34 5.431 2.059 6.835 281 HA THR 34 HA THR 34 7.849 2.993 8.209 282 HB THR 34 HB THR 34 7.537 0.135 7.167 283 HG1 THR 34 HG1 THR 34 7.454 1.300 9.697 284 HG21 THR 34 3HG2 THR 34 9.979 1.488 8.372 285 HG22 THR 34 1HG2 THR 34 9.790 1.051 6.672 286 HG23 THR 34 2HG2 THR 34 9.853 -0.208 7.905 287 H ASP 35 H ASP 35 9.178 3.976 6.819 288 HA ASP 35 HA ASP 35 8.817 3.677 3.897 289 HB2 ASP 35 2HB ASP 35 9.897 5.863 3.699 290 HB3 ASP 35 3HB ASP 35 8.552 5.961 4.824 291 H ASP 36 H ASP 36 11.021 3.117 6.512 292 HA ASP 36 HA ASP 36 13.506 2.837 5.328 293 HB2 ASP 36 2HB ASP 36 12.276 1.022 7.453 294 HB3 ASP 36 3HB ASP 36 13.990 1.107 7.073 295 H LYS 37 H LYS 37 13.976 1.761 3.511 296 HA LYS 37 HA LYS 37 12.158 -0.011 2.233 297 HB2 LYS 37 2HB LYS 37 13.865 -0.122 0.443 298 HB3 LYS 37 3HB LYS 37 13.552 1.522 0.973 299 HG2 LYS 37 2HG LYS 37 15.658 1.282 2.435 300 HG3 LYS 37 3HG LYS 37 16.015 -0.156 1.481 301 HD2 LYS 37 2HD LYS 37 15.815 2.722 0.514 302 HD3 LYS 37 3HD LYS 37 17.222 1.661 0.468 303 HE2 LYS 37 2HE LYS 37 16.015 0.217 -1.180 304 HE3 LYS 37 3HE LYS 37 14.692 1.381 -1.183 305 HZ1 LYS 37 3HZ LYS 37 16.190 1.694 -3.050 306 HZ2 LYS 37 1HZ LYS 37 17.490 1.960 -2.003 307 HZ3 LYS 37 2HZ LYS 37 16.197 3.045 -2.039 308 H GLU 38 H GLU 38 15.024 -0.553 4.156 309 HA GLU 38 HA GLU 38 15.365 -3.334 3.720 310 HB2 GLU 38 2HB GLU 38 16.620 -3.315 5.868 311 HB3 GLU 38 3HB GLU 38 17.096 -1.973 4.834 312 HG2 GLU 38 2HG GLU 38 15.623 -0.469 6.172 313 HG3 GLU 38 3HG GLU 38 15.258 -1.819 7.239 314 H LYS 39 H LYS 39 13.350 -1.489 6.005 315 HA LYS 39 HA LYS 39 12.598 -3.832 7.509 316 HB2 LYS 39 2HB LYS 39 13.026 -1.706 8.637 317 HB3 LYS 39 3HB LYS 39 11.711 -0.935 7.755 318 HG2 LYS 39 2HG LYS 39 10.079 -2.381 8.881 319 HG3 LYS 39 3HG LYS 39 11.382 -3.234 9.713 320 HD2 LYS 39 2HD LYS 39 11.972 -1.190 10.950 321 HD3 LYS 39 3HD LYS 39 10.761 -0.271 10.047 322 HE2 LYS 39 2HE LYS 39 10.181 -2.579 11.934 323 HE3 LYS 39 3HE LYS 39 9.941 -0.869 12.289 324 HZ1 LYS 39 3HZ LYS 39 8.524 -2.484 10.246 325 HZ2 LYS 39 1HZ LYS 39 8.366 -0.807 10.390 326 HZ3 LYS 39 2HZ LYS 39 7.867 -1.813 11.650 327 H VAL 40 H VAL 40 11.096 -1.836 4.983 328 HA VAL 40 HA VAL 40 8.439 -2.801 5.211 329 HB VAL 40 HB VAL 40 9.873 -1.889 2.657 330 HG11 VAL 40 1HG1 VAL 40 6.878 -2.123 3.203 331 HG12 VAL 40 2HG1 VAL 40 7.821 -3.143 2.114 332 HG13 VAL 40 3HG1 VAL 40 7.611 -1.433 1.748 333 HG21 VAL 40 3HG2 VAL 40 8.151 -0.278 4.583 334 HG22 VAL 40 1HG2 VAL 40 8.838 0.317 3.068 335 HG23 VAL 40 2HG2 VAL 40 9.899 -0.146 4.398 336 H LYS 41 H LYS 41 11.305 -4.005 3.506 337 HA LYS 41 HA LYS 41 10.197 -6.314 2.302 338 HB2 LYS 41 2HB LYS 41 13.029 -5.771 3.277 339 HB3 LYS 41 3HB LYS 41 12.573 -7.159 2.286 340 HG2 LYS 41 2HG LYS 41 11.921 -5.698 0.452 341 HG3 LYS 41 3HG LYS 41 12.256 -4.263 1.435 342 HD2 LYS 41 2HD LYS 41 14.630 -4.867 1.559 343 HD3 LYS 41 3HD LYS 41 14.324 -6.357 0.665 344 HE2 LYS 41 2HE LYS 41 13.666 -5.029 -1.311 345 HE3 LYS 41 3HE LYS 41 13.981 -3.539 -0.411 346 HZ1 LYS 41 3HZ LYS 41 15.998 -5.631 -1.067 347 HZ2 LYS 41 1HZ LYS 41 16.302 -4.225 -0.178 348 HZ3 LYS 41 2HZ LYS 41 15.862 -4.115 -1.799 349 H GLU 42 H GLU 42 11.614 -5.754 5.515 350 HA GLU 42 HA GLU 42 11.533 -8.411 6.495 351 HB2 GLU 42 2HB GLU 42 11.413 -5.776 8.034 352 HB3 GLU 42 3HB GLU 42 11.675 -7.353 8.772 353 HG2 GLU 42 2HG GLU 42 13.768 -7.597 7.443 354 HG3 GLU 42 3HG GLU 42 13.509 -5.981 6.792 355 H GLU 43 H GLU 43 9.138 -5.822 6.393 356 HA GLU 43 HA GLU 43 7.190 -7.096 8.049 357 HB2 GLU 43 2HB GLU 43 6.783 -4.913 5.961 358 HB3 GLU 43 3HB GLU 43 5.619 -5.388 7.190 359 HG2 GLU 43 2HG GLU 43 8.244 -3.966 7.572 360 HG3 GLU 43 3HG GLU 43 6.630 -3.371 7.924 361 H ILE 44 H ILE 44 7.652 -6.830 4.536 362 HA ILE 44 HA ILE 44 5.547 -8.458 3.627 363 HB ILE 44 HB ILE 44 8.323 -7.933 2.455 364 HG12 ILE 44 2HG1 ILE 44 5.602 -6.776 1.660 365 HG13 ILE 44 3HG1 ILE 44 6.839 -5.926 2.579 366 HG21 ILE 44 1HG2 ILE 44 6.000 -9.299 1.064 367 HG22 ILE 44 2HG2 ILE 44 7.511 -10.064 1.555 368 HG23 ILE 44 3HG2 ILE 44 7.519 -8.825 0.301 369 HD11 ILE 44 3HD1 ILE 44 6.820 -5.232 0.248 370 HD12 ILE 44 1HD1 ILE 44 7.121 -6.896 -0.268 371 HD13 ILE 44 2HD1 ILE 44 8.343 -6.019 0.662 372 H GLU 45 H GLU 45 8.734 -9.192 4.926 373 HA GLU 45 HA GLU 45 8.910 -11.939 4.200 374 HB2 GLU 45 2HB GLU 45 10.728 -10.119 5.033 375 HB3 GLU 45 3HB GLU 45 10.425 -10.867 6.587 376 HG2 GLU 45 2HG GLU 45 11.397 -12.284 4.091 377 HG3 GLU 45 3HG GLU 45 12.409 -11.780 5.432 378 H LYS 46 H LYS 46 7.532 -10.227 6.940 379 HA LYS 46 HA LYS 46 7.007 -12.524 8.592 380 HB2 LYS 46 2HB LYS 46 5.728 -9.745 8.607 381 HB3 LYS 46 3HB LYS 46 5.571 -10.943 9.892 382 HG2 LYS 46 2HG LYS 46 7.928 -10.778 10.430 383 HG3 LYS 46 3HG LYS 46 8.226 -9.772 9.015 384 HD2 LYS 46 2HD LYS 46 6.669 -8.041 10.053 385 HD3 LYS 46 3HD LYS 46 6.692 -9.015 11.525 386 HE2 LYS 46 2HE LYS 46 9.085 -7.704 10.194 387 HE3 LYS 46 3HE LYS 46 8.296 -7.182 11.679 388 HZ1 LYS 46 3HZ LYS 46 10.334 -8.416 12.098 389 HZ2 LYS 46 1HZ LYS 46 9.703 -9.769 11.311 390 HZ3 LYS 46 2HZ LYS 46 8.995 -9.218 12.741 391 H ALA 47 H ALA 47 5.013 -10.505 6.428 392 HA ALA 47 HA ALA 47 2.525 -11.767 6.941 393 HB1 ALA 47 3HB ALA 47 2.745 -9.437 6.192 394 HB2 ALA 47 1HB ALA 47 1.670 -10.350 5.135 395 HB3 ALA 47 2HB ALA 47 3.319 -9.983 4.616 396 H ARG 48 H ARG 48 4.983 -12.368 4.496 397 HA ARG 48 HA ARG 48 3.468 -13.865 2.632 398 HB2 ARG 48 2HB ARG 48 5.662 -14.712 1.795 399 HB3 ARG 48 3HB ARG 48 5.694 -12.969 2.052 400 HG2 ARG 48 2HG ARG 48 6.878 -13.277 4.181 401 HG3 ARG 48 3HG ARG 48 6.807 -15.025 3.991 402 HD2 ARG 48 2HD ARG 48 8.266 -13.168 2.089 403 HD3 ARG 48 3HD ARG 48 9.033 -14.013 3.432 404 HE ARG 48 HE ARG 48 7.837 -15.284 1.044 405 HH11 ARG 48 1HH1 ARG 48 10.124 -15.503 3.750 406 HH12 ARG 48 2HH1 ARG 48 10.813 -16.988 3.176 407 HH21 ARG 48 1HH2 ARG 48 8.815 -17.149 0.293 408 HH22 ARG 48 2HH2 ARG 48 10.068 -17.921 1.210 409 H LYS 49 H LYS 49 5.254 -14.852 5.530 410 HA LYS 49 HA LYS 49 4.744 -17.699 5.151 411 HB2 LYS 49 2HB LYS 49 6.098 -16.169 7.413 412 HB3 LYS 49 3HB LYS 49 5.997 -17.925 7.317 413 HG2 LYS 49 2HG LYS 49 7.329 -17.848 5.202 414 HG3 LYS 49 3HG LYS 49 7.500 -16.104 5.404 415 HD2 LYS 49 2HD LYS 49 8.419 -18.087 7.521 416 HD3 LYS 49 3HD LYS 49 9.464 -17.569 6.201 417 HE2 LYS 49 2HE LYS 49 9.989 -16.263 8.160 418 HE3 LYS 49 3HE LYS 49 9.204 -15.207 6.989 419 HZ1 LYS 49 3HZ LYS 49 7.843 -16.455 9.321 420 HZ2 LYS 49 1HZ LYS 49 7.170 -15.336 8.254 421 HZ3 LYS 49 2HZ LYS 49 8.426 -14.877 9.277 422 H GLN 50 H GLN 50 3.539 -14.999 7.019 423 HA GLN 50 HA GLN 50 2.073 -16.479 8.967 424 HB2 GLN 50 2HB GLN 50 2.892 -14.089 9.221 425 HB3 GLN 50 3HB GLN 50 1.648 -13.590 8.084 426 HG2 GLN 50 2HG GLN 50 0.938 -13.148 10.367 427 HG3 GLN 50 3HG GLN 50 -0.096 -14.376 9.643 428 HE21 GLN 50 1HE2 GLN 50 2.414 -13.780 12.017 429 HE22 GLN 50 2HE2 GLN 50 2.234 -15.269 12.875 430 H GLY 51 H GLY 51 1.400 -15.181 5.775 431 HA2 GLY 51 2HA GLY 51 -0.175 -15.807 4.222 432 HA3 GLY 51 3HA GLY 51 -0.877 -16.908 5.396 433 H ARG 52 H ARG 52 -0.473 -13.369 4.954 434 HA ARG 52 HA ARG 52 -3.348 -12.936 5.104 435 HB2 ARG 52 2HB ARG 52 -3.266 -11.395 7.023 436 HB3 ARG 52 3HB ARG 52 -2.751 -13.006 7.496 437 HG2 ARG 52 2HG ARG 52 -0.382 -12.255 7.434 438 HG3 ARG 52 3HG ARG 52 -0.925 -10.632 6.988 439 HD2 ARG 52 2HD ARG 52 -0.424 -10.844 9.421 440 HD3 ARG 52 3HD ARG 52 -2.106 -10.396 9.114 441 HE ARG 52 HE ARG 52 -1.844 -13.218 9.319 442 HH11 ARG 52 1HH1 ARG 52 -1.910 -10.366 11.405 443 HH12 ARG 52 2HH1 ARG 52 -2.489 -11.253 12.782 444 HH21 ARG 52 1HH2 ARG 52 -2.631 -14.339 11.084 445 HH22 ARG 52 2HH2 ARG 52 -2.899 -13.524 12.594 446 HA PRO 53 HA PRO 53 -2.252 -9.227 2.683 447 HB2 PRO 53 2HB PRO 53 -4.339 -7.548 3.462 448 HB3 PRO 53 3HB PRO 53 -4.485 -8.801 2.216 449 HG2 PRO 53 2HG PRO 53 -5.312 -8.902 5.085 450 HG3 PRO 53 3HG PRO 53 -6.154 -9.519 3.647 451 HD2 PRO 53 2HD PRO 53 -4.777 -11.163 5.293 452 HD3 PRO 53 3HD PRO 53 -4.847 -11.442 3.537 453 H ILE 54 H ILE 54 -1.038 -7.436 3.065 454 HA ILE 54 HA ILE 54 -0.820 -6.356 5.808 455 HB ILE 54 HB ILE 54 1.141 -7.765 5.402 456 HG12 ILE 54 2HG1 ILE 54 1.859 -4.804 5.224 457 HG13 ILE 54 3HG1 ILE 54 1.451 -5.672 6.698 458 HG21 ILE 54 1HG2 ILE 54 1.710 -6.099 2.924 459 HG22 ILE 54 2HG2 ILE 54 1.170 -7.776 2.939 460 HG23 ILE 54 3HG2 ILE 54 2.759 -7.358 3.583 461 HD11 ILE 54 3HD1 ILE 54 3.456 -7.055 6.408 462 HD12 ILE 54 1HD1 ILE 54 3.807 -5.334 6.545 463 HD13 ILE 54 2HD1 ILE 54 3.869 -6.114 4.968 464 H VAL 55 H VAL 55 -0.690 -4.149 5.946 465 HA VAL 55 HA VAL 55 -1.027 -2.588 3.459 466 HB VAL 55 HB VAL 55 -2.260 -1.831 6.155 467 HG11 VAL 55 1HG1 VAL 55 -2.909 -0.964 3.314 468 HG12 VAL 55 2HG1 VAL 55 -2.009 -0.015 4.505 469 HG13 VAL 55 3HG1 VAL 55 -3.709 -0.399 4.786 470 HG21 VAL 55 3HG2 VAL 55 -4.419 -2.702 5.364 471 HG22 VAL 55 1HG2 VAL 55 -3.226 -3.993 5.506 472 HG23 VAL 55 2HG2 VAL 55 -3.642 -3.353 3.920 473 H ILE 56 H ILE 56 0.652 -1.225 3.137 474 HA ILE 56 HA ILE 56 2.316 -0.372 5.429 475 HB ILE 56 HB ILE 56 2.978 -0.340 2.448 476 HG12 ILE 56 2HG1 ILE 56 2.936 -2.643 3.375 477 HG13 ILE 56 3HG1 ILE 56 4.574 -2.166 2.955 478 HG21 ILE 56 1HG2 ILE 56 4.754 0.401 4.803 479 HG22 ILE 56 2HG2 ILE 56 4.135 1.503 3.572 480 HG23 ILE 56 3HG2 ILE 56 5.289 0.247 3.129 481 HD11 ILE 56 3HD1 ILE 56 4.517 -3.415 5.042 482 HD12 ILE 56 1HD1 ILE 56 3.415 -2.233 5.746 483 HD13 ILE 56 2HD1 ILE 56 5.065 -1.765 5.330 484 H PHE 57 H PHE 57 1.763 1.558 6.227 485 HA PHE 57 HA PHE 57 0.480 3.618 4.564 486 HB2 PHE 57 2HB PHE 57 0.921 3.365 7.579 487 HB3 PHE 57 3HB PHE 57 0.298 4.834 6.838 488 HD1 PHE 57 HD2 PHE 57 -0.404 1.172 7.174 489 HD2 PHE 57 HD1 PHE 57 -2.018 5.071 6.470 490 HE1 PHE 57 HE2 PHE 57 -2.688 0.258 7.250 491 HE2 PHE 57 HE1 PHE 57 -4.293 4.143 6.563 492 HZ PHE 57 HZ PHE 57 -4.618 1.743 6.924 493 H ILE 58 H ILE 58 1.660 5.177 3.680 494 HA ILE 58 HA ILE 58 4.011 6.310 5.015 495 HB ILE 58 HB ILE 58 5.234 6.414 2.757 496 HG12 ILE 58 2HG1 ILE 58 3.215 4.249 2.012 497 HG13 ILE 58 3HG1 ILE 58 3.348 5.849 1.286 498 HG21 ILE 58 1HG2 ILE 58 5.999 4.922 4.560 499 HG22 ILE 58 2HG2 ILE 58 6.277 4.211 2.972 500 HG23 ILE 58 3HG2 ILE 58 4.935 3.642 3.967 501 HD11 ILE 58 3HD1 ILE 58 4.323 4.244 -0.171 502 HD12 ILE 58 1HD1 ILE 58 5.350 3.613 1.115 503 HD13 ILE 58 2HD1 ILE 58 5.612 5.246 0.493 504 H ARG 59 H ARG 59 4.539 8.381 4.303 505 HA ARG 59 HA ARG 59 2.370 9.993 3.287 506 HB2 ARG 59 2HB ARG 59 4.047 10.607 5.141 507 HB3 ARG 59 3HB ARG 59 5.229 10.860 3.865 508 HG2 ARG 59 2HG ARG 59 3.800 12.632 2.905 509 HG3 ARG 59 3HG ARG 59 2.614 12.350 4.182 510 HD2 ARG 59 2HD ARG 59 4.379 12.936 5.876 511 HD3 ARG 59 3HD ARG 59 5.451 13.378 4.538 512 HE ARG 59 HE ARG 59 2.976 14.758 4.338 513 HH11 ARG 59 1HH1 ARG 59 5.980 14.796 6.200 514 HH12 ARG 59 2HH1 ARG 59 5.849 16.492 6.566 515 HH21 ARG 59 1HH2 ARG 59 2.801 16.954 4.868 516 HH22 ARG 59 2HH2 ARG 59 4.051 17.709 5.812 517 H GLY 60 H GLY 60 2.544 11.360 1.397 518 HA2 GLY 60 2HA GLY 60 3.156 9.967 -0.946 519 HA3 GLY 60 3HA GLY 60 2.781 11.675 -0.857 520 H ALA 61 H ALA 61 5.278 12.034 0.894 521 HA ALA 61 HA ALA 61 7.203 12.597 -1.135 522 HB1 ALA 61 3HB ALA 61 7.057 13.864 0.975 523 HB2 ALA 61 1HB ALA 61 8.679 13.211 0.746 524 HB3 ALA 61 2HB ALA 61 7.563 12.436 1.878 525 H TYR 62 H TYR 62 6.743 9.935 1.116 526 HA TYR 62 HA TYR 62 9.326 8.737 0.739 527 HB2 TYR 62 2HB TYR 62 6.870 7.730 2.230 528 HB3 TYR 62 3HB TYR 62 8.451 6.953 2.257 529 HD1 TYR 62 HD2 TYR 62 10.483 8.619 2.911 530 HD2 TYR 62 HD1 TYR 62 6.394 9.202 4.013 531 HE1 TYR 62 HE2 TYR 62 11.187 10.065 4.777 532 HE2 TYR 62 HE1 TYR 62 7.102 10.653 5.872 533 HH TYR 62 HH TYR 62 9.125 10.982 7.295 534 H GLU 63 H GLU 63 6.242 8.340 -0.802 535 HA GLU 63 HA GLU 63 6.134 5.623 -1.309 536 HB2 GLU 63 2HB GLU 63 4.425 6.056 -2.918 537 HB3 GLU 63 3HB GLU 63 4.243 7.210 -1.606 538 HG2 GLU 63 2HG GLU 63 5.065 9.005 -2.950 539 HG3 GLU 63 3HG GLU 63 5.629 7.916 -4.212 540 H GLU 64 H GLU 64 8.073 7.956 -3.036 541 HA GLU 64 HA GLU 64 8.514 6.701 -5.479 542 HB2 GLU 64 2HB GLU 64 10.662 7.950 -5.563 543 HB3 GLU 64 3HB GLU 64 9.320 8.957 -5.028 544 HG2 GLU 64 2HG GLU 64 10.056 8.845 -2.725 545 HG3 GLU 64 3HG GLU 64 11.297 7.660 -3.131 546 H VAL 65 H VAL 65 9.841 5.889 -2.347 547 HA VAL 65 HA VAL 65 12.019 4.260 -3.185 548 HB VAL 65 HB VAL 65 10.526 4.203 -0.521 549 HG11 VAL 65 1HG1 VAL 65 12.007 2.279 -0.787 550 HG12 VAL 65 2HG1 VAL 65 12.645 3.382 0.433 551 HG13 VAL 65 3HG1 VAL 65 13.358 3.343 -1.182 552 HG21 VAL 65 3HG2 VAL 65 12.908 5.927 -1.296 553 HG22 VAL 65 1HG2 VAL 65 12.182 5.826 0.310 554 HG23 VAL 65 2HG2 VAL 65 11.260 6.500 -1.035 555 H VAL 66 H VAL 66 8.579 3.634 -2.658 556 HA VAL 66 HA VAL 66 8.588 0.845 -2.306 557 HB VAL 66 HB VAL 66 6.405 2.581 -3.557 558 HG11 VAL 66 1HG1 VAL 66 6.020 0.220 -4.167 559 HG12 VAL 66 2HG1 VAL 66 4.820 0.755 -2.991 560 HG13 VAL 66 3HG1 VAL 66 6.168 -0.262 -2.475 561 HG21 VAL 66 3HG2 VAL 66 5.398 2.520 -1.303 562 HG22 VAL 66 1HG2 VAL 66 7.007 3.247 -1.275 563 HG23 VAL 66 2HG2 VAL 66 6.778 1.590 -0.710 564 H ARG 67 H ARG 67 8.781 2.763 -5.278 565 HA ARG 67 HA ARG 67 8.305 0.829 -7.241 566 HB2 ARG 67 2HB ARG 67 8.718 3.254 -7.702 567 HB3 ARG 67 3HB ARG 67 10.410 3.036 -7.285 568 HG2 ARG 67 2HG ARG 67 10.164 1.158 -9.281 569 HG3 ARG 67 3HG ARG 67 8.967 2.343 -9.806 570 HD2 ARG 67 2HD ARG 67 11.080 2.868 -10.857 571 HD3 ARG 67 3HD ARG 67 10.748 4.118 -9.651 572 HE ARG 67 HE ARG 67 12.484 1.835 -8.948 573 HH11 ARG 67 1HH1 ARG 67 12.209 5.317 -9.526 574 HH12 ARG 67 2HH1 ARG 67 13.776 5.656 -8.864 575 HH21 ARG 67 1HH2 ARG 67 14.532 2.298 -8.134 576 HH22 ARG 67 2HH2 ARG 67 15.098 3.938 -8.072 577 H ASP 68 H ASP 68 11.245 1.495 -5.389 578 HA ASP 68 HA ASP 68 12.911 -0.483 -6.644 579 HB2 ASP 68 2HB ASP 68 13.821 1.584 -5.597 580 HB3 ASP 68 3HB ASP 68 13.278 1.041 -4.017 581 H ILE 69 H ILE 69 11.064 -0.311 -3.596 582 HA ILE 69 HA ILE 69 12.021 -2.706 -2.395 583 HB ILE 69 HB ILE 69 9.342 -1.338 -1.836 584 HG12 ILE 69 2HG1 ILE 69 11.988 -0.786 -0.418 585 HG13 ILE 69 3HG1 ILE 69 11.299 0.251 -1.661 586 HG21 ILE 69 1HG2 ILE 69 11.025 -3.151 -0.054 587 HG22 ILE 69 2HG2 ILE 69 9.502 -3.583 -0.832 588 HG23 ILE 69 3HG2 ILE 69 9.526 -2.345 0.422 589 HD11 ILE 69 3HD1 ILE 69 10.845 1.111 0.566 590 HD12 ILE 69 1HD1 ILE 69 10.012 -0.385 0.994 591 HD13 ILE 69 2HD1 ILE 69 9.350 0.670 -0.260 592 H VAL 70 H VAL 70 9.349 -2.041 -4.585 593 HA VAL 70 HA VAL 70 7.580 -4.077 -3.823 594 HB VAL 70 HB VAL 70 7.017 -1.977 -5.103 595 HG11 VAL 70 1HG1 VAL 70 7.957 -3.501 -7.545 596 HG12 VAL 70 2HG1 VAL 70 8.709 -2.057 -6.864 597 HG13 VAL 70 3HG1 VAL 70 7.088 -1.963 -7.555 598 HG21 VAL 70 3HG2 VAL 70 5.893 -4.552 -6.233 599 HG22 VAL 70 1HG2 VAL 70 5.128 -2.964 -6.327 600 HG23 VAL 70 2HG2 VAL 70 5.360 -3.740 -4.761 601 H GLU 71 H GLU 71 10.280 -4.088 -6.049 602 HA GLU 71 HA GLU 71 9.761 -6.311 -7.643 603 HB2 GLU 71 2HB GLU 71 11.640 -4.676 -7.967 604 HB3 GLU 71 3HB GLU 71 12.492 -5.425 -6.621 605 HG2 GLU 71 2HG GLU 71 12.335 -7.620 -7.956 606 HG3 GLU 71 3HG GLU 71 11.824 -6.626 -9.317 607 H TYR 72 H TYR 72 10.931 -6.114 -4.362 608 HA TYR 72 HA TYR 72 11.806 -8.792 -3.995 609 HB2 TYR 72 2HB TYR 72 12.501 -7.100 -2.397 610 HB3 TYR 72 3HB TYR 72 10.834 -6.697 -2.001 611 HD1 TYR 72 HD1 TYR 72 13.355 -9.475 -1.766 612 HD2 TYR 72 HD2 TYR 72 9.741 -7.814 -0.197 613 HE1 TYR 72 HE1 TYR 72 13.375 -11.131 0.062 614 HE2 TYR 72 HE2 TYR 72 9.767 -9.466 1.614 615 HH TYR 72 HH TYR 72 10.689 -11.616 2.136 616 H ALA 73 H ALA 73 8.647 -7.215 -3.524 617 HA ALA 73 HA ALA 73 7.315 -9.535 -2.487 618 HB1 ALA 73 3HB ALA 73 5.256 -8.211 -2.776 619 HB2 ALA 73 1HB ALA 73 6.163 -6.999 -3.688 620 HB3 ALA 73 2HB ALA 73 6.524 -7.273 -1.983 621 H GLN 74 H GLN 74 7.851 -8.198 -5.708 622 HA GLN 74 HA GLN 74 5.974 -9.709 -7.217 623 HB2 GLN 74 2HB GLN 74 8.673 -8.574 -8.068 624 HB3 GLN 74 3HB GLN 74 7.431 -9.165 -9.171 625 HG2 GLN 74 2HG GLN 74 5.918 -7.377 -8.453 626 HG3 GLN 74 3HG GLN 74 7.132 -6.806 -7.304 627 HE21 GLN 74 1HE2 GLN 74 5.943 -5.425 -9.553 628 HE22 GLN 74 2HE2 GLN 74 7.248 -4.929 -10.564 629 H LYS 75 H LYS 75 9.407 -10.278 -6.416 630 HA LYS 75 HA LYS 75 9.538 -12.816 -7.780 631 HB2 LYS 75 2HB LYS 75 11.822 -12.983 -6.941 632 HB3 LYS 75 3HB LYS 75 11.536 -11.357 -7.542 633 HG2 LYS 75 2HG LYS 75 11.161 -10.624 -5.152 634 HG3 LYS 75 3HG LYS 75 11.662 -12.237 -4.648 635 HD2 LYS 75 2HD LYS 75 13.536 -10.685 -4.445 636 HD3 LYS 75 3HD LYS 75 13.885 -11.870 -5.705 637 HE2 LYS 75 2HE LYS 75 13.293 -10.218 -7.428 638 HE3 LYS 75 3HE LYS 75 12.879 -9.041 -6.179 639 HZ1 LYS 75 3HZ LYS 75 15.581 -10.198 -6.635 640 HZ2 LYS 75 1HZ LYS 75 15.178 -9.071 -5.441 641 HZ3 LYS 75 2HZ LYS 75 15.080 -8.644 -7.073 642 H GLU 76 H GLU 76 8.480 -11.811 -4.688 643 HA GLU 76 HA GLU 76 8.449 -14.453 -3.503 644 HB2 GLU 76 2HB GLU 76 7.379 -11.730 -2.684 645 HB3 GLU 76 3HB GLU 76 6.800 -13.177 -1.866 646 HG2 GLU 76 2HG GLU 76 9.650 -12.156 -1.960 647 HG3 GLU 76 3HG GLU 76 8.581 -12.257 -0.558 648 H GLY 77 H GLY 77 6.591 -12.895 -5.882 649 HA2 GLY 77 2HA GLY 77 4.752 -13.624 -7.075 650 HA3 GLY 77 3HA GLY 77 4.685 -15.038 -6.035 651 H LEU 78 H LEU 78 4.725 -11.975 -4.494 652 HA LEU 78 HA LEU 78 2.035 -12.318 -3.460 653 HB2 LEU 78 2HB LEU 78 4.071 -10.129 -2.889 654 HB3 LEU 78 3HB LEU 78 2.571 -10.392 -2.011 655 HG LEU 78 HG LEU 78 5.046 -12.157 -2.004 656 HD11 LEU 78 1HD1 LEU 78 5.155 -10.193 -0.559 657 HD12 LEU 78 2HD1 LEU 78 5.088 -11.677 0.386 658 HD13 LEU 78 3HD1 LEU 78 3.647 -10.667 0.229 659 HD21 LEU 78 3HD2 LEU 78 2.362 -12.764 -0.727 660 HD22 LEU 78 1HD2 LEU 78 3.854 -13.678 -0.476 661 HD23 LEU 78 2HD2 LEU 78 3.103 -13.640 -2.068 662 H ARG 79 H ARG 79 0.328 -10.935 -3.779 663 HA ARG 79 HA ARG 79 0.194 -9.611 -6.330 664 HB2 ARG 79 2HB ARG 79 -1.658 -10.953 -4.915 665 HB3 ARG 79 3HB ARG 79 -1.990 -9.370 -4.231 666 HG2 ARG 79 2HG ARG 79 -2.105 -10.084 -7.177 667 HG3 ARG 79 3HG ARG 79 -3.499 -9.946 -6.111 668 HD2 ARG 79 2HD ARG 79 -3.134 -7.556 -5.862 669 HD3 ARG 79 3HD ARG 79 -1.608 -7.654 -6.749 670 HE ARG 79 HE ARG 79 -3.365 -8.616 -8.544 671 HH11 ARG 79 1HH1 ARG 79 -3.385 -5.638 -6.637 672 HH12 ARG 79 2HH1 ARG 79 -4.268 -4.755 -7.842 673 HH21 ARG 79 1HH2 ARG 79 -4.439 -7.409 -10.098 674 HH22 ARG 79 2HH2 ARG 79 -4.859 -5.749 -9.784 675 H VAL 80 H VAL 80 0.830 -7.525 -6.667 676 HA VAL 80 HA VAL 80 1.328 -5.823 -4.304 677 HB VAL 80 HB VAL 80 3.052 -4.674 -5.739 678 HG11 VAL 80 1HG1 VAL 80 3.716 -6.430 -4.162 679 HG12 VAL 80 2HG1 VAL 80 4.740 -6.480 -5.593 680 HG13 VAL 80 3HG1 VAL 80 3.453 -7.675 -5.385 681 HG21 VAL 80 3HG2 VAL 80 2.174 -5.214 -7.983 682 HG22 VAL 80 1HG2 VAL 80 2.526 -6.925 -7.731 683 HG23 VAL 80 2HG2 VAL 80 3.846 -5.753 -7.826 684 H LEU 81 H LEU 81 0.104 -4.142 -4.039 685 HA LEU 81 HA LEU 81 -1.133 -2.680 -6.276 686 HB2 LEU 81 2HB LEU 81 -2.754 -4.391 -5.423 687 HB3 LEU 81 3HB LEU 81 -2.604 -3.705 -3.822 688 HG LEU 81 HG LEU 81 -3.649 -1.600 -4.618 689 HD11 LEU 81 1HD1 LEU 81 -2.933 -1.634 -6.917 690 HD12 LEU 81 2HD1 LEU 81 -4.686 -1.504 -6.834 691 HD13 LEU 81 3HD1 LEU 81 -3.933 -3.052 -7.238 692 HD21 LEU 81 3HD2 LEU 81 -5.932 -2.459 -4.897 693 HD22 LEU 81 1HD2 LEU 81 -5.072 -3.360 -3.648 694 HD23 LEU 81 2HD2 LEU 81 -5.293 -4.069 -5.250 695 H VAL 82 H VAL 82 -0.545 -0.557 -5.992 696 HA VAL 82 HA VAL 82 -0.236 0.457 -3.215 697 HB VAL 82 HB VAL 82 1.070 2.348 -4.130 698 HG11 VAL 82 1HG1 VAL 82 2.157 -0.370 -4.974 699 HG12 VAL 82 2HG1 VAL 82 2.280 0.361 -3.375 700 HG13 VAL 82 3HG1 VAL 82 3.126 1.091 -4.737 701 HG21 VAL 82 3HG2 VAL 82 1.861 2.367 -6.465 702 HG22 VAL 82 1HG2 VAL 82 0.105 2.505 -6.377 703 HG23 VAL 82 2HG2 VAL 82 0.843 0.967 -6.825 704 H ILE 83 H ILE 83 -1.820 1.622 -2.457 705 HA ILE 83 HA ILE 83 -3.827 2.905 -4.193 706 HB ILE 83 HB ILE 83 -3.914 2.374 -1.177 707 HG12 ILE 83 2HG1 ILE 83 -5.225 0.761 -3.418 708 HG13 ILE 83 3HG1 ILE 83 -3.780 0.266 -2.547 709 HG21 ILE 83 1HG2 ILE 83 -5.419 4.204 -1.869 710 HG22 ILE 83 2HG2 ILE 83 -6.347 2.787 -1.382 711 HG23 ILE 83 3HG2 ILE 83 -6.150 3.162 -3.094 712 HD11 ILE 83 3HD1 ILE 83 -5.093 0.219 -0.467 713 HD12 ILE 83 1HD1 ILE 83 -5.664 -0.895 -1.706 714 HD13 ILE 83 2HD1 ILE 83 -6.538 0.605 -1.409 715 H LYS 84 H LYS 84 -3.391 5.056 -4.567 716 HA LYS 84 HA LYS 84 -1.849 6.623 -2.561 717 HB2 LYS 84 2HB LYS 84 -0.777 7.777 -4.570 718 HB3 LYS 84 3HB LYS 84 -0.336 6.086 -4.367 719 HG2 LYS 84 2HG LYS 84 -2.094 5.518 -6.102 720 HG3 LYS 84 3HG LYS 84 -2.275 7.246 -6.388 721 HD2 LYS 84 2HD LYS 84 0.368 5.788 -6.695 722 HD3 LYS 84 3HD LYS 84 -0.791 5.953 -8.011 723 HE2 LYS 84 2HE LYS 84 0.746 7.677 -8.373 724 HE3 LYS 84 3HE LYS 84 -0.630 8.482 -7.616 725 HZ1 LYS 84 3HZ LYS 84 0.544 8.508 -5.523 726 HZ2 LYS 84 1HZ LYS 84 1.540 9.186 -6.700 727 HZ3 LYS 84 2HZ LYS 84 1.820 7.617 -6.161 728 H VAL 85 H VAL 85 -2.956 8.250 -1.781 729 HA VAL 85 HA VAL 85 -5.235 9.444 -3.151 730 HB VAL 85 HB VAL 85 -4.034 10.275 -0.461 731 HG11 VAL 85 1HG1 VAL 85 -6.249 11.250 0.004 732 HG12 VAL 85 2HG1 VAL 85 -6.818 10.751 -1.591 733 HG13 VAL 85 3HG1 VAL 85 -5.540 11.960 -1.450 734 HG21 VAL 85 3HG2 VAL 85 -4.624 7.899 -0.353 735 HG22 VAL 85 1HG2 VAL 85 -6.246 8.253 -0.955 736 HG23 VAL 85 2HG2 VAL 85 -5.739 8.853 0.627 737 H ALA 86 H ALA 86 -4.902 11.040 -4.576 738 HA ALA 86 HA ALA 86 -3.118 13.238 -4.110 739 HB1 ALA 86 3HB ALA 86 -2.386 11.288 -6.307 740 HB2 ALA 86 1HB ALA 86 -1.475 11.573 -4.823 741 HB3 ALA 86 2HB ALA 86 -1.628 12.860 -6.020 742 H GLN 87 H GLN 87 -3.435 14.924 -5.553 743 HA GLN 87 HA GLN 87 -5.608 14.716 -7.547 744 HB2 GLN 87 2HB GLN 87 -5.505 16.650 -5.191 745 HB3 GLN 87 3HB GLN 87 -6.637 16.800 -6.531 746 HG2 GLN 87 2HG GLN 87 -7.722 14.708 -5.898 747 HG3 GLN 87 3HG GLN 87 -6.506 14.430 -4.651 748 HE21 GLN 87 1HE2 GLN 87 -8.083 14.301 -3.038 749 HE22 GLN 87 2HE2 GLN 87 -8.931 15.688 -2.460 750 H ASP 88 H ASP 88 -4.986 15.721 -9.360 751 HA ASP 88 HA ASP 88 -4.031 17.085 -10.892 752 HB2 ASP 88 2HB ASP 88 -5.650 18.630 -9.784 753 HB3 ASP 88 3HB ASP 88 -4.377 19.178 -8.702 754 H GLN 89 H GLN 89 -2.004 15.876 -10.705 755 HA GLN 89 HA GLN 89 0.276 17.667 -10.304 756 HB2 GLN 89 2HB GLN 89 0.084 14.939 -8.961 757 HB3 GLN 89 3HB GLN 89 1.602 15.798 -9.179 758 HG2 GLN 89 2HG GLN 89 0.814 17.588 -7.693 759 HG3 GLN 89 3HG GLN 89 -0.738 16.759 -7.504 760 HE21 GLN 89 1HE2 GLN 89 -0.807 14.820 -6.272 761 HE22 GLN 89 2HE2 GLN 89 0.463 14.385 -5.188 762 H GLU 90 H GLU 90 1.355 17.566 -12.164 763 HA GLU 90 HA GLU 90 1.016 15.483 -14.121 764 HB2 GLU 90 2HB GLU 90 2.977 17.810 -14.012 765 HB3 GLU 90 3HB GLU 90 2.626 16.836 -15.441 766 HG2 GLU 90 2HG GLU 90 0.367 17.679 -15.566 767 HG3 GLU 90 3HG GLU 90 0.503 18.444 -13.984 768 H LEU 91 H LEU 91 3.481 16.359 -11.753 769 HA LEU 91 HA LEU 91 5.544 14.549 -12.459 770 HB2 LEU 91 2HB LEU 91 4.807 15.856 -9.813 771 HB3 LEU 91 3HB LEU 91 6.181 14.775 -9.955 772 HG LEU 91 HG LEU 91 7.218 16.338 -11.617 773 HD11 LEU 91 1HD1 LEU 91 6.382 18.617 -11.884 774 HD12 LEU 91 2HD1 LEU 91 4.950 18.223 -10.929 775 HD13 LEU 91 3HD1 LEU 91 5.217 17.439 -12.488 776 HD21 LEU 91 3HD2 LEU 91 6.555 17.580 -8.929 777 HD22 LEU 91 1HD2 LEU 91 7.900 18.041 -9.978 778 HD23 LEU 91 2HD2 LEU 91 7.857 16.434 -9.259 779 H LEU 92 H LEU 92 2.616 14.210 -10.605 780 HA LEU 92 HA LEU 92 2.981 11.799 -9.248 781 HB2 LEU 92 2HB LEU 92 1.047 13.424 -9.046 782 HB3 LEU 92 3HB LEU 92 0.425 12.796 -10.554 783 HG LEU 92 HG LEU 92 0.436 10.474 -9.292 784 HD11 LEU 92 1HD1 LEU 92 1.704 11.233 -7.342 785 HD12 LEU 92 2HD1 LEU 92 0.107 10.652 -6.879 786 HD13 LEU 92 3HD1 LEU 92 0.423 12.389 -6.940 787 HD21 LEU 92 3HD2 LEU 92 -1.600 11.633 -10.081 788 HD22 LEU 92 1HD2 LEU 92 -1.619 12.608 -8.608 789 HD23 LEU 92 2HD2 LEU 92 -1.862 10.861 -8.518 790 H GLU 93 H GLU 93 1.759 12.488 -12.489 791 HA GLU 93 HA GLU 93 0.985 9.847 -13.183 792 HB2 GLU 93 2HB GLU 93 1.482 12.309 -14.908 793 HB3 GLU 93 3HB GLU 93 0.743 10.817 -15.487 794 HG2 GLU 93 2HG GLU 93 -1.129 11.112 -13.910 795 HG3 GLU 93 3HG GLU 93 -0.383 12.587 -13.299 796 H ARG 94 H ARG 94 4.008 11.580 -13.418 797 HA ARG 94 HA ARG 94 5.324 9.861 -15.267 798 HB2 ARG 94 2HB ARG 94 6.173 12.119 -14.705 799 HB3 ARG 94 3HB ARG 94 6.501 11.605 -13.054 800 HG2 ARG 94 2HG ARG 94 8.185 9.981 -13.928 801 HG3 ARG 94 3HG ARG 94 7.871 10.567 -15.560 802 HD2 ARG 94 2HD ARG 94 8.734 12.769 -14.994 803 HD3 ARG 94 3HD ARG 94 8.899 12.312 -13.294 804 HE ARG 94 HE ARG 94 10.407 10.696 -15.189 805 HH11 ARG 94 1HH1 ARG 94 10.520 13.485 -13.035 806 HH12 ARG 94 2HH1 ARG 94 12.254 13.471 -12.917 807 HH21 ARG 94 1HH2 ARG 94 12.686 10.661 -14.982 808 HH22 ARG 94 2HH2 ARG 94 13.482 11.872 -14.022 809 H PHE 95 H PHE 95 5.267 9.937 -11.681 810 HA PHE 95 HA PHE 95 6.790 7.550 -11.282 811 HB2 PHE 95 2HB PHE 95 6.593 9.188 -9.465 812 HB3 PHE 95 3HB PHE 95 4.841 8.998 -9.422 813 HD1 PHE 95 HD2 PHE 95 8.000 6.988 -9.032 814 HD2 PHE 95 HD1 PHE 95 3.908 7.476 -7.829 815 HE1 PHE 95 HE2 PHE 95 8.254 5.175 -7.388 816 HE2 PHE 95 HE1 PHE 95 4.189 5.654 -6.194 817 HZ PHE 95 HZ PHE 95 6.355 4.506 -5.973 818 H TYR 96 H TYR 96 3.358 8.241 -11.489 819 HA TYR 96 HA TYR 96 2.238 5.808 -10.728 820 HB2 TYR 96 2HB TYR 96 0.861 7.769 -10.864 821 HB3 TYR 96 3HB TYR 96 1.285 8.048 -12.548 822 HD1 TYR 96 HD1 TYR 96 -0.450 5.581 -10.339 823 HD2 TYR 96 HD2 TYR 96 -0.181 7.287 -14.239 824 HE1 TYR 96 HE1 TYR 96 -2.432 4.350 -11.009 825 HE2 TYR 96 HE2 TYR 96 -2.179 6.041 -14.927 826 HH TYR 96 HH TYR 96 -3.479 4.137 -14.303 827 H GLU 97 H GLU 97 3.153 7.035 -13.920 828 HA GLU 97 HA GLU 97 2.258 4.896 -15.526 829 HB2 GLU 97 2HB GLU 97 2.747 7.181 -16.385 830 HB3 GLU 97 3HB GLU 97 4.464 6.942 -16.049 831 HG2 GLU 97 2HG GLU 97 4.178 4.856 -17.668 832 HG3 GLU 97 3HG GLU 97 2.756 5.733 -18.216 833 H GLN 98 H GLN 98 5.203 5.422 -13.686 834 HA GLN 98 HA GLN 98 6.929 3.573 -14.940 835 HB2 GLN 98 2HB GLN 98 7.778 5.278 -13.418 836 HB3 GLN 98 3HB GLN 98 6.831 4.626 -12.082 837 HG2 GLN 98 2HG GLN 98 9.161 4.006 -11.805 838 HG3 GLN 98 3HG GLN 98 8.214 2.557 -12.141 839 HE21 GLN 98 1HE2 GLN 98 8.532 1.480 -14.136 840 HE22 GLN 98 2HE2 GLN 98 9.902 1.801 -15.135 841 H LEU 99 H LEU 99 4.665 3.168 -12.196 842 HA LEU 99 HA LEU 99 5.348 0.391 -11.775 843 HB2 LEU 99 2HB LEU 99 3.109 2.116 -10.661 844 HB3 LEU 99 3HB LEU 99 3.277 0.411 -10.269 845 HG LEU 99 HG LEU 99 5.579 0.920 -9.319 846 HD11 LEU 99 1HD1 LEU 99 6.131 3.240 -8.728 847 HD12 LEU 99 2HD1 LEU 99 4.724 3.806 -9.642 848 HD13 LEU 99 3HD1 LEU 99 6.057 3.007 -10.477 849 HD21 LEU 99 3HD2 LEU 99 3.654 0.627 -7.855 850 HD22 LEU 99 1HD2 LEU 99 3.238 2.336 -8.016 851 HD23 LEU 99 2HD2 LEU 99 4.736 1.858 -7.208 852 H LYS 100 H LYS 100 2.978 2.151 -13.628 853 HA LYS 100 HA LYS 100 1.406 -0.116 -14.443 854 HB2 LYS 100 2HB LYS 100 1.671 2.649 -15.682 855 HB3 LYS 100 3HB LYS 100 0.429 1.473 -16.089 856 HG2 LYS 100 2HG LYS 100 0.713 2.495 -13.250 857 HG3 LYS 100 3HG LYS 100 -0.127 3.442 -14.474 858 HD2 LYS 100 2HD LYS 100 -1.899 2.340 -13.456 859 HD3 LYS 100 3HD LYS 100 -1.584 1.276 -14.820 860 HE2 LYS 100 2HE LYS 100 -0.370 0.713 -12.106 861 HE3 LYS 100 3HE LYS 100 -2.028 0.252 -12.450 862 HZ1 LYS 100 3HZ LYS 100 -0.316 -1.505 -12.787 863 HZ2 LYS 100 1HZ LYS 100 0.247 -0.637 -14.113 864 HZ3 LYS 100 2HZ LYS 100 -1.323 -1.234 -14.117 865 H LYS 101 H LYS 101 4.330 1.405 -15.537 866 HA LYS 101 HA LYS 101 4.584 0.250 -18.150 867 HB2 LYS 101 2HB LYS 101 5.774 2.328 -17.327 868 HB3 LYS 101 3HB LYS 101 6.737 1.328 -16.251 869 HG2 LYS 101 2HG LYS 101 7.666 0.163 -18.274 870 HG3 LYS 101 3HG LYS 101 6.794 1.320 -19.287 871 HD2 LYS 101 2HD LYS 101 8.995 1.935 -17.276 872 HD3 LYS 101 3HD LYS 101 9.118 2.043 -19.031 873 HE2 LYS 101 2HE LYS 101 7.431 3.808 -17.218 874 HE3 LYS 101 3HE LYS 101 8.894 4.278 -18.078 875 HZ1 LYS 101 3HZ LYS 101 6.932 5.068 -19.214 876 HZ2 LYS 101 1HZ LYS 101 6.320 3.500 -19.345 877 HZ3 LYS 101 2HZ LYS 101 7.727 3.930 -20.172 878 H ASP 102 H ASP 102 5.760 -0.458 -14.937 879 HA ASP 102 HA ASP 102 7.229 -2.827 -15.423 880 HB2 ASP 102 2HB ASP 102 7.614 -1.527 -13.417 881 HB3 ASP 102 3HB ASP 102 5.922 -1.610 -12.942 882 H GLY 103 H GLY 103 4.080 -2.450 -13.787 883 HA2 GLY 103 2HA GLY 103 2.344 -4.047 -14.972 884 HA3 GLY 103 3HA GLY 103 3.396 -5.254 -14.232 885 H VAL 104 H VAL 104 3.919 -3.297 -11.940 886 HA VAL 104 HA VAL 104 2.210 -4.230 -9.995 887 HB VAL 104 HB VAL 104 3.632 -1.517 -10.036 888 HG11 VAL 104 1HG1 VAL 104 1.826 -1.430 -8.363 889 HG12 VAL 104 2HG1 VAL 104 3.396 -1.482 -7.565 890 HG13 VAL 104 3HG1 VAL 104 2.396 -2.936 -7.639 891 HG21 VAL 104 3HG2 VAL 104 5.330 -2.629 -8.629 892 HG22 VAL 104 1HG2 VAL 104 5.156 -3.440 -10.184 893 HG23 VAL 104 2HG2 VAL 104 4.432 -4.148 -8.739 894 H ASP 105 H ASP 105 0.104 -3.968 -9.593 895 HA ASP 105 HA ASP 105 -1.527 -2.169 -11.113 896 HB2 ASP 105 2HB ASP 105 -2.198 -4.500 -10.193 897 HB3 ASP 105 3HB ASP 105 -2.421 -3.718 -8.650 898 H VAL 106 H VAL 106 -2.651 -0.339 -10.373 899 HA VAL 106 HA VAL 106 -1.847 0.818 -7.772 900 HB VAL 106 HB VAL 106 -1.833 2.396 -10.404 901 HG11 VAL 106 1HG1 VAL 106 -1.041 3.244 -7.594 902 HG12 VAL 106 2HG1 VAL 106 -2.487 3.748 -8.471 903 HG13 VAL 106 3HG1 VAL 106 -0.892 4.230 -9.053 904 HG21 VAL 106 3HG2 VAL 106 0.589 1.535 -8.771 905 HG22 VAL 106 1HG2 VAL 106 0.605 2.583 -10.194 906 HG23 VAL 106 2HG2 VAL 106 0.121 0.893 -10.344 907 H ARG 107 H ARG 107 -3.684 1.397 -6.708 908 HA ARG 107 HA ARG 107 -6.032 2.309 -8.244 909 HB2 ARG 107 2HB ARG 107 -5.718 1.716 -5.270 910 HB3 ARG 107 3HB ARG 107 -7.196 2.311 -6.013 911 HG2 ARG 107 2HG ARG 107 -5.876 -0.336 -6.657 912 HG3 ARG 107 3HG ARG 107 -7.228 -0.126 -5.547 913 HD2 ARG 107 2HD ARG 107 -8.165 -0.900 -7.600 914 HD3 ARG 107 3HD ARG 107 -8.541 0.820 -7.525 915 HE ARG 107 HE ARG 107 -6.890 1.231 -9.206 916 HH11 ARG 107 1HH1 ARG 107 -7.481 -2.205 -8.735 917 HH12 ARG 107 2HH1 ARG 107 -6.792 -2.648 -10.258 918 HH21 ARG 107 1HH2 ARG 107 -5.952 0.623 -11.167 919 HH22 ARG 107 2HH2 ARG 107 -5.929 -1.047 -11.633 920 H VAL 108 H VAL 108 -5.684 4.388 -8.864 921 HA VAL 108 HA VAL 108 -4.698 6.393 -7.003 922 HB VAL 108 HB VAL 108 -5.414 8.053 -8.858 923 HG11 VAL 108 1HG1 VAL 108 -3.425 7.566 -10.237 924 HG12 VAL 108 2HG1 VAL 108 -3.328 5.949 -9.535 925 HG13 VAL 108 3HG1 VAL 108 -3.088 7.368 -8.516 926 HG21 VAL 108 3HG2 VAL 108 -5.741 5.499 -10.490 927 HG22 VAL 108 1HG2 VAL 108 -5.764 7.147 -11.133 928 HG23 VAL 108 2HG2 VAL 108 -7.036 6.607 -10.037 929 H THR 109 H THR 109 -5.915 7.293 -5.549 930 HA THR 109 HA THR 109 -8.859 7.377 -5.851 931 HB THR 109 HB THR 109 -8.512 5.752 -4.176 932 HG1 THR 109 HG1 THR 109 -8.721 8.000 -2.491 933 HG21 THR 109 3HG2 THR 109 -6.445 7.524 -2.831 934 HG22 THR 109 1HG2 THR 109 -6.104 6.060 -3.758 935 HG23 THR 109 2HG2 THR 109 -7.007 5.957 -2.245 936 H ASP 110 H ASP 110 -9.134 9.392 -6.513 937 HA ASP 110 HA ASP 110 -7.474 11.607 -5.704 938 HB2 ASP 110 2HB ASP 110 -8.771 12.910 -7.321 939 HB3 ASP 110 3HB ASP 110 -8.309 11.370 -8.030 940 H ASN 111 H ASN 111 -9.825 10.145 -4.017 941 HA ASN 111 HA ASN 111 -10.451 12.613 -2.522 942 HB2 ASN 111 2HB ASN 111 -12.338 10.287 -3.088 943 HB3 ASN 111 3HB ASN 111 -12.653 11.512 -1.865 944 HD21 ASN 111 1HD2 ASN 111 -13.183 13.620 -2.531 945 HD22 ASN 111 2HD2 ASN 111 -13.664 13.981 -4.152 946 H GLU 112 H GLU 112 -10.678 12.354 -0.315 947 HA GLU 112 HA GLU 112 -8.770 10.604 0.924 948 HB2 GLU 112 2HB GLU 112 -10.810 12.455 2.255 949 HB3 GLU 112 3HB GLU 112 -9.305 11.860 2.952 950 HG2 GLU 112 2HG GLU 112 -7.989 13.212 1.442 951 HG3 GLU 112 3HG GLU 112 -9.423 13.663 0.524 952 H ASP 113 H ASP 113 -12.274 10.950 0.891 953 HA ASP 113 HA ASP 113 -12.856 8.804 2.708 954 HB2 ASP 113 2HB ASP 113 -14.298 10.890 2.345 955 HB3 ASP 113 3HB ASP 113 -14.822 10.179 0.825 956 H GLU 114 H GLU 114 -12.636 9.120 -0.811 957 HA GLU 114 HA GLU 114 -13.718 6.600 -1.528 958 HB2 GLU 114 2HB GLU 114 -13.378 8.299 -3.239 959 HB3 GLU 114 3HB GLU 114 -11.645 8.328 -2.944 960 HG2 GLU 114 2HG GLU 114 -12.256 7.150 -5.044 961 HG3 GLU 114 3HG GLU 114 -11.380 6.125 -3.912 962 H ALA 115 H ALA 115 -10.536 7.600 -0.427 963 HA ALA 115 HA ALA 115 -9.136 5.184 -0.903 964 HB1 ALA 115 3HB ALA 115 -8.038 7.341 -0.526 965 HB2 ALA 115 1HB ALA 115 -7.458 6.126 0.614 966 HB3 ALA 115 2HB ALA 115 -8.611 7.355 1.143 967 H LYS 116 H LYS 116 -11.013 6.400 1.850 968 HA LYS 116 HA LYS 116 -10.540 4.447 3.798 969 HB2 LYS 116 2HB LYS 116 -11.646 6.417 4.472 970 HB3 LYS 116 3HB LYS 116 -12.781 6.361 3.132 971 HG2 LYS 116 2HG LYS 116 -13.892 4.395 4.256 972 HG3 LYS 116 3HG LYS 116 -12.852 4.673 5.650 973 HD2 LYS 116 2HD LYS 116 -14.799 6.682 4.472 974 HD3 LYS 116 3HD LYS 116 -15.104 5.701 5.906 975 HE2 LYS 116 2HE LYS 116 -13.226 6.823 7.062 976 HE3 LYS 116 3HE LYS 116 -12.928 7.797 5.616 977 HZ1 LYS 116 3HZ LYS 116 -14.214 9.044 7.204 978 HZ2 LYS 116 1HZ LYS 116 -15.394 7.831 7.283 979 HZ3 LYS 116 2HZ LYS 116 -15.177 8.712 5.854 980 H LYS 117 H LYS 117 -13.209 4.627 1.424 981 HA LYS 117 HA LYS 117 -14.365 2.109 2.123 982 HB2 LYS 117 2HB LYS 117 -15.778 2.461 0.057 983 HB3 LYS 117 3HB LYS 117 -15.820 3.781 1.220 984 HG2 LYS 117 2HG LYS 117 -14.238 5.059 -0.167 985 HG3 LYS 117 3HG LYS 117 -14.204 3.748 -1.342 986 HD2 LYS 117 2HD LYS 117 -16.729 5.273 -0.595 987 HD3 LYS 117 3HD LYS 117 -15.687 5.709 -1.948 988 HE2 LYS 117 2HE LYS 117 -17.139 3.065 -1.631 989 HE3 LYS 117 3HE LYS 117 -17.628 4.390 -2.686 990 HZ1 LYS 117 3HZ LYS 117 -15.459 4.136 -3.833 991 HZ2 LYS 117 1HZ LYS 117 -16.475 2.791 -3.982 992 HZ3 LYS 117 2HZ LYS 117 -15.168 2.747 -2.914 993 H ARG 118 H ARG 118 -11.956 3.085 -0.228 994 HA ARG 118 HA ARG 118 -11.916 0.837 -1.938 995 HB2 ARG 118 2HB ARG 118 -10.810 3.070 -2.379 996 HB3 ARG 118 3HB ARG 118 -9.585 2.664 -1.186 997 HG2 ARG 118 2HG ARG 118 -8.672 2.281 -3.385 998 HG3 ARG 118 3HG ARG 118 -8.912 0.711 -2.611 999 HD2 ARG 118 2HD ARG 118 -9.605 0.671 -4.974 1000 HD3 ARG 118 3HD ARG 118 -10.982 0.384 -3.907 1001 HE ARG 118 HE ARG 118 -11.220 3.009 -4.270 1002 HH11 ARG 118 1HH1 ARG 118 -10.622 0.517 -6.685 1003 HH12 ARG 118 2HH1 ARG 118 -11.390 1.393 -7.966 1004 HH21 ARG 118 1HH2 ARG 118 -12.248 4.132 -5.938 1005 HH22 ARG 118 2HH2 ARG 118 -12.319 3.465 -7.539 1006 H LEU 119 H LEU 119 -10.249 1.564 1.099 1007 HA LEU 119 HA LEU 119 -8.501 -0.675 1.171 1008 HB2 LEU 119 2HB LEU 119 -9.564 1.194 3.323 1009 HB3 LEU 119 3HB LEU 119 -8.403 -0.081 3.680 1010 HG LEU 119 HG LEU 119 -7.916 2.182 1.706 1011 HD11 LEU 119 1HD1 LEU 119 -6.814 1.857 4.510 1012 HD12 LEU 119 2HD1 LEU 119 -8.047 3.018 4.014 1013 HD13 LEU 119 3HD1 LEU 119 -6.415 3.139 3.364 1014 HD21 LEU 119 3HD2 LEU 119 -6.698 0.115 1.157 1015 HD22 LEU 119 1HD2 LEU 119 -6.006 0.086 2.782 1016 HD23 LEU 119 2HD2 LEU 119 -5.611 1.398 1.668 1017 H LYS 120 H LYS 120 -11.581 -0.034 2.866 1018 HA LYS 120 HA LYS 120 -11.853 -2.533 4.122 1019 HB2 LYS 120 2HB LYS 120 -13.151 -0.516 4.759 1020 HB3 LYS 120 3HB LYS 120 -14.047 -0.606 3.245 1021 HG2 LYS 120 2HG LYS 120 -14.931 -2.854 3.971 1022 HG3 LYS 120 3HG LYS 120 -14.106 -2.626 5.517 1023 HD2 LYS 120 2HD LYS 120 -16.492 -2.030 5.713 1024 HD3 LYS 120 3HD LYS 120 -15.481 -0.604 5.957 1025 HE2 LYS 120 2HE LYS 120 -15.904 0.044 3.577 1026 HE3 LYS 120 3HE LYS 120 -16.998 -1.333 3.425 1027 HZ1 LYS 120 3HZ LYS 120 -18.407 -0.375 5.113 1028 HZ2 LYS 120 1HZ LYS 120 -18.161 0.755 3.879 1029 HZ3 LYS 120 2HZ LYS 120 -17.336 0.912 5.344 1030 H GLU 121 H GLU 121 -12.820 -1.394 0.938 1031 HA GLU 121 HA GLU 121 -14.485 -3.384 -0.035 1032 HB2 GLU 121 2HB GLU 121 -13.981 -1.277 -1.236 1033 HB3 GLU 121 3HB GLU 121 -12.330 -1.811 -1.509 1034 HG2 GLU 121 2HG GLU 121 -13.480 -2.103 -3.562 1035 HG3 GLU 121 3HG GLU 121 -13.268 -3.711 -2.880 1036 H LEU 122 H LEU 122 -10.952 -3.192 -0.104 1037 HA LEU 122 HA LEU 122 -10.514 -5.656 -1.487 1038 HB2 LEU 122 2HB LEU 122 -8.609 -3.957 0.174 1039 HB3 LEU 122 3HB LEU 122 -8.124 -5.282 -0.878 1040 HG LEU 122 HG LEU 122 -9.497 -2.735 -1.825 1041 HD11 LEU 122 1HD1 LEU 122 -6.595 -3.555 -2.069 1042 HD12 LEU 122 2HD1 LEU 122 -7.238 -2.284 -1.026 1043 HD13 LEU 122 3HD1 LEU 122 -7.336 -2.115 -2.777 1044 HD21 LEU 122 3HD2 LEU 122 -8.322 -5.029 -3.434 1045 HD22 LEU 122 1HD2 LEU 122 -8.932 -3.512 -4.099 1046 HD23 LEU 122 2HD2 LEU 122 -10.033 -4.619 -3.286 1047 H LEU 123 H LEU 123 -10.341 -4.671 1.942 1048 HA LEU 123 HA LEU 123 -9.354 -7.068 3.027 1049 HB2 LEU 123 2HB LEU 123 -10.787 -4.680 4.153 1050 HB3 LEU 123 3HB LEU 123 -10.717 -6.117 5.157 1051 HG LEU 123 HG LEU 123 -8.223 -6.059 5.067 1052 HD11 LEU 123 1HD1 LEU 123 -7.010 -4.122 4.239 1053 HD12 LEU 123 2HD1 LEU 123 -8.505 -3.418 3.618 1054 HD13 LEU 123 3HD1 LEU 123 -7.878 -4.914 2.924 1055 HD21 LEU 123 3HD2 LEU 123 -9.514 -3.503 6.046 1056 HD22 LEU 123 1HD2 LEU 123 -7.966 -4.165 6.581 1057 HD23 LEU 123 2HD2 LEU 123 -9.456 -5.038 6.915 1058 H GLU 124 H GLU 124 -12.677 -6.166 2.228 1059 HA GLU 124 HA GLU 124 -13.980 -8.334 3.502 1060 HB2 GLU 124 2HB GLU 124 -14.840 -6.729 1.070 1061 HB3 GLU 124 3HB GLU 124 -15.884 -7.838 1.949 1062 HG2 GLU 124 2HG GLU 124 -14.725 -5.220 2.924 1063 HG3 GLU 124 3HG GLU 124 -16.419 -5.620 2.665 1064 H LYS 125 H LYS 125 -12.192 -8.162 0.536 1065 HA LYS 125 HA LYS 125 -12.827 -10.979 -0.136 1066 HB2 LYS 125 2HB LYS 125 -11.789 -8.689 -1.873 1067 HB3 LYS 125 3HB LYS 125 -11.908 -10.357 -2.429 1068 HG2 LYS 125 2HG LYS 125 -14.355 -10.303 -2.128 1069 HG3 LYS 125 3HG LYS 125 -14.256 -8.655 -1.512 1070 HD2 LYS 125 2HD LYS 125 -13.376 -9.468 -4.309 1071 HD3 LYS 125 3HD LYS 125 -14.980 -8.843 -3.930 1072 HE2 LYS 125 2HE LYS 125 -12.371 -7.348 -3.491 1073 HE3 LYS 125 3HE LYS 125 -13.488 -7.091 -4.829 1074 HZ1 LYS 125 3HZ LYS 125 -13.841 -5.452 -3.123 1075 HZ2 LYS 125 1HZ LYS 125 -14.091 -6.648 -1.955 1076 HZ3 LYS 125 2HZ LYS 125 -15.191 -6.458 -3.220 1077 H VAL 126 H VAL 126 -10.737 -9.525 1.759 1078 HA VAL 126 HA VAL 126 -8.732 -10.031 2.694 1079 HB VAL 126 HB VAL 126 -8.704 -12.448 0.816 1080 HG11 VAL 126 1HG1 VAL 126 -6.456 -12.082 1.725 1081 HG12 VAL 126 2HG1 VAL 126 -7.179 -13.528 2.422 1082 HG13 VAL 126 3HG1 VAL 126 -7.102 -12.039 3.368 1083 HG21 VAL 126 3HG2 VAL 126 -9.724 -12.226 3.681 1084 HG22 VAL 126 1HG2 VAL 126 -9.646 -13.714 2.732 1085 HG23 VAL 126 2HG2 VAL 126 -10.718 -12.407 2.233 1086 H GLY 127 H GLY 127 -9.068 -8.813 -0.244 1087 HA2 GLY 127 2HA GLY 127 -7.105 -7.132 -0.570 1088 HA3 GLY 127 3HA GLY 127 -6.249 -8.611 -1.026 1089 H SER 128 H SER 128 -6.045 -7.492 -3.126 1090 HA SER 128 HA SER 128 -8.423 -7.611 -4.848 1091 HB2 SER 128 2HB SER 128 -6.828 -6.611 -6.559 1092 HB3 SER 128 3HB SER 128 -7.077 -5.620 -5.120 1093 HG SER 128 HG SER 128 -4.884 -7.367 -5.571 1094 H LEU 129 H LEU 129 -8.351 -10.007 -4.261 1095 HA LEU 129 HA LEU 129 -6.486 -11.654 -5.806 1096 HB2 LEU 129 2HB LEU 129 -8.847 -12.432 -4.043 1097 HB3 LEU 129 3HB LEU 129 -7.889 -13.589 -4.948 1098 HG LEU 129 HG LEU 129 -5.852 -12.694 -3.591 1099 HD11 LEU 129 1HD1 LEU 129 -6.877 -10.692 -2.668 1100 HD12 LEU 129 2HD1 LEU 129 -6.360 -11.774 -1.378 1101 HD13 LEU 129 3HD1 LEU 129 -8.069 -11.668 -1.806 1102 HD21 LEU 129 3HD2 LEU 129 -8.011 -14.299 -2.186 1103 HD22 LEU 129 1HD2 LEU 129 -6.308 -14.237 -1.721 1104 HD23 LEU 129 2HD2 LEU 129 -6.773 -14.936 -3.269 1105 H GLU 130 H GLU 130 -7.360 -13.363 -7.211 1106 HA GLU 130 HA GLU 130 -8.282 -14.028 -9.144 1107 HB2 GLU 130 2HB GLU 130 -10.822 -12.900 -7.900 1108 HB3 GLU 130 3HB GLU 130 -10.767 -13.990 -9.278 1109 HG2 GLU 130 2HG GLU 130 -9.888 -14.614 -6.449 1110 HG3 GLU 130 3HG GLU 130 -11.318 -15.238 -7.270 1111 H HIS 131 H HIS 131 -6.944 -11.617 -9.377 1112 HA HIS 131 HA HIS 131 -8.374 -9.618 -10.775 1113 HB2 HIS 131 2HB HIS 131 -6.130 -9.172 -9.801 1114 HB3 HIS 131 3HB HIS 131 -5.401 -10.242 -10.992 1115 HD1 HIS 131 HD1 HIS 131 -7.038 -6.853 -10.669 1116 HD2 HIS 131 HD2 HIS 131 -5.066 -9.117 -13.566 1117 HE1 HIS 131 HE1 HIS 131 -6.644 -5.297 -12.604 1118 HE2 HIS 131 HE2 HIS 131 -5.624 -6.733 -14.394 1119 H HIS 132 H HIS 132 -9.654 -10.458 -12.283 1120 HA HIS 132 HA HIS 132 -8.478 -11.590 -14.754 1121 HB2 HIS 132 2HB HIS 132 -11.040 -12.501 -13.354 1122 HB3 HIS 132 3HB HIS 132 -10.551 -13.016 -14.968 1123 HD1 HIS 132 HD1 HIS 132 -10.405 -14.106 -11.553 1124 HD2 HIS 132 HD2 HIS 132 -7.841 -14.375 -14.818 1125 HE1 HIS 132 HE1 HIS 132 -8.803 -15.967 -11.006 1126 HE2 HIS 132 HE2 HIS 132 -7.364 -16.196 -13.053 1127 H HIS 133 H HIS 133 -9.475 -10.828 -16.638 1128 HA HIS 133 HA HIS 133 -10.229 -9.168 -17.998 1129 HB2 HIS 133 2HB HIS 133 -12.439 -8.631 -15.964 1130 HB3 HIS 133 3HB HIS 133 -12.475 -8.313 -17.694 1131 HD1 HIS 133 HD1 HIS 133 -13.172 -10.900 -15.156 1132 HD2 HIS 133 HD2 HIS 133 -12.919 -10.683 -19.303 1133 HE1 HIS 133 HE1 HIS 133 -14.191 -13.029 -16.002 1134 HE2 HIS 133 HE2 HIS 133 -14.195 -12.784 -18.505 1135 H HIS 134 H HIS 134 -11.489 -6.608 -17.122 1136 HA HIS 134 HA HIS 134 -11.047 -4.549 -16.311 1137 HB2 HIS 134 2HB HIS 134 -9.552 -6.056 -14.119 1138 HB3 HIS 134 3HB HIS 134 -10.034 -4.360 -14.035 1139 HD1 HIS 134 HD1 HIS 134 -11.239 -7.739 -13.321 1140 HD2 HIS 134 HD2 HIS 134 -12.960 -4.021 -14.012 1141 HE1 HIS 134 HE1 HIS 134 -13.621 -7.950 -12.559 1142 HE2 HIS 134 HE2 HIS 134 -14.550 -5.627 -12.758 1143 H HIS 135 H HIS 135 -9.246 -5.793 -18.242 1144 HA HIS 135 HA HIS 135 -6.612 -4.699 -17.797 1145 HB2 HIS 135 2HB HIS 135 -6.183 -5.342 -20.198 1146 HB3 HIS 135 3HB HIS 135 -6.754 -6.680 -19.209 1147 HD1 HIS 135 HD1 HIS 135 -7.857 -4.406 -22.013 1148 HD2 HIS 135 HD2 HIS 135 -9.158 -7.834 -20.051 1149 HE1 HIS 135 HE1 HIS 135 -9.741 -5.304 -23.402 1150 HE2 HIS 135 HE2 HIS 135 -10.591 -7.296 -22.137 1151 H HIS 136 H HIS 136 -7.158 -2.625 -17.209 1152 HA HIS 136 HA HIS 136 -7.383 -0.411 -17.358 1153 HB2 HIS 136 2HB HIS 136 -7.165 -0.797 -20.379 1154 HB3 HIS 136 3HB HIS 136 -7.052 0.750 -19.543 1155 HD1 HIS 136 HD1 HIS 136 -4.974 -1.901 -20.808 1156 HD2 HIS 136 HD2 HIS 136 -4.779 0.735 -17.599 1157 HE1 HIS 136 HE1 HIS 136 -2.583 -1.930 -20.047 1158 HE2 HIS 136 HE2 HIS 136 -2.449 -0.146 -18.291 Start of MODEL 15 1 H1 MET 1 1H MET 1 -3.779 -16.185 1.824 2 H2 MET 1 2H MET 1 -2.791 -15.114 2.670 3 H3 MET 1 3H MET 1 -2.145 -16.034 1.411 4 HA MET 1 HA MET 1 -3.528 -14.910 -0.182 5 HB2 MET 1 2HB MET 1 -4.396 -13.225 2.215 6 HB3 MET 1 3HB MET 1 -4.795 -12.869 0.537 7 HG2 MET 1 2HG MET 1 -6.700 -13.890 1.602 8 HG3 MET 1 3HG MET 1 -6.044 -15.014 0.412 9 HE1 MET 1 3HE MET 1 -7.411 -17.077 1.494 10 HE2 MET 1 1HE MET 1 -8.124 -15.939 2.637 11 HE3 MET 1 2HE MET 1 -7.389 -17.431 3.222 12 H GLY 2 H GLY 2 -1.633 -14.336 -1.131 13 HA2 GLY 2 2HA GLY 2 0.370 -12.693 0.218 14 HA3 GLY 2 3HA GLY 2 0.518 -13.480 -1.344 15 H THR 3 H THR 3 -1.912 -11.150 -0.154 16 HA THR 3 HA THR 3 -1.449 -9.413 -2.451 17 HB THR 3 HB THR 3 -3.395 -8.855 -0.157 18 HG1 THR 3 HG1 THR 3 -4.932 -10.026 -1.469 19 HG21 THR 3 3HG2 THR 3 -3.467 -8.149 -3.113 20 HG22 THR 3 1HG2 THR 3 -3.081 -7.036 -1.796 21 HG23 THR 3 2HG2 THR 3 -4.700 -7.729 -1.924 22 H VAL 4 H VAL 4 -0.478 -7.415 -2.327 23 HA VAL 4 HA VAL 4 0.417 -6.366 0.302 24 HB VAL 4 HB VAL 4 1.954 -5.994 -2.339 25 HG11 VAL 4 1HG1 VAL 4 3.760 -5.113 -0.901 26 HG12 VAL 4 2HG1 VAL 4 2.763 -5.365 0.533 27 HG13 VAL 4 3HG1 VAL 4 2.273 -4.187 -0.686 28 HG21 VAL 4 3HG2 VAL 4 2.090 -8.368 -1.690 29 HG22 VAL 4 1HG2 VAL 4 2.665 -7.912 -0.084 30 HG23 VAL 4 2HG2 VAL 4 3.654 -7.573 -1.509 31 H VAL 5 H VAL 5 -0.780 -4.585 0.625 32 HA VAL 5 HA VAL 5 -1.645 -2.958 -1.691 33 HB VAL 5 HB VAL 5 -3.715 -2.390 -0.286 34 HG11 VAL 5 1HG1 VAL 5 -3.445 -5.277 -1.184 35 HG12 VAL 5 2HG1 VAL 5 -3.837 -3.902 -2.218 36 HG13 VAL 5 3HG1 VAL 5 -4.964 -4.400 -0.958 37 HG21 VAL 5 3HG2 VAL 5 -2.889 -4.835 1.327 38 HG22 VAL 5 1HG2 VAL 5 -4.446 -4.007 1.445 39 HG23 VAL 5 2HG2 VAL 5 -2.966 -3.179 1.927 40 H ILE 6 H ILE 6 -0.537 -1.136 -1.681 41 HA ILE 6 HA ILE 6 0.562 -0.055 0.836 42 HB ILE 6 HB ILE 6 1.426 0.704 -2.005 43 HG12 ILE 6 2HG1 ILE 6 3.577 -0.696 -1.321 44 HG13 ILE 6 3HG1 ILE 6 2.483 -1.528 -0.225 45 HG21 ILE 6 1HG2 ILE 6 3.433 1.632 -0.884 46 HG22 ILE 6 2HG2 ILE 6 2.771 1.180 0.688 47 HG23 ILE 6 3HG2 ILE 6 1.952 2.392 -0.300 48 HD11 ILE 6 3HD1 ILE 6 1.119 -2.233 -2.128 49 HD12 ILE 6 1HD1 ILE 6 2.798 -2.739 -2.310 50 HD13 ILE 6 2HD1 ILE 6 2.190 -1.361 -3.228 51 H VAL 7 H VAL 7 -0.800 1.434 1.649 52 HA VAL 7 HA VAL 7 -2.396 3.200 -0.030 53 HB VAL 7 HB VAL 7 -2.090 3.206 3.017 54 HG11 VAL 7 1HG1 VAL 7 -2.958 5.344 2.153 55 HG12 VAL 7 2HG1 VAL 7 -4.218 4.476 3.029 56 HG13 VAL 7 3HG1 VAL 7 -4.229 4.496 1.264 57 HG21 VAL 7 3HG2 VAL 7 -4.202 1.944 3.096 58 HG22 VAL 7 1HG2 VAL 7 -2.949 1.042 2.244 59 HG23 VAL 7 2HG2 VAL 7 -4.226 1.851 1.333 60 H VAL 8 H VAL 8 -1.465 4.956 -0.853 61 HA VAL 8 HA VAL 8 0.583 6.431 0.693 62 HB VAL 8 HB VAL 8 0.438 6.271 -2.358 63 HG11 VAL 8 1HG1 VAL 8 1.343 8.418 -1.574 64 HG12 VAL 8 2HG1 VAL 8 2.605 7.455 -2.337 65 HG13 VAL 8 3HG1 VAL 8 2.533 7.574 -0.578 66 HG21 VAL 8 3HG2 VAL 8 1.203 4.115 -1.442 67 HG22 VAL 8 1HG2 VAL 8 2.456 4.941 -0.508 68 HG23 VAL 8 2HG2 VAL 8 2.519 4.946 -2.273 69 H SER 9 H SER 9 0.406 8.655 0.751 70 HA SER 9 HA SER 9 -1.208 10.171 -1.075 71 HB2 SER 9 2HB SER 9 -2.679 11.241 0.683 72 HB3 SER 9 3HB SER 9 -3.078 9.551 0.375 73 HG SER 9 HG SER 9 -1.404 9.350 2.271 74 H ASN 10 H ASN 10 -0.658 12.373 -0.991 75 HA ASN 10 HA ASN 10 1.980 12.874 -0.016 76 HB2 ASN 10 2HB ASN 10 0.007 14.814 -1.280 77 HB3 ASN 10 3HB ASN 10 1.724 15.114 -1.039 78 HD21 ASN 10 1HD2 ASN 10 -0.636 13.413 -2.930 79 HD22 ASN 10 2HD2 ASN 10 0.447 12.875 -4.158 80 H ASP 11 H ASP 11 -1.031 13.199 1.497 81 HA ASP 11 HA ASP 11 0.136 14.920 3.604 82 HB2 ASP 11 2HB ASP 11 -1.973 15.795 2.644 83 HB3 ASP 11 3HB ASP 11 -2.789 14.294 3.057 84 H GLU 12 H GLU 12 0.100 14.212 5.719 85 HA GLU 12 HA GLU 12 0.373 11.357 6.055 86 HB2 GLU 12 2HB GLU 12 1.925 13.018 7.092 87 HB3 GLU 12 3HB GLU 12 0.609 13.599 8.111 88 HG2 GLU 12 2HG GLU 12 0.435 11.251 9.048 89 HG3 GLU 12 3HG GLU 12 1.910 10.862 8.158 90 H ARG 13 H ARG 13 -1.996 13.822 6.893 91 HA ARG 13 HA ARG 13 -3.340 12.285 8.915 92 HB2 ARG 13 2HB ARG 13 -4.339 14.725 7.402 93 HB3 ARG 13 3HB ARG 13 -5.101 14.009 8.823 94 HG2 ARG 13 2HG ARG 13 -3.048 14.536 10.147 95 HG3 ARG 13 3HG ARG 13 -2.368 15.336 8.726 96 HD2 ARG 13 2HD ARG 13 -4.930 16.134 10.153 97 HD3 ARG 13 3HD ARG 13 -3.376 16.954 10.296 98 HE ARG 13 HE ARG 13 -3.630 17.315 7.773 99 HH11 ARG 13 1HH1 ARG 13 -6.417 17.253 9.947 100 HH12 ARG 13 2HH1 ARG 13 -7.361 18.303 8.935 101 HH21 ARG 13 1HH2 ARG 13 -4.877 18.709 6.508 102 HH22 ARG 13 2HH2 ARG 13 -6.494 19.122 6.996 103 H ILE 14 H ILE 14 -3.695 12.608 5.424 104 HA ILE 14 HA ILE 14 -6.156 11.241 5.109 105 HB ILE 14 HB ILE 14 -3.770 11.250 3.192 106 HG12 ILE 14 2HG1 ILE 14 -6.184 13.125 3.346 107 HG13 ILE 14 3HG1 ILE 14 -4.512 13.556 3.691 108 HG21 ILE 14 1HG2 ILE 14 -5.405 10.709 1.422 109 HG22 ILE 14 2HG2 ILE 14 -6.698 10.632 2.620 110 HG23 ILE 14 3HG2 ILE 14 -5.385 9.452 2.661 111 HD11 ILE 14 3HD1 ILE 14 -5.194 14.390 1.532 112 HD12 ILE 14 1HD1 ILE 14 -5.628 12.766 1.003 113 HD13 ILE 14 2HD1 ILE 14 -3.940 13.165 1.335 114 H LEU 15 H LEU 15 -2.778 10.069 5.245 115 HA LEU 15 HA LEU 15 -3.202 7.301 5.044 116 HB2 LEU 15 2HB LEU 15 -1.089 8.836 6.601 117 HB3 LEU 15 3HB LEU 15 -1.050 7.090 6.387 118 HG LEU 15 HG LEU 15 -0.909 9.115 4.125 119 HD11 LEU 15 1HD1 LEU 15 1.084 9.173 5.555 120 HD12 LEU 15 2HD1 LEU 15 1.450 8.491 3.976 121 HD13 LEU 15 3HD1 LEU 15 1.282 7.427 5.372 122 HD21 LEU 15 3HD2 LEU 15 -1.939 7.011 3.386 123 HD22 LEU 15 1HD2 LEU 15 -0.620 6.076 4.102 124 HD23 LEU 15 2HD2 LEU 15 -0.310 7.144 2.728 125 H GLU 16 H GLU 16 -3.129 9.395 7.918 126 HA GLU 16 HA GLU 16 -3.329 7.347 9.859 127 HB2 GLU 16 2HB GLU 16 -2.410 9.623 10.285 128 HB3 GLU 16 3HB GLU 16 -4.027 10.307 10.119 129 HG2 GLU 16 2HG GLU 16 -4.774 9.073 12.101 130 HG3 GLU 16 3HG GLU 16 -3.203 8.282 12.227 131 H GLU 17 H GLU 17 -5.726 9.510 8.385 132 HA GLU 17 HA GLU 17 -8.048 8.746 9.749 133 HB2 GLU 17 2HB GLU 17 -7.819 10.685 8.138 134 HB3 GLU 17 3HB GLU 17 -7.824 9.539 6.804 135 HG2 GLU 17 2HG GLU 17 -10.020 10.497 6.978 136 HG3 GLU 17 3HG GLU 17 -10.114 8.813 7.489 137 H LEU 18 H LEU 18 -6.644 7.513 6.734 138 HA LEU 18 HA LEU 18 -8.605 5.493 6.271 139 HB2 LEU 18 2HB LEU 18 -5.978 6.272 5.022 140 HB3 LEU 18 3HB LEU 18 -6.626 4.688 4.643 141 HG LEU 18 HG LEU 18 -8.597 5.639 3.591 142 HD11 LEU 18 1HD1 LEU 18 -7.678 8.403 4.441 143 HD12 LEU 18 2HD1 LEU 18 -9.061 7.525 5.094 144 HD13 LEU 18 3HD1 LEU 18 -9.063 8.032 3.409 145 HD21 LEU 18 3HD2 LEU 18 -7.595 6.912 1.730 146 HD22 LEU 18 1HD2 LEU 18 -6.596 5.533 2.183 147 HD23 LEU 18 2HD2 LEU 18 -6.129 7.160 2.681 148 H LEU 19 H LEU 19 -5.586 5.578 8.067 149 HA LEU 19 HA LEU 19 -5.120 2.780 8.269 150 HB2 LEU 19 2HB LEU 19 -3.299 4.264 8.833 151 HB3 LEU 19 3HB LEU 19 -4.251 5.078 10.066 152 HG LEU 19 HG LEU 19 -4.222 2.966 11.446 153 HD11 LEU 19 1HD1 LEU 19 -3.946 1.294 9.683 154 HD12 LEU 19 2HD1 LEU 19 -2.696 1.126 10.910 155 HD13 LEU 19 3HD1 LEU 19 -2.310 1.875 9.356 156 HD21 LEU 19 3HD2 LEU 19 -2.575 4.718 11.887 157 HD22 LEU 19 1HD2 LEU 19 -1.464 3.998 10.716 158 HD23 LEU 19 2HD2 LEU 19 -1.897 3.122 12.187 159 H GLU 20 H GLU 20 -6.889 5.084 10.265 160 HA GLU 20 HA GLU 20 -7.551 3.337 12.391 161 HB2 GLU 20 2HB GLU 20 -8.939 5.856 11.407 162 HB3 GLU 20 3HB GLU 20 -9.219 5.099 12.976 163 HG2 GLU 20 2HG GLU 20 -6.962 5.584 13.695 164 HG3 GLU 20 3HG GLU 20 -6.503 6.116 12.072 165 H VAL 21 H VAL 21 -9.060 3.971 9.269 166 HA VAL 21 HA VAL 21 -11.518 2.553 9.699 167 HB VAL 21 HB VAL 21 -10.091 3.141 7.053 168 HG11 VAL 21 1HG1 VAL 21 -12.327 2.934 5.999 169 HG12 VAL 21 2HG1 VAL 21 -13.015 2.449 7.552 170 HG13 VAL 21 3HG1 VAL 21 -11.818 1.426 6.759 171 HG21 VAL 21 3HG2 VAL 21 -10.483 5.219 8.287 172 HG22 VAL 21 1HG2 VAL 21 -12.189 4.810 8.493 173 HG23 VAL 21 2HG2 VAL 21 -11.542 5.136 6.883 174 H VAL 22 H VAL 22 -8.461 1.690 8.026 175 HA VAL 22 HA VAL 22 -9.142 -0.967 7.340 176 HB VAL 22 HB VAL 22 -6.380 0.312 7.642 177 HG11 VAL 22 1HG1 VAL 22 -6.218 -2.153 7.576 178 HG12 VAL 22 2HG1 VAL 22 -5.544 -1.424 6.121 179 HG13 VAL 22 3HG1 VAL 22 -7.139 -2.179 6.073 180 HG21 VAL 22 3HG2 VAL 22 -8.099 0.012 5.149 181 HG22 VAL 22 1HG2 VAL 22 -6.491 0.739 5.227 182 HG23 VAL 22 2HG2 VAL 22 -7.850 1.509 6.044 183 H LEU 23 H LEU 23 -7.323 0.326 10.122 184 HA LEU 23 HA LEU 23 -6.366 -2.092 11.193 185 HB2 LEU 23 2HB LEU 23 -5.847 0.520 11.692 186 HB3 LEU 23 3HB LEU 23 -6.928 0.240 13.039 187 HG LEU 23 HG LEU 23 -4.334 -1.293 12.527 188 HD11 LEU 23 1HD1 LEU 23 -3.854 1.035 13.088 189 HD12 LEU 23 2HD1 LEU 23 -3.403 -0.018 14.425 190 HD13 LEU 23 3HD1 LEU 23 -4.887 0.933 14.520 191 HD21 LEU 23 3HD2 LEU 23 -5.916 -2.668 13.777 192 HD22 LEU 23 1HD2 LEU 23 -6.178 -1.362 14.937 193 HD23 LEU 23 2HD2 LEU 23 -4.602 -2.148 14.826 194 H LYS 24 H LYS 24 -9.375 -0.277 11.828 195 HA LYS 24 HA LYS 24 -10.331 -2.186 13.817 196 HB2 LYS 24 2HB LYS 24 -12.202 -0.742 14.126 197 HB3 LYS 24 3HB LYS 24 -10.802 0.297 13.917 198 HG2 LYS 24 2HG LYS 24 -11.481 0.706 11.555 199 HG3 LYS 24 3HG LYS 24 -12.913 -0.295 11.817 200 HD2 LYS 24 2HD LYS 24 -13.619 1.298 13.639 201 HD3 LYS 24 3HD LYS 24 -12.243 2.324 13.216 202 HE2 LYS 24 2HE LYS 24 -13.159 2.692 10.978 203 HE3 LYS 24 3HE LYS 24 -14.487 1.573 11.308 204 HZ1 LYS 24 3HZ LYS 24 -15.131 3.899 11.555 205 HZ2 LYS 24 1HZ LYS 24 -13.988 4.101 12.784 206 HZ3 LYS 24 2HZ LYS 24 -15.301 3.054 13.008 207 H SER 25 H SER 25 -10.594 -1.812 10.377 208 HA SER 25 HA SER 25 -13.021 -3.184 9.860 209 HB2 SER 25 2HB SER 25 -11.903 -1.867 8.117 210 HB3 SER 25 3HB SER 25 -10.502 -2.932 8.163 211 HG SER 25 HG SER 25 -11.554 -3.864 6.581 212 H ASP 26 H ASP 26 -9.675 -4.252 10.261 213 HA ASP 26 HA ASP 26 -10.538 -6.786 11.324 214 HB2 ASP 26 2HB ASP 26 -10.439 -7.271 8.860 215 HB3 ASP 26 3HB ASP 26 -8.747 -6.786 8.846 216 HA PRO 27 HA PRO 27 -7.056 -5.365 13.718 217 HB2 PRO 27 2HB PRO 27 -7.082 -7.175 15.723 218 HB3 PRO 27 3HB PRO 27 -8.456 -6.076 15.471 219 HG2 PRO 27 2HG PRO 27 -8.171 -8.945 14.602 220 HG3 PRO 27 3HG PRO 27 -9.534 -8.157 15.434 221 HD2 PRO 27 2HD PRO 27 -9.482 -8.553 12.724 222 HD3 PRO 27 3HD PRO 27 -10.345 -7.198 13.484 223 H ASN 28 H ASN 28 -6.963 -8.444 12.089 224 HA ASN 28 HA ASN 28 -4.227 -8.985 13.086 225 HB2 ASN 28 2HB ASN 28 -4.561 -11.331 12.602 226 HB3 ASN 28 3HB ASN 28 -5.889 -10.745 13.591 227 HD21 ASN 28 1HD2 ASN 28 -7.965 -10.612 12.672 228 HD22 ASN 28 2HD2 ASN 28 -8.363 -11.404 11.192 229 H VAL 29 H VAL 29 -5.937 -8.104 10.190 230 HA VAL 29 HA VAL 29 -3.980 -8.760 8.250 231 HB VAL 29 HB VAL 29 -5.949 -6.418 8.380 232 HG11 VAL 29 1HG1 VAL 29 -5.416 -5.931 5.995 233 HG12 VAL 29 2HG1 VAL 29 -4.097 -7.104 6.055 234 HG13 VAL 29 3HG1 VAL 29 -4.029 -5.646 7.046 235 HG21 VAL 29 3HG2 VAL 29 -6.932 -8.657 8.042 236 HG22 VAL 29 1HG2 VAL 29 -5.889 -8.919 6.643 237 HG23 VAL 29 2HG2 VAL 29 -7.134 -7.667 6.599 238 H LYS 30 H LYS 30 -2.012 -7.885 7.791 239 HA LYS 30 HA LYS 30 -0.670 -6.662 10.007 240 HB2 LYS 30 2HB LYS 30 0.081 -8.413 7.946 241 HB3 LYS 30 3HB LYS 30 0.887 -6.932 7.470 242 HG2 LYS 30 2HG LYS 30 1.229 -8.406 10.099 243 HG3 LYS 30 3HG LYS 30 2.387 -8.350 8.770 244 HD2 LYS 30 2HD LYS 30 2.665 -5.915 9.127 245 HD3 LYS 30 3HD LYS 30 1.490 -5.977 10.442 246 HE2 LYS 30 2HE LYS 30 3.010 -7.517 11.685 247 HE3 LYS 30 3HE LYS 30 4.204 -7.342 10.390 248 HZ1 LYS 30 3HZ LYS 30 4.264 -4.955 10.841 249 HZ2 LYS 30 1HZ LYS 30 4.673 -5.844 12.218 250 HZ3 LYS 30 2HZ LYS 30 3.143 -5.147 12.091 251 H THR 31 H THR 31 -1.747 -4.615 10.091 252 HA THR 31 HA THR 31 -1.411 -2.673 7.942 253 HB THR 31 HB THR 31 -2.618 -1.133 9.585 254 HG1 THR 31 HG1 THR 31 -3.294 -3.412 11.108 255 HG21 THR 31 3HG2 THR 31 -4.026 -3.770 8.964 256 HG22 THR 31 1HG2 THR 31 -3.881 -2.399 7.859 257 HG23 THR 31 2HG2 THR 31 -4.817 -2.238 9.344 258 H VAL 32 H VAL 32 0.338 -1.449 7.799 259 HA VAL 32 HA VAL 32 2.164 -1.064 10.099 260 HB VAL 32 HB VAL 32 2.960 -1.689 7.194 261 HG11 VAL 32 1HG1 VAL 32 4.712 -1.209 9.632 262 HG12 VAL 32 2HG1 VAL 32 4.544 -0.140 8.239 263 HG13 VAL 32 3HG1 VAL 32 5.285 -1.728 8.046 264 HG21 VAL 32 3HG2 VAL 32 2.156 -3.714 8.339 265 HG22 VAL 32 1HG2 VAL 32 3.266 -3.423 9.682 266 HG23 VAL 32 2HG2 VAL 32 3.898 -3.803 8.076 267 H ARG 33 H ARG 33 2.329 1.085 10.474 268 HA ARG 33 HA ARG 33 2.629 2.935 8.169 269 HB2 ARG 33 2HB ARG 33 0.571 3.472 9.414 270 HB3 ARG 33 3HB ARG 33 1.465 3.510 10.932 271 HG2 ARG 33 2HG ARG 33 2.770 5.460 10.082 272 HG3 ARG 33 3HG ARG 33 1.797 5.448 8.610 273 HD2 ARG 33 2HD ARG 33 -0.184 6.066 9.808 274 HD3 ARG 33 3HD ARG 33 0.576 5.743 11.373 275 HE ARG 33 HE ARG 33 1.956 7.781 9.899 276 HH11 ARG 33 1HH1 ARG 33 -0.865 7.260 11.946 277 HH12 ARG 33 2HH1 ARG 33 -0.920 8.911 12.483 278 HH21 ARG 33 1HH2 ARG 33 1.915 9.903 10.717 279 HH22 ARG 33 2HH2 ARG 33 0.646 10.394 11.793 280 H THR 34 H THR 34 4.813 2.811 8.016 281 HA THR 34 HA THR 34 6.443 3.735 10.289 282 HB THR 34 HB THR 34 6.652 1.252 10.266 283 HG1 THR 34 HG1 THR 34 8.749 3.011 9.941 284 HG21 THR 34 3HG2 THR 34 7.801 0.076 8.448 285 HG22 THR 34 1HG2 THR 34 7.871 1.565 7.497 286 HG23 THR 34 2HG2 THR 34 6.315 0.812 7.849 287 H ASP 35 H ASP 35 5.981 3.365 6.836 288 HA ASP 35 HA ASP 35 6.777 4.379 4.988 289 HB2 ASP 35 2HB ASP 35 7.715 6.539 6.932 290 HB3 ASP 35 3HB ASP 35 7.654 6.713 5.183 291 H ASP 36 H ASP 36 8.705 2.792 6.961 292 HA ASP 36 HA ASP 36 11.346 3.692 6.122 293 HB2 ASP 36 2HB ASP 36 10.830 2.871 8.487 294 HB3 ASP 36 3HB ASP 36 10.638 1.249 7.826 295 H LYS 37 H LYS 37 12.695 2.543 4.739 296 HA LYS 37 HA LYS 37 11.209 1.393 2.588 297 HB2 LYS 37 2HB LYS 37 13.043 3.100 2.364 298 HB3 LYS 37 3HB LYS 37 14.206 1.835 2.750 299 HG2 LYS 37 2HG LYS 37 13.559 0.590 0.750 300 HG3 LYS 37 3HG LYS 37 12.307 1.781 0.385 301 HD2 LYS 37 2HD LYS 37 15.307 2.255 0.391 302 HD3 LYS 37 3HD LYS 37 14.257 2.156 -1.021 303 HE2 LYS 37 2HE LYS 37 13.074 4.210 -0.247 304 HE3 LYS 37 3HE LYS 37 14.212 4.328 1.099 305 HZ1 LYS 37 3HZ LYS 37 14.820 5.741 -0.791 306 HZ2 LYS 37 1HZ LYS 37 14.959 4.374 -1.771 307 HZ3 LYS 37 2HZ LYS 37 16.013 4.586 -0.469 308 H GLU 38 H GLU 38 14.054 0.205 4.375 309 HA GLU 38 HA GLU 38 14.026 -2.373 3.148 310 HB2 GLU 38 2HB GLU 38 15.774 -2.963 4.765 311 HB3 GLU 38 3HB GLU 38 16.092 -1.375 4.078 312 HG2 GLU 38 2HG GLU 38 15.218 -0.308 6.128 313 HG3 GLU 38 3HG GLU 38 14.893 -1.897 6.816 314 H LYS 39 H LYS 39 12.515 -1.000 6.006 315 HA LYS 39 HA LYS 39 12.114 -3.355 7.496 316 HB2 LYS 39 2HB LYS 39 12.057 -1.032 8.405 317 HB3 LYS 39 3HB LYS 39 10.487 -0.793 7.639 318 HG2 LYS 39 2HG LYS 39 9.529 -2.586 9.018 319 HG3 LYS 39 3HG LYS 39 11.110 -2.883 9.746 320 HD2 LYS 39 2HD LYS 39 11.091 -0.610 10.723 321 HD3 LYS 39 3HD LYS 39 9.514 -0.304 9.983 322 HE2 LYS 39 2HE LYS 39 9.297 -0.915 12.363 323 HE3 LYS 39 3HE LYS 39 8.514 -2.107 11.323 324 HZ1 LYS 39 3HZ LYS 39 10.467 -3.522 11.554 325 HZ2 LYS 39 1HZ LYS 39 9.800 -3.165 13.069 326 HZ3 LYS 39 2HZ LYS 39 11.207 -2.381 12.553 327 H VAL 40 H VAL 40 10.064 -1.711 5.126 328 HA VAL 40 HA VAL 40 7.681 -3.138 5.415 329 HB VAL 40 HB VAL 40 8.914 -1.943 2.888 330 HG11 VAL 40 1HG1 VAL 40 6.603 -2.036 1.906 331 HG12 VAL 40 2HG1 VAL 40 6.092 -3.030 3.269 332 HG13 VAL 40 3HG1 VAL 40 7.316 -3.627 2.151 333 HG21 VAL 40 3HG2 VAL 40 6.723 -0.872 4.711 334 HG22 VAL 40 1HG2 VAL 40 7.358 -0.078 3.269 335 HG23 VAL 40 2HG2 VAL 40 8.394 -0.313 4.675 336 H LYS 41 H LYS 41 10.507 -3.865 3.363 337 HA LYS 41 HA LYS 41 9.561 -6.149 2.035 338 HB2 LYS 41 2HB LYS 41 12.422 -5.454 2.819 339 HB3 LYS 41 3HB LYS 41 11.972 -6.679 1.632 340 HG2 LYS 41 2HG LYS 41 10.931 -4.903 0.234 341 HG3 LYS 41 3HG LYS 41 11.474 -3.693 1.403 342 HD2 LYS 41 2HD LYS 41 13.817 -4.238 0.943 343 HD3 LYS 41 3HD LYS 41 13.334 -5.571 -0.111 344 HE2 LYS 41 2HE LYS 41 12.274 -3.947 -1.655 345 HE3 LYS 41 3HE LYS 41 12.795 -2.625 -0.611 346 HZ1 LYS 41 3HZ LYS 41 15.073 -3.147 -1.092 347 HZ2 LYS 41 1HZ LYS 41 14.239 -2.969 -2.543 348 HZ3 LYS 41 2HZ LYS 41 14.640 -4.511 -1.983 349 H GLU 42 H GLU 42 11.145 -5.806 5.166 350 HA GLU 42 HA GLU 42 11.541 -8.569 5.753 351 HB2 GLU 42 2HB GLU 42 11.109 -6.342 7.798 352 HB3 GLU 42 3HB GLU 42 11.973 -7.862 8.029 353 HG2 GLU 42 2HG GLU 42 13.667 -7.061 6.341 354 HG3 GLU 42 3HG GLU 42 12.839 -5.506 6.338 355 H GLU 43 H GLU 43 8.924 -6.268 6.414 356 HA GLU 43 HA GLU 43 7.431 -8.052 8.108 357 HB2 GLU 43 2HB GLU 43 6.676 -5.353 6.930 358 HB3 GLU 43 3HB GLU 43 5.745 -6.222 8.149 359 HG2 GLU 43 2HG GLU 43 7.715 -6.106 9.687 360 HG3 GLU 43 3HG GLU 43 8.563 -5.147 8.478 361 H ILE 44 H ILE 44 7.324 -7.242 4.680 362 HA ILE 44 HA ILE 44 4.817 -8.358 4.007 363 HB ILE 44 HB ILE 44 7.370 -8.244 2.312 364 HG12 ILE 44 2HG1 ILE 44 4.888 -6.447 2.213 365 HG13 ILE 44 3HG1 ILE 44 6.441 -5.984 2.903 366 HG21 ILE 44 1HG2 ILE 44 5.920 -8.668 0.347 367 HG22 ILE 44 2HG2 ILE 44 4.531 -8.880 1.414 368 HG23 ILE 44 3HG2 ILE 44 5.876 -10.019 1.480 369 HD11 ILE 44 3HD1 ILE 44 6.125 -5.065 0.663 370 HD12 ILE 44 1HD1 ILE 44 5.959 -6.697 0.005 371 HD13 ILE 44 2HD1 ILE 44 7.491 -6.178 0.712 372 H GLU 45 H GLU 45 8.091 -9.757 4.102 373 HA GLU 45 HA GLU 45 7.605 -12.415 3.497 374 HB2 GLU 45 2HB GLU 45 9.829 -11.472 3.637 375 HB3 GLU 45 3HB GLU 45 9.658 -11.142 5.350 376 HG2 GLU 45 2HG GLU 45 9.453 -13.997 4.460 377 HG3 GLU 45 3HG GLU 45 11.036 -13.249 4.378 378 H LYS 46 H LYS 46 7.410 -10.817 6.653 379 HA LYS 46 HA LYS 46 6.809 -13.083 8.235 380 HB2 LYS 46 2HB LYS 46 6.004 -10.186 8.724 381 HB3 LYS 46 3HB LYS 46 6.078 -11.462 9.939 382 HG2 LYS 46 2HG LYS 46 8.528 -11.633 9.591 383 HG3 LYS 46 3HG LYS 46 8.434 -10.339 8.398 384 HD2 LYS 46 2HD LYS 46 7.506 -8.839 10.217 385 HD3 LYS 46 3HD LYS 46 7.849 -10.128 11.376 386 HE2 LYS 46 2HE LYS 46 9.873 -8.670 9.645 387 HE3 LYS 46 3HE LYS 46 9.646 -8.471 11.379 388 HZ1 LYS 46 3HZ LYS 46 10.319 -10.785 11.674 389 HZ2 LYS 46 1HZ LYS 46 11.526 -9.865 10.923 390 HZ3 LYS 46 2HZ LYS 46 10.582 -10.926 10.008 391 H ALA 47 H ALA 47 4.759 -10.768 6.527 392 HA ALA 47 HA ALA 47 2.230 -11.778 7.355 393 HB1 ALA 47 3HB ALA 47 2.509 -9.496 6.500 394 HB2 ALA 47 1HB ALA 47 1.312 -10.375 5.547 395 HB3 ALA 47 2HB ALA 47 2.941 -10.122 4.907 396 H ARG 48 H ARG 48 4.479 -12.737 4.823 397 HA ARG 48 HA ARG 48 2.600 -14.320 3.309 398 HB2 ARG 48 2HB ARG 48 5.637 -14.395 3.277 399 HB3 ARG 48 3HB ARG 48 4.583 -15.181 2.111 400 HG2 ARG 48 2HG ARG 48 5.016 -12.215 2.500 401 HG3 ARG 48 3HG ARG 48 5.450 -13.190 1.107 402 HD2 ARG 48 2HD ARG 48 3.558 -12.080 0.352 403 HD3 ARG 48 3HD ARG 48 2.867 -13.598 0.907 404 HE ARG 48 HE ARG 48 2.340 -12.297 3.033 405 HH11 ARG 48 1HH1 ARG 48 2.460 -10.717 -0.096 406 HH12 ARG 48 2HH1 ARG 48 1.337 -9.477 0.353 407 HH21 ARG 48 1HH2 ARG 48 0.798 -10.697 3.580 408 HH22 ARG 48 2HH2 ARG 48 0.404 -9.467 2.420 409 H LYS 49 H LYS 49 5.149 -15.069 5.713 410 HA LYS 49 HA LYS 49 4.567 -17.869 5.891 411 HB2 LYS 49 2HB LYS 49 6.026 -16.003 7.812 412 HB3 LYS 49 3HB LYS 49 5.897 -17.744 8.050 413 HG2 LYS 49 2HG LYS 49 7.006 -17.970 5.724 414 HG3 LYS 49 3HG LYS 49 7.413 -16.259 5.889 415 HD2 LYS 49 2HD LYS 49 8.660 -16.749 7.969 416 HD3 LYS 49 3HD LYS 49 8.199 -18.451 7.851 417 HE2 LYS 49 2HE LYS 49 10.491 -18.166 7.078 418 HE3 LYS 49 3HE LYS 49 9.473 -18.626 5.715 419 HZ1 LYS 49 3HZ LYS 49 9.402 -16.278 5.079 420 HZ2 LYS 49 1HZ LYS 49 10.975 -16.885 5.090 421 HZ3 LYS 49 2HZ LYS 49 10.440 -15.896 6.348 422 H GLN 50 H GLN 50 3.123 -15.027 7.224 423 HA GLN 50 HA GLN 50 1.506 -16.420 9.189 424 HB2 GLN 50 2HB GLN 50 2.253 -13.985 9.374 425 HB3 GLN 50 3HB GLN 50 1.116 -13.597 8.088 426 HG2 GLN 50 2HG GLN 50 0.176 -13.069 10.270 427 HG3 GLN 50 3HG GLN 50 -0.746 -14.355 9.501 428 HE21 GLN 50 1HE2 GLN 50 2.366 -14.825 11.141 429 HE22 GLN 50 2HE2 GLN 50 1.738 -15.774 12.436 430 H GLY 51 H GLY 51 1.271 -15.345 5.866 431 HA2 GLY 51 2HA GLY 51 0.043 -16.246 4.148 432 HA3 GLY 51 3HA GLY 51 -0.856 -17.208 5.304 433 H ARG 52 H ARG 52 -0.609 -13.658 5.421 434 HA ARG 52 HA ARG 52 -3.294 -13.331 4.284 435 HB2 ARG 52 2HB ARG 52 -4.118 -12.068 6.281 436 HB3 ARG 52 3HB ARG 52 -3.822 -13.768 6.615 437 HG2 ARG 52 2HG ARG 52 -1.677 -13.162 7.721 438 HG3 ARG 52 3HG ARG 52 -2.019 -11.456 7.415 439 HD2 ARG 52 2HD ARG 52 -4.004 -11.550 8.815 440 HD3 ARG 52 3HD ARG 52 -3.812 -13.293 9.036 441 HE ARG 52 HE ARG 52 -1.674 -11.497 9.967 442 HH11 ARG 52 1HH1 ARG 52 -4.337 -13.610 10.811 443 HH12 ARG 52 2HH1 ARG 52 -3.875 -13.743 12.475 444 HH21 ARG 52 1HH2 ARG 52 -1.060 -11.674 12.135 445 HH22 ARG 52 2HH2 ARG 52 -2.000 -12.635 13.234 446 HA PRO 53 HA PRO 53 -1.736 -9.708 2.460 447 HB2 PRO 53 2HB PRO 53 -3.774 -7.846 2.559 448 HB3 PRO 53 3HB PRO 53 -3.831 -9.295 1.546 449 HG2 PRO 53 2HG PRO 53 -5.061 -8.852 4.250 450 HG3 PRO 53 3HG PRO 53 -5.783 -9.566 2.785 451 HD2 PRO 53 2HD PRO 53 -4.843 -11.139 4.758 452 HD3 PRO 53 3HD PRO 53 -4.667 -11.598 3.051 453 H ILE 54 H ILE 54 -0.854 -7.602 2.672 454 HA ILE 54 HA ILE 54 -0.619 -6.572 5.439 455 HB ILE 54 HB ILE 54 1.403 -7.847 4.971 456 HG12 ILE 54 2HG1 ILE 54 2.054 -4.874 4.736 457 HG13 ILE 54 3HG1 ILE 54 1.587 -5.669 6.233 458 HG21 ILE 54 1HG2 ILE 54 1.831 -6.153 2.477 459 HG22 ILE 54 2HG2 ILE 54 1.394 -7.862 2.506 460 HG23 ILE 54 3HG2 ILE 54 2.966 -7.346 3.119 461 HD11 ILE 54 3HD1 ILE 54 3.603 -7.062 6.093 462 HD12 ILE 54 1HD1 ILE 54 3.957 -5.336 6.149 463 HD13 ILE 54 2HD1 ILE 54 4.069 -6.206 4.621 464 H VAL 55 H VAL 55 -1.016 -4.458 5.610 465 HA VAL 55 HA VAL 55 -1.307 -2.800 3.182 466 HB VAL 55 HB VAL 55 -2.417 -2.073 5.937 467 HG11 VAL 55 1HG1 VAL 55 -3.266 -1.255 3.124 468 HG12 VAL 55 2HG1 VAL 55 -2.331 -0.268 4.247 469 HG13 VAL 55 3HG1 VAL 55 -3.997 -0.696 4.634 470 HG21 VAL 55 3HG2 VAL 55 -3.876 -3.713 3.826 471 HG22 VAL 55 1HG2 VAL 55 -4.586 -3.066 5.308 472 HG23 VAL 55 2HG2 VAL 55 -3.327 -4.296 5.396 473 H ILE 56 H ILE 56 0.127 -1.147 2.881 474 HA ILE 56 HA ILE 56 1.989 -0.432 5.096 475 HB ILE 56 HB ILE 56 2.596 -0.560 2.092 476 HG12 ILE 56 2HG1 ILE 56 2.379 -2.828 3.145 477 HG13 ILE 56 3HG1 ILE 56 4.015 -2.499 2.584 478 HG21 ILE 56 1HG2 ILE 56 3.896 1.202 3.195 479 HG22 ILE 56 2HG2 ILE 56 4.948 -0.139 2.752 480 HG23 ILE 56 3HG2 ILE 56 4.446 0.070 4.431 481 HD11 ILE 56 3HD1 ILE 56 4.060 -3.632 4.721 482 HD12 ILE 56 1HD1 ILE 56 3.053 -2.381 5.446 483 HD13 ILE 56 2HD1 ILE 56 4.689 -1.998 4.906 484 H PHE 57 H PHE 57 1.759 1.634 5.700 485 HA PHE 57 HA PHE 57 0.449 3.617 3.975 486 HB2 PHE 57 2HB PHE 57 0.920 3.480 6.985 487 HB3 PHE 57 3HB PHE 57 0.331 4.940 6.188 488 HD1 PHE 57 HD2 PHE 57 -0.488 1.329 6.804 489 HD2 PHE 57 HD1 PHE 57 -1.966 5.159 5.585 490 HE1 PHE 57 HE2 PHE 57 -2.789 0.461 6.813 491 HE2 PHE 57 HE1 PHE 57 -4.259 4.275 5.613 492 HZ PHE 57 HZ PHE 57 -4.659 1.933 6.189 493 H ILE 58 H ILE 58 1.754 4.797 2.802 494 HA ILE 58 HA ILE 58 4.300 5.878 3.874 495 HB ILE 58 HB ILE 58 3.862 4.934 0.979 496 HG12 ILE 58 2HG1 ILE 58 5.437 3.612 3.250 497 HG13 ILE 58 3HG1 ILE 58 3.961 2.995 2.521 498 HG21 ILE 58 1HG2 ILE 58 5.465 6.790 1.184 499 HG22 ILE 58 2HG2 ILE 58 6.267 5.300 0.693 500 HG23 ILE 58 3HG2 ILE 58 6.401 5.864 2.362 501 HD11 ILE 58 3HD1 ILE 58 5.922 1.796 1.763 502 HD12 ILE 58 1HD1 ILE 58 6.612 3.289 1.128 503 HD13 ILE 58 2HD1 ILE 58 5.131 2.631 0.428 504 H ARG 59 H ARG 59 4.673 8.052 3.355 505 HA ARG 59 HA ARG 59 2.370 9.528 2.261 506 HB2 ARG 59 2HB ARG 59 3.473 10.055 4.521 507 HB3 ARG 59 3HB ARG 59 4.842 10.682 3.612 508 HG2 ARG 59 2HG ARG 59 3.364 12.345 2.545 509 HG3 ARG 59 3HG ARG 59 1.996 11.716 3.465 510 HD2 ARG 59 2HD ARG 59 3.039 12.423 5.558 511 HD3 ARG 59 3HD ARG 59 4.486 12.957 4.688 512 HE ARG 59 HE ARG 59 2.397 14.308 3.527 513 HH11 ARG 59 1HH1 ARG 59 3.743 14.184 6.790 514 HH12 ARG 59 2HH1 ARG 59 3.242 15.804 7.168 515 HH21 ARG 59 1HH2 ARG 59 1.730 16.384 4.035 516 HH22 ARG 59 2HH2 ARG 59 2.095 17.054 5.594 517 H GLY 60 H GLY 60 3.064 11.602 0.912 518 HA2 GLY 60 2HA GLY 60 3.865 10.643 -1.593 519 HA3 GLY 60 3HA GLY 60 3.668 12.331 -1.173 520 H ALA 61 H ALA 61 5.803 12.550 0.738 521 HA ALA 61 HA ALA 61 8.075 12.791 -1.047 522 HB1 ALA 61 3HB ALA 61 9.235 13.786 0.877 523 HB2 ALA 61 1HB ALA 61 7.902 13.301 1.937 524 HB3 ALA 61 2HB ALA 61 7.630 14.493 0.668 525 H TYR 62 H TYR 62 7.000 10.646 1.439 526 HA TYR 62 HA TYR 62 9.376 9.046 1.617 527 HB2 TYR 62 2HB TYR 62 6.537 8.581 2.618 528 HB3 TYR 62 3HB TYR 62 7.886 7.495 2.934 529 HD1 TYR 62 HD1 TYR 62 6.421 10.792 3.754 530 HD2 TYR 62 HD2 TYR 62 9.671 8.130 4.535 531 HE1 TYR 62 HE1 TYR 62 7.018 12.105 5.743 532 HE2 TYR 62 HE2 TYR 62 10.259 9.450 6.528 533 HH TYR 62 HH TYR 62 9.955 11.663 7.455 534 H GLU 63 H GLU 63 6.701 9.191 -0.573 535 HA GLU 63 HA GLU 63 6.025 6.597 -1.188 536 HB2 GLU 63 2HB GLU 63 4.722 8.466 -1.950 537 HB3 GLU 63 3HB GLU 63 6.023 9.061 -2.981 538 HG2 GLU 63 2HG GLU 63 5.734 6.918 -4.351 539 HG3 GLU 63 3HG GLU 63 4.294 6.596 -3.396 540 H GLU 64 H GLU 64 8.916 8.243 -2.210 541 HA GLU 64 HA GLU 64 9.910 6.750 -4.303 542 HB2 GLU 64 2HB GLU 64 11.069 8.677 -3.333 543 HB3 GLU 64 3HB GLU 64 11.334 7.808 -1.826 544 HG2 GLU 64 2HG GLU 64 13.394 7.932 -3.122 545 HG3 GLU 64 3HG GLU 64 12.856 6.260 -2.963 546 H VAL 65 H VAL 65 9.692 5.813 -0.917 547 HA VAL 65 HA VAL 65 11.227 3.517 -0.730 548 HB VAL 65 HB VAL 65 8.658 4.373 0.653 549 HG11 VAL 65 1HG1 VAL 65 8.596 1.964 0.782 550 HG12 VAL 65 2HG1 VAL 65 9.052 2.600 2.362 551 HG13 VAL 65 3HG1 VAL 65 10.280 1.906 1.300 552 HG21 VAL 65 3HG2 VAL 65 10.135 4.834 2.575 553 HG22 VAL 65 1HG2 VAL 65 10.668 5.714 1.141 554 HG23 VAL 65 2HG2 VAL 65 11.526 4.259 1.652 555 H VAL 66 H VAL 66 7.906 3.875 -1.983 556 HA VAL 66 HA VAL 66 7.163 1.188 -2.193 557 HB VAL 66 HB VAL 66 6.298 3.406 -4.098 558 HG11 VAL 66 1HG1 VAL 66 4.213 2.096 -4.389 559 HG12 VAL 66 2HG1 VAL 66 4.867 0.819 -3.360 560 HG13 VAL 66 3HG1 VAL 66 5.628 1.178 -4.911 561 HG21 VAL 66 3HG2 VAL 66 5.959 4.104 -1.762 562 HG22 VAL 66 1HG2 VAL 66 5.049 2.624 -1.439 563 HG23 VAL 66 2HG2 VAL 66 4.416 3.825 -2.567 564 H ARG 67 H ARG 67 9.218 3.117 -4.295 565 HA ARG 67 HA ARG 67 9.341 1.591 -6.644 566 HB2 ARG 67 2HB ARG 67 10.325 3.893 -6.254 567 HB3 ARG 67 3HB ARG 67 11.624 3.141 -5.344 568 HG2 ARG 67 2HG ARG 67 12.476 3.621 -7.518 569 HG3 ARG 67 3HG ARG 67 12.250 1.874 -7.429 570 HD2 ARG 67 2HD ARG 67 10.133 2.077 -8.692 571 HD3 ARG 67 3HD ARG 67 10.346 3.830 -8.785 572 HE ARG 67 HE ARG 67 11.859 1.766 -10.231 573 HH11 ARG 67 1HH1 ARG 67 11.417 5.199 -9.608 574 HH12 ARG 67 2HH1 ARG 67 12.348 5.676 -10.990 575 HH21 ARG 67 1HH2 ARG 67 13.110 2.421 -12.005 576 HH22 ARG 67 2HH2 ARG 67 13.304 4.111 -12.342 577 H ASP 68 H ASP 68 11.220 1.294 -3.635 578 HA ASP 68 HA ASP 68 12.840 -0.922 -4.460 579 HB2 ASP 68 2HB ASP 68 12.455 0.682 -1.998 580 HB3 ASP 68 3HB ASP 68 12.707 -1.012 -1.626 581 H ILE 69 H ILE 69 9.801 -0.603 -2.663 582 HA ILE 69 HA ILE 69 9.370 -3.262 -1.857 583 HB ILE 69 HB ILE 69 7.268 -1.168 -2.587 584 HG12 ILE 69 2HG1 ILE 69 8.505 -1.759 0.148 585 HG13 ILE 69 3HG1 ILE 69 8.902 -0.367 -0.859 586 HG21 ILE 69 1HG2 ILE 69 6.966 -3.624 -0.807 587 HG22 ILE 69 2HG2 ILE 69 6.275 -3.428 -2.419 588 HG23 ILE 69 3HG2 ILE 69 5.728 -2.398 -1.098 589 HD11 ILE 69 3HD1 ILE 69 7.370 0.263 0.887 590 HD12 ILE 69 1HD1 ILE 69 6.219 -0.968 0.372 591 HD13 ILE 69 2HD1 ILE 69 6.577 0.402 -0.681 592 H VAL 70 H VAL 70 8.649 -1.620 -4.898 593 HA VAL 70 HA VAL 70 6.982 -3.426 -6.208 594 HB VAL 70 HB VAL 70 9.077 -1.471 -7.264 595 HG11 VAL 70 1HG1 VAL 70 8.108 -1.740 -9.541 596 HG12 VAL 70 2HG1 VAL 70 7.148 -3.106 -8.962 597 HG13 VAL 70 3HG1 VAL 70 8.908 -3.205 -8.978 598 HG21 VAL 70 3HG2 VAL 70 7.090 -0.487 -6.191 599 HG22 VAL 70 1HG2 VAL 70 6.032 -1.389 -7.280 600 HG23 VAL 70 2HG2 VAL 70 7.100 -0.134 -7.915 601 H GLU 71 H GLU 71 10.546 -3.220 -6.341 602 HA GLU 71 HA GLU 71 10.970 -5.366 -8.114 603 HB2 GLU 71 2HB GLU 71 12.859 -4.210 -6.021 604 HB3 GLU 71 3HB GLU 71 13.337 -5.269 -7.347 605 HG2 GLU 71 2HG GLU 71 12.650 -3.573 -8.981 606 HG3 GLU 71 3HG GLU 71 12.114 -2.517 -7.673 607 H TYR 72 H TYR 72 11.137 -5.209 -4.564 608 HA TYR 72 HA TYR 72 11.863 -7.848 -4.008 609 HB2 TYR 72 2HB TYR 72 11.958 -6.121 -2.286 610 HB3 TYR 72 3HB TYR 72 10.214 -5.881 -2.359 611 HD1 TYR 72 HD1 TYR 72 12.833 -8.397 -1.435 612 HD2 TYR 72 HD2 TYR 72 8.767 -7.185 -0.950 613 HE1 TYR 72 HE1 TYR 72 12.532 -10.100 0.301 614 HE2 TYR 72 HE2 TYR 72 8.471 -8.886 0.796 615 HH TYR 72 HH TYR 72 11.033 -10.516 2.251 616 H ALA 73 H ALA 73 8.576 -6.442 -4.101 617 HA ALA 73 HA ALA 73 7.254 -8.819 -3.262 618 HB1 ALA 73 3HB ALA 73 5.183 -7.551 -3.665 619 HB2 ALA 73 1HB ALA 73 6.102 -6.312 -4.523 620 HB3 ALA 73 2HB ALA 73 6.375 -6.577 -2.799 621 H GLN 74 H GLN 74 7.918 -7.425 -6.447 622 HA GLN 74 HA GLN 74 6.299 -9.273 -7.953 623 HB2 GLN 74 2HB GLN 74 8.596 -7.465 -8.798 624 HB3 GLN 74 3HB GLN 74 7.632 -8.408 -9.929 625 HG2 GLN 74 2HG GLN 74 6.470 -6.278 -8.106 626 HG3 GLN 74 3HG GLN 74 7.038 -5.962 -9.739 627 HE21 GLN 74 1HE2 GLN 74 5.016 -5.240 -10.395 628 HE22 GLN 74 2HE2 GLN 74 3.668 -6.301 -10.631 629 H LYS 75 H LYS 75 9.672 -9.237 -6.822 630 HA LYS 75 HA LYS 75 10.486 -11.661 -8.138 631 HB2 LYS 75 2HB LYS 75 11.616 -10.169 -5.734 632 HB3 LYS 75 3HB LYS 75 12.329 -11.668 -6.325 633 HG2 LYS 75 2HG LYS 75 12.058 -9.094 -7.904 634 HG3 LYS 75 3HG LYS 75 13.537 -9.701 -7.156 635 HD2 LYS 75 2HD LYS 75 13.485 -11.674 -8.636 636 HD3 LYS 75 3HD LYS 75 11.984 -11.100 -9.365 637 HE2 LYS 75 2HE LYS 75 13.173 -9.094 -10.205 638 HE3 LYS 75 3HE LYS 75 14.674 -9.697 -9.498 639 HZ1 LYS 75 3HZ LYS 75 14.482 -10.195 -11.870 640 HZ2 LYS 75 1HZ LYS 75 13.088 -11.106 -11.577 641 HZ3 LYS 75 2HZ LYS 75 14.575 -11.606 -10.943 642 H GLU 76 H GLU 76 8.817 -10.914 -5.169 643 HA GLU 76 HA GLU 76 8.848 -13.602 -4.107 644 HB2 GLU 76 2HB GLU 76 7.330 -11.075 -3.325 645 HB3 GLU 76 3HB GLU 76 7.171 -12.598 -2.453 646 HG2 GLU 76 2HG GLU 76 9.719 -10.991 -2.788 647 HG3 GLU 76 3HG GLU 76 8.730 -11.068 -1.333 648 H GLY 77 H GLY 77 7.115 -12.079 -6.580 649 HA2 GLY 77 2HA GLY 77 5.514 -12.874 -8.033 650 HA3 GLY 77 3HA GLY 77 5.570 -14.406 -7.169 651 H LEU 78 H LEU 78 4.794 -11.218 -5.901 652 HA LEU 78 HA LEU 78 2.291 -12.278 -4.764 653 HB2 LEU 78 2HB LEU 78 3.879 -9.781 -4.044 654 HB3 LEU 78 3HB LEU 78 2.467 -10.388 -3.185 655 HG LEU 78 HG LEU 78 5.152 -11.801 -3.389 656 HD11 LEU 78 1HD1 LEU 78 5.413 -11.275 -1.014 657 HD12 LEU 78 2HD1 LEU 78 3.894 -10.377 -1.030 658 HD13 LEU 78 3HD1 LEU 78 5.268 -9.805 -1.979 659 HD21 LEU 78 3HD2 LEU 78 2.668 -12.593 -1.835 660 HD22 LEU 78 1HD2 LEU 78 4.241 -13.392 -1.736 661 HD23 LEU 78 2HD2 LEU 78 3.330 -13.427 -3.242 662 H ARG 79 H ARG 79 0.435 -11.001 -4.742 663 HA ARG 79 HA ARG 79 -0.197 -9.385 -7.019 664 HB2 ARG 79 2HB ARG 79 -1.758 -10.896 -5.613 665 HB3 ARG 79 3HB ARG 79 -1.714 -9.665 -4.365 666 HG2 ARG 79 2HG ARG 79 -2.760 -9.200 -7.178 667 HG3 ARG 79 3HG ARG 79 -3.770 -9.658 -5.812 668 HD2 ARG 79 2HD ARG 79 -3.043 -7.551 -4.654 669 HD3 ARG 79 3HD ARG 79 -2.187 -7.085 -6.126 670 HE ARG 79 HE ARG 79 -5.092 -7.248 -5.735 671 HH11 ARG 79 1HH1 ARG 79 -2.439 -6.406 -7.864 672 HH12 ARG 79 2HH1 ARG 79 -3.453 -5.516 -8.946 673 HH21 ARG 79 1HH2 ARG 79 -6.392 -6.051 -7.162 674 HH22 ARG 79 2HH2 ARG 79 -5.673 -5.308 -8.561 675 H VAL 80 H VAL 80 0.754 -7.346 -7.181 676 HA VAL 80 HA VAL 80 1.309 -5.798 -4.713 677 HB VAL 80 HB VAL 80 2.540 -5.258 -7.474 678 HG11 VAL 80 1HG1 VAL 80 2.596 -3.365 -5.881 679 HG12 VAL 80 2HG1 VAL 80 4.220 -3.976 -6.197 680 HG13 VAL 80 3HG1 VAL 80 3.406 -4.382 -4.683 681 HG21 VAL 80 3HG2 VAL 80 4.581 -6.431 -6.702 682 HG22 VAL 80 1HG2 VAL 80 3.202 -7.528 -6.805 683 HG23 VAL 80 2HG2 VAL 80 3.740 -6.935 -5.233 684 H LEU 81 H LEU 81 0.018 -4.149 -4.365 685 HA LEU 81 HA LEU 81 -1.484 -2.826 -6.527 686 HB2 LEU 81 2HB LEU 81 -2.902 -4.634 -5.567 687 HB3 LEU 81 3HB LEU 81 -2.652 -3.979 -3.960 688 HG LEU 81 HG LEU 81 -3.903 -1.935 -4.587 689 HD11 LEU 81 1HD1 LEU 81 -4.336 -3.298 -7.241 690 HD12 LEU 81 2HD1 LEU 81 -3.369 -1.851 -6.947 691 HD13 LEU 81 3HD1 LEU 81 -5.112 -1.803 -6.705 692 HD21 LEU 81 3HD2 LEU 81 -5.431 -4.505 -5.149 693 HD22 LEU 81 1HD2 LEU 81 -6.162 -2.944 -4.753 694 HD23 LEU 81 2HD2 LEU 81 -5.162 -3.773 -3.566 695 H VAL 82 H VAL 82 -0.764 -0.773 -6.316 696 HA VAL 82 HA VAL 82 -0.404 0.394 -3.621 697 HB VAL 82 HB VAL 82 1.548 0.724 -4.981 698 HG11 VAL 82 1HG1 VAL 82 1.566 1.745 -7.193 699 HG12 VAL 82 2HG1 VAL 82 -0.185 1.936 -7.155 700 HG13 VAL 82 3HG1 VAL 82 0.527 0.322 -7.194 701 HG21 VAL 82 3HG2 VAL 82 0.006 3.358 -4.986 702 HG22 VAL 82 1HG2 VAL 82 1.761 3.183 -5.068 703 HG23 VAL 82 2HG2 VAL 82 0.894 2.697 -3.610 704 H ILE 83 H ILE 83 -2.142 1.319 -2.844 705 HA ILE 83 HA ILE 83 -4.217 2.529 -4.563 706 HB ILE 83 HB ILE 83 -4.345 1.789 -1.594 707 HG12 ILE 83 2HG1 ILE 83 -5.491 0.191 -3.938 708 HG13 ILE 83 3HG1 ILE 83 -3.966 -0.198 -3.151 709 HG21 ILE 83 1HG2 ILE 83 -6.580 2.486 -3.554 710 HG22 ILE 83 2HG2 ILE 83 -5.994 3.514 -2.246 711 HG23 ILE 83 3HG2 ILE 83 -6.807 1.995 -1.872 712 HD11 ILE 83 3HD1 ILE 83 -6.681 -0.208 -1.869 713 HD12 ILE 83 1HD1 ILE 83 -5.157 -0.560 -1.049 714 HD13 ILE 83 2HD1 ILE 83 -5.724 -1.609 -2.349 715 H LYS 84 H LYS 84 -3.809 4.739 -4.816 716 HA LYS 84 HA LYS 84 -3.106 6.269 -2.408 717 HB2 LYS 84 2HB LYS 84 -1.363 7.529 -3.612 718 HB3 LYS 84 3HB LYS 84 -0.981 5.828 -3.401 719 HG2 LYS 84 2HG LYS 84 -1.610 5.424 -5.778 720 HG3 LYS 84 3HG LYS 84 -1.888 7.163 -5.962 721 HD2 LYS 84 2HD LYS 84 0.536 7.474 -5.130 722 HD3 LYS 84 3HD LYS 84 0.729 5.738 -5.383 723 HE2 LYS 84 2HE LYS 84 0.241 5.996 -7.755 724 HE3 LYS 84 3HE LYS 84 -0.135 7.709 -7.511 725 HZ1 LYS 84 3HZ LYS 84 2.074 7.595 -8.349 726 HZ2 LYS 84 1HZ LYS 84 2.527 6.396 -7.242 727 HZ3 LYS 84 2HZ LYS 84 2.221 7.966 -6.701 728 H VAL 85 H VAL 85 -3.860 8.268 -2.229 729 HA VAL 85 HA VAL 85 -5.947 9.105 -4.092 730 HB VAL 85 HB VAL 85 -5.100 10.223 -1.360 731 HG11 VAL 85 1HG1 VAL 85 -7.540 10.986 -3.008 732 HG12 VAL 85 2HG1 VAL 85 -6.152 12.017 -2.665 733 HG13 VAL 85 3HG1 VAL 85 -7.215 11.511 -1.352 734 HG21 VAL 85 3HG2 VAL 85 -6.070 7.966 -1.218 735 HG22 VAL 85 1HG2 VAL 85 -7.498 8.507 -2.106 736 HG23 VAL 85 2HG2 VAL 85 -7.156 9.154 -0.498 737 H ALA 86 H ALA 86 -5.796 10.822 -5.461 738 HA ALA 86 HA ALA 86 -3.543 12.693 -5.399 739 HB1 ALA 86 3HB ALA 86 -2.632 10.720 -6.564 740 HB2 ALA 86 1HB ALA 86 -2.804 12.092 -7.662 741 HB3 ALA 86 2HB ALA 86 -3.974 10.769 -7.707 742 H GLN 87 H GLN 87 -4.460 14.604 -5.852 743 HA GLN 87 HA GLN 87 -6.727 14.807 -7.720 744 HB2 GLN 87 2HB GLN 87 -5.634 16.794 -5.700 745 HB3 GLN 87 3HB GLN 87 -6.972 17.124 -6.800 746 HG2 GLN 87 2HG GLN 87 -8.189 15.164 -5.724 747 HG3 GLN 87 3HG GLN 87 -6.898 15.139 -4.521 748 HE21 GLN 87 1HE2 GLN 87 -8.320 15.647 -2.827 749 HE22 GLN 87 2HE2 GLN 87 -9.039 17.206 -2.648 750 H ASP 88 H ASP 88 -3.630 16.433 -6.947 751 HA ASP 88 HA ASP 88 -2.906 16.674 -9.733 752 HB2 ASP 88 2HB ASP 88 -4.453 18.614 -9.496 753 HB3 ASP 88 3HB ASP 88 -3.482 19.230 -8.162 754 H GLN 89 H GLN 89 -1.067 15.587 -9.189 755 HA GLN 89 HA GLN 89 1.089 17.066 -7.883 756 HB2 GLN 89 2HB GLN 89 0.085 14.351 -6.923 757 HB3 GLN 89 3HB GLN 89 1.733 14.872 -6.627 758 HG2 GLN 89 2HG GLN 89 -0.704 16.385 -5.658 759 HG3 GLN 89 3HG GLN 89 0.143 15.170 -4.706 760 HE21 GLN 89 1HE2 GLN 89 0.328 18.403 -6.033 761 HE22 GLN 89 2HE2 GLN 89 1.677 18.918 -5.085 762 H GLU 90 H GLU 90 2.376 17.129 -9.676 763 HA GLU 90 HA GLU 90 2.387 15.185 -11.742 764 HB2 GLU 90 2HB GLU 90 2.924 17.559 -12.146 765 HB3 GLU 90 3HB GLU 90 4.400 17.412 -11.196 766 HG2 GLU 90 2HG GLU 90 5.345 15.869 -12.841 767 HG3 GLU 90 3HG GLU 90 3.834 15.861 -13.747 768 H LEU 91 H LEU 91 4.383 15.627 -8.915 769 HA LEU 91 HA LEU 91 6.546 13.910 -9.592 770 HB2 LEU 91 2HB LEU 91 5.518 14.635 -6.817 771 HB3 LEU 91 3HB LEU 91 7.058 13.875 -7.163 772 HG LEU 91 HG LEU 91 7.549 16.144 -6.678 773 HD11 LEU 91 1HD1 LEU 91 8.569 17.047 -8.705 774 HD12 LEU 91 2HD1 LEU 91 7.622 15.942 -9.701 775 HD13 LEU 91 3HD1 LEU 91 8.833 15.307 -8.585 776 HD21 LEU 91 3HD2 LEU 91 5.328 17.141 -6.864 777 HD22 LEU 91 1HD2 LEU 91 5.402 17.056 -8.628 778 HD23 LEU 91 2HD2 LEU 91 6.511 18.105 -7.740 779 H LEU 92 H LEU 92 3.467 13.452 -7.952 780 HA LEU 92 HA LEU 92 3.727 10.689 -7.331 781 HB2 LEU 92 2HB LEU 92 2.147 12.114 -6.158 782 HB3 LEU 92 3HB LEU 92 1.294 12.504 -7.634 783 HG LEU 92 HG LEU 92 1.324 9.619 -6.681 784 HD11 LEU 92 1HD1 LEU 92 -0.676 9.975 -5.309 785 HD12 LEU 92 2HD1 LEU 92 -0.589 11.717 -5.590 786 HD13 LEU 92 3HD1 LEU 92 0.684 10.902 -4.677 787 HD21 LEU 92 3HD2 LEU 92 -0.748 11.266 -8.197 788 HD22 LEU 92 1HD2 LEU 92 -0.932 9.567 -7.747 789 HD23 LEU 92 2HD2 LEU 92 0.326 10.046 -8.882 790 H GLU 93 H GLU 93 2.410 12.462 -10.140 791 HA GLU 93 HA GLU 93 1.224 10.268 -11.498 792 HB2 GLU 93 2HB GLU 93 2.227 12.938 -12.558 793 HB3 GLU 93 3HB GLU 93 1.281 11.799 -13.510 794 HG2 GLU 93 2HG GLU 93 -0.608 12.050 -11.935 795 HG3 GLU 93 3HG GLU 93 0.343 13.187 -10.980 796 H ARG 94 H ARG 94 4.447 11.696 -11.679 797 HA ARG 94 HA ARG 94 5.526 10.277 -13.847 798 HB2 ARG 94 2HB ARG 94 6.618 12.237 -12.805 799 HB3 ARG 94 3HB ARG 94 6.887 11.329 -11.323 800 HG2 ARG 94 2HG ARG 94 8.961 11.487 -12.583 801 HG3 ARG 94 3HG ARG 94 8.424 9.808 -12.535 802 HD2 ARG 94 2HD ARG 94 7.538 10.027 -14.838 803 HD3 ARG 94 3HD ARG 94 8.071 11.714 -14.885 804 HE ARG 94 HE ARG 94 10.118 9.713 -14.326 805 HH11 ARG 94 1HH1 ARG 94 8.574 11.649 -16.829 806 HH12 ARG 94 2HH1 ARG 94 9.912 11.497 -17.920 807 HH21 ARG 94 1HH2 ARG 94 11.877 9.578 -15.744 808 HH22 ARG 94 2HH2 ARG 94 11.784 10.326 -17.306 809 H PHE 95 H PHE 95 5.603 9.592 -10.389 810 HA PHE 95 HA PHE 95 6.994 7.124 -10.450 811 HB2 PHE 95 2HB PHE 95 6.710 8.673 -8.467 812 HB3 PHE 95 3HB PHE 95 5.030 8.165 -8.353 813 HD1 PHE 95 HD2 PHE 95 8.552 7.029 -8.032 814 HD2 PHE 95 HD1 PHE 95 4.444 6.054 -7.301 815 HE1 PHE 95 HE2 PHE 95 9.242 5.157 -6.604 816 HE2 PHE 95 HE1 PHE 95 5.160 4.177 -5.879 817 HZ PHE 95 HZ PHE 95 7.555 3.737 -5.529 818 H TYR 96 H TYR 96 3.616 8.026 -10.464 819 HA TYR 96 HA TYR 96 2.266 5.633 -10.050 820 HB2 TYR 96 2HB TYR 96 1.085 7.695 -9.907 821 HB3 TYR 96 3HB TYR 96 1.602 8.211 -11.499 822 HD1 TYR 96 HD1 TYR 96 -0.731 5.890 -9.722 823 HD2 TYR 96 HD2 TYR 96 0.254 7.785 -13.415 824 HE1 TYR 96 HE1 TYR 96 -2.906 5.237 -10.655 825 HE2 TYR 96 HE2 TYR 96 -1.913 7.120 -14.348 826 HH TYR 96 HH TYR 96 -4.465 6.051 -12.506 827 H GLU 97 H GLU 97 3.401 7.108 -13.075 828 HA GLU 97 HA GLU 97 2.168 5.345 -14.902 829 HB2 GLU 97 2HB GLU 97 3.096 7.604 -15.472 830 HB3 GLU 97 3HB GLU 97 4.729 6.969 -15.275 831 HG2 GLU 97 2HG GLU 97 4.224 5.331 -17.129 832 HG3 GLU 97 3HG GLU 97 2.688 6.160 -17.377 833 H GLN 98 H GLN 98 5.369 5.389 -13.411 834 HA GLN 98 HA GLN 98 6.533 3.356 -14.996 835 HB2 GLN 98 2HB GLN 98 7.699 5.212 -13.627 836 HB3 GLN 98 3HB GLN 98 7.491 4.167 -12.225 837 HG2 GLN 98 2HG GLN 98 9.733 3.910 -13.193 838 HG3 GLN 98 3HG GLN 98 8.820 2.404 -13.315 839 HE21 GLN 98 1HE2 GLN 98 9.863 1.553 -15.098 840 HE22 GLN 98 2HE2 GLN 98 9.848 2.274 -16.666 841 H LEU 99 H LEU 99 4.732 3.287 -12.010 842 HA LEU 99 HA LEU 99 5.189 0.640 -11.125 843 HB2 LEU 99 2HB LEU 99 2.661 2.325 -10.897 844 HB3 LEU 99 3HB LEU 99 3.040 0.915 -9.913 845 HG LEU 99 HG LEU 99 4.668 3.483 -9.904 846 HD11 LEU 99 1HD1 LEU 99 3.639 4.017 -7.763 847 HD12 LEU 99 2HD1 LEU 99 2.624 2.583 -7.866 848 HD13 LEU 99 3HD1 LEU 99 2.407 3.898 -9.019 849 HD21 LEU 99 3HD2 LEU 99 5.965 1.512 -9.285 850 HD22 LEU 99 1HD2 LEU 99 4.760 1.077 -8.073 851 HD23 LEU 99 2HD2 LEU 99 5.711 2.554 -7.889 852 H LYS 100 H LYS 100 2.829 2.036 -13.326 853 HA LYS 100 HA LYS 100 1.261 -0.269 -13.879 854 HB2 LYS 100 2HB LYS 100 1.684 2.139 -15.711 855 HB3 LYS 100 3HB LYS 100 0.280 1.074 -15.658 856 HG2 LYS 100 2HG LYS 100 -0.404 1.954 -13.525 857 HG3 LYS 100 3HG LYS 100 1.116 2.827 -13.335 858 HD2 LYS 100 2HD LYS 100 -0.494 4.473 -13.928 859 HD3 LYS 100 3HD LYS 100 0.454 4.207 -15.386 860 HE2 LYS 100 2HE LYS 100 -2.301 3.041 -14.838 861 HE3 LYS 100 3HE LYS 100 -1.971 4.447 -15.844 862 HZ1 LYS 100 3HZ LYS 100 -0.652 2.980 -17.304 863 HZ2 LYS 100 1HZ LYS 100 -2.286 2.547 -17.220 864 HZ3 LYS 100 2HZ LYS 100 -1.136 1.652 -16.374 865 H LYS 101 H LYS 101 4.034 1.250 -15.448 866 HA LYS 101 HA LYS 101 4.120 -0.434 -17.758 867 HB2 LYS 101 2HB LYS 101 6.293 1.361 -16.592 868 HB3 LYS 101 3HB LYS 101 6.297 0.666 -18.210 869 HG2 LYS 101 2HG LYS 101 4.111 1.963 -18.616 870 HG3 LYS 101 3HG LYS 101 4.455 2.798 -17.102 871 HD2 LYS 101 2HD LYS 101 5.242 4.187 -18.909 872 HD3 LYS 101 3HD LYS 101 6.657 3.541 -18.075 873 HE2 LYS 101 2HE LYS 101 6.920 1.833 -19.845 874 HE3 LYS 101 3HE LYS 101 5.492 2.461 -20.670 875 HZ1 LYS 101 3HZ LYS 101 7.993 3.985 -20.174 876 HZ2 LYS 101 1HZ LYS 101 6.632 4.550 -21.000 877 HZ3 LYS 101 2HZ LYS 101 7.544 3.285 -21.640 878 H ASP 102 H ASP 102 5.463 -0.617 -14.540 879 HA ASP 102 HA ASP 102 7.282 -2.782 -14.957 880 HB2 ASP 102 2HB ASP 102 7.350 -1.354 -12.925 881 HB3 ASP 102 3HB ASP 102 5.761 -1.938 -12.439 882 H GLY 103 H GLY 103 3.943 -2.613 -13.728 883 HA2 GLY 103 2HA GLY 103 2.457 -4.499 -14.662 884 HA3 GLY 103 3HA GLY 103 3.649 -5.558 -13.912 885 H VAL 104 H VAL 104 3.639 -3.002 -11.936 886 HA VAL 104 HA VAL 104 1.975 -4.087 -9.887 887 HB VAL 104 HB VAL 104 3.263 -1.322 -10.158 888 HG11 VAL 104 1HG1 VAL 104 1.378 -1.173 -8.595 889 HG12 VAL 104 2HG1 VAL 104 2.903 -1.050 -7.719 890 HG13 VAL 104 3HG1 VAL 104 1.985 -2.560 -7.685 891 HG21 VAL 104 3HG2 VAL 104 4.967 -2.194 -8.603 892 HG22 VAL 104 1HG2 VAL 104 4.900 -3.155 -10.082 893 HG23 VAL 104 2HG2 VAL 104 4.171 -3.770 -8.594 894 H ASP 105 H ASP 105 -0.157 -3.835 -9.609 895 HA ASP 105 HA ASP 105 -1.788 -2.208 -11.332 896 HB2 ASP 105 2HB ASP 105 -2.485 -4.413 -10.320 897 HB3 ASP 105 3HB ASP 105 -2.546 -3.643 -8.748 898 H VAL 106 H VAL 106 -2.766 -0.298 -10.851 899 HA VAL 106 HA VAL 106 -1.988 1.133 -8.387 900 HB VAL 106 HB VAL 106 -1.830 3.228 -9.745 901 HG11 VAL 106 1HG1 VAL 106 0.019 1.035 -10.767 902 HG12 VAL 106 2HG1 VAL 106 0.248 2.004 -9.313 903 HG13 VAL 106 3HG1 VAL 106 0.316 2.773 -10.896 904 HG21 VAL 106 3HG2 VAL 106 -3.325 2.634 -11.608 905 HG22 VAL 106 1HG2 VAL 106 -2.182 1.413 -12.173 906 HG23 VAL 106 2HG2 VAL 106 -1.753 3.126 -12.233 907 H ARG 107 H ARG 107 -3.724 1.510 -7.265 908 HA ARG 107 HA ARG 107 -6.289 2.115 -8.613 909 HB2 ARG 107 2HB ARG 107 -5.607 0.520 -6.232 910 HB3 ARG 107 3HB ARG 107 -6.706 1.815 -5.796 911 HG2 ARG 107 2HG ARG 107 -8.025 -0.078 -6.245 912 HG3 ARG 107 3HG ARG 107 -8.264 1.001 -7.608 913 HD2 ARG 107 2HD ARG 107 -6.441 -1.426 -7.615 914 HD3 ARG 107 3HD ARG 107 -8.096 -1.430 -8.212 915 HE ARG 107 HE ARG 107 -5.744 -0.396 -9.520 916 HH11 ARG 107 1HH1 ARG 107 -9.255 -0.243 -9.500 917 HH12 ARG 107 2HH1 ARG 107 -9.352 0.324 -11.135 918 HH21 ARG 107 1HH2 ARG 107 -5.886 0.354 -11.637 919 HH22 ARG 107 2HH2 ARG 107 -7.442 0.665 -12.350 920 H VAL 108 H VAL 108 -6.156 4.292 -8.996 921 HA VAL 108 HA VAL 108 -5.708 6.065 -6.669 922 HB VAL 108 HB VAL 108 -5.609 7.962 -8.392 923 HG11 VAL 108 1HG1 VAL 108 -3.227 7.577 -8.949 924 HG12 VAL 108 2HG1 VAL 108 -3.390 5.877 -8.503 925 HG13 VAL 108 3HG1 VAL 108 -3.583 7.132 -7.278 926 HG21 VAL 108 3HG2 VAL 108 -5.265 5.670 -10.377 927 HG22 VAL 108 1HG2 VAL 108 -5.007 7.382 -10.733 928 HG23 VAL 108 2HG2 VAL 108 -6.620 6.799 -10.322 929 H THR 109 H THR 109 -7.472 6.588 -5.683 930 HA THR 109 HA THR 109 -10.090 6.315 -6.950 931 HB THR 109 HB THR 109 -10.895 6.828 -4.589 932 HG1 THR 109 HG1 THR 109 -9.462 7.464 -3.167 933 HG21 THR 109 3HG2 THR 109 -10.226 4.637 -3.654 934 HG22 THR 109 1HG2 THR 109 -8.935 4.504 -4.849 935 HG23 THR 109 2HG2 THR 109 -10.623 4.485 -5.367 936 H ASP 110 H ASP 110 -7.836 8.778 -5.868 937 HA ASP 110 HA ASP 110 -7.666 11.005 -6.109 938 HB2 ASP 110 2HB ASP 110 -8.429 11.011 -8.354 939 HB3 ASP 110 3HB ASP 110 -10.089 10.644 -7.897 940 H ASN 111 H ASN 111 -11.062 10.172 -5.477 941 HA ASN 111 HA ASN 111 -11.396 12.133 -3.392 942 HB2 ASN 111 2HB ASN 111 -13.140 9.742 -4.084 943 HB3 ASN 111 3HB ASN 111 -13.608 11.131 -3.115 944 HD21 ASN 111 1HD2 ASN 111 -12.283 13.009 -5.092 945 HD22 ASN 111 2HD2 ASN 111 -13.366 13.054 -6.429 946 H GLU 112 H GLU 112 -11.215 11.786 -1.219 947 HA GLU 112 HA GLU 112 -9.593 9.658 -0.220 948 HB2 GLU 112 2HB GLU 112 -11.183 11.757 1.306 949 HB3 GLU 112 3HB GLU 112 -9.909 10.742 1.979 950 HG2 GLU 112 2HG GLU 112 -8.271 11.807 0.445 951 HG3 GLU 112 3HG GLU 112 -9.560 12.849 -0.169 952 H ASP 113 H ASP 113 -13.040 10.408 0.022 953 HA ASP 113 HA ASP 113 -13.729 8.346 1.858 954 HB2 ASP 113 2HB ASP 113 -15.429 10.068 0.023 955 HB3 ASP 113 3HB ASP 113 -16.120 8.896 1.145 956 H GLU 114 H GLU 114 -13.539 8.402 -1.663 957 HA GLU 114 HA GLU 114 -14.692 5.808 -2.057 958 HB2 GLU 114 2HB GLU 114 -12.747 7.383 -3.790 959 HB3 GLU 114 3HB GLU 114 -13.546 5.899 -4.294 960 HG2 GLU 114 2HG GLU 114 -14.915 8.515 -3.609 961 HG3 GLU 114 3HG GLU 114 -14.644 7.882 -5.227 962 H ALA 115 H ALA 115 -11.474 6.941 -1.191 963 HA ALA 115 HA ALA 115 -10.015 4.551 -1.752 964 HB1 ALA 115 3HB ALA 115 -8.926 6.745 -1.577 965 HB2 ALA 115 1HB ALA 115 -8.205 5.585 -0.457 966 HB3 ALA 115 2HB ALA 115 -9.318 6.819 0.140 967 H LYS 116 H LYS 116 -11.119 5.958 1.353 968 HA LYS 116 HA LYS 116 -10.351 3.848 3.050 969 HB2 LYS 116 2HB LYS 116 -11.797 4.906 4.741 970 HB3 LYS 116 3HB LYS 116 -10.925 6.143 3.841 971 HG2 LYS 116 2HG LYS 116 -12.950 6.542 2.453 972 HG3 LYS 116 3HG LYS 116 -13.811 5.326 3.393 973 HD2 LYS 116 2HD LYS 116 -14.478 7.494 4.178 974 HD3 LYS 116 3HD LYS 116 -13.496 6.745 5.434 975 HE2 LYS 116 2HE LYS 116 -11.609 8.159 4.885 976 HE3 LYS 116 3HE LYS 116 -12.420 8.767 3.437 977 HZ1 LYS 116 3HZ LYS 116 -13.384 9.198 6.217 978 HZ2 LYS 116 1HZ LYS 116 -14.059 9.842 4.802 979 HZ3 LYS 116 2HZ LYS 116 -12.520 10.330 5.301 980 H LYS 117 H LYS 117 -13.261 4.361 1.145 981 HA LYS 117 HA LYS 117 -14.971 2.369 2.128 982 HB2 LYS 117 2HB LYS 117 -15.904 3.983 0.625 983 HB3 LYS 117 3HB LYS 117 -14.661 3.707 -0.589 984 HG2 LYS 117 2HG LYS 117 -15.625 1.471 -1.046 985 HG3 LYS 117 3HG LYS 117 -16.898 1.785 0.135 986 HD2 LYS 117 2HD LYS 117 -17.888 3.476 -1.227 987 HD3 LYS 117 3HD LYS 117 -16.445 3.624 -2.235 988 HE2 LYS 117 2HE LYS 117 -18.357 2.434 -3.339 989 HE3 LYS 117 3HE LYS 117 -16.861 1.505 -3.288 990 HZ1 LYS 117 3HZ LYS 117 -19.092 1.172 -1.365 991 HZ2 LYS 117 1HZ LYS 117 -17.708 0.208 -1.495 992 HZ3 LYS 117 2HZ LYS 117 -18.859 0.209 -2.733 993 H ARG 118 H ARG 118 -12.683 2.233 -0.642 994 HA ARG 118 HA ARG 118 -13.156 -0.489 -1.268 995 HB2 ARG 118 2HB ARG 118 -11.068 1.516 -2.095 996 HB3 ARG 118 3HB ARG 118 -10.712 -0.181 -2.390 997 HG2 ARG 118 2HG ARG 118 -11.693 0.871 -4.371 998 HG3 ARG 118 3HG ARG 118 -12.739 -0.407 -3.752 999 HD2 ARG 118 2HD ARG 118 -14.152 1.325 -2.658 1000 HD3 ARG 118 3HD ARG 118 -13.115 2.576 -3.353 1001 HE ARG 118 HE ARG 118 -14.350 0.721 -5.222 1002 HH11 ARG 118 1HH1 ARG 118 -14.500 3.863 -3.684 1003 HH12 ARG 118 2HH1 ARG 118 -15.578 4.525 -4.866 1004 HH21 ARG 118 1HH2 ARG 118 -15.839 1.568 -6.717 1005 HH22 ARG 118 2HH2 ARG 118 -16.341 3.224 -6.589 1006 H LEU 119 H LEU 119 -10.683 1.087 0.700 1007 HA LEU 119 HA LEU 119 -8.915 -0.988 1.176 1008 HB2 LEU 119 2HB LEU 119 -9.766 1.390 2.857 1009 HB3 LEU 119 3HB LEU 119 -8.501 0.300 3.401 1010 HG LEU 119 HG LEU 119 -8.392 1.890 0.808 1011 HD11 LEU 119 1HD1 LEU 119 -8.265 3.386 2.750 1012 HD12 LEU 119 2HD1 LEU 119 -6.712 3.295 1.923 1013 HD13 LEU 119 3HD1 LEU 119 -6.958 2.415 3.435 1014 HD21 LEU 119 3HD2 LEU 119 -6.289 0.187 2.188 1015 HD22 LEU 119 1HD2 LEU 119 -6.027 1.175 0.745 1016 HD23 LEU 119 2HD2 LEU 119 -7.124 -0.201 0.680 1017 H LYS 120 H LYS 120 -11.782 -0.088 3.058 1018 HA LYS 120 HA LYS 120 -11.582 -2.073 5.073 1019 HB2 LYS 120 2HB LYS 120 -12.919 0.027 5.261 1020 HB3 LYS 120 3HB LYS 120 -14.039 -0.582 4.045 1021 HG2 LYS 120 2HG LYS 120 -14.675 -2.432 5.566 1022 HG3 LYS 120 3HG LYS 120 -13.536 -1.820 6.769 1023 HD2 LYS 120 2HD LYS 120 -15.835 -1.128 7.321 1024 HD3 LYS 120 3HD LYS 120 -14.834 0.277 6.952 1025 HE2 LYS 120 2HE LYS 120 -15.809 0.354 4.668 1026 HE3 LYS 120 3HE LYS 120 -16.837 -1.026 5.064 1027 HZ1 LYS 120 3HZ LYS 120 -16.885 1.612 6.434 1028 HZ2 LYS 120 1HZ LYS 120 -17.892 0.299 6.784 1029 HZ3 LYS 120 2HZ LYS 120 -18.007 1.079 5.288 1030 H GLU 121 H GLU 121 -13.189 -1.958 1.945 1031 HA GLU 121 HA GLU 121 -14.615 -4.429 2.134 1032 HB2 GLU 121 2HB GLU 121 -13.910 -2.712 -0.283 1033 HB3 GLU 121 3HB GLU 121 -15.022 -4.081 -0.317 1034 HG2 GLU 121 2HG GLU 121 -16.514 -2.942 1.256 1035 HG3 GLU 121 3HG GLU 121 -15.401 -1.582 1.363 1036 H LEU 122 H LEU 122 -11.348 -3.601 1.116 1037 HA LEU 122 HA LEU 122 -10.820 -6.029 -0.352 1038 HB2 LEU 122 2HB LEU 122 -8.775 -4.123 0.864 1039 HB3 LEU 122 3HB LEU 122 -8.461 -5.360 -0.346 1040 HG LEU 122 HG LEU 122 -9.897 -2.720 -0.693 1041 HD11 LEU 122 1HD1 LEU 122 -7.493 -2.643 -0.919 1042 HD12 LEU 122 2HD1 LEU 122 -8.262 -2.361 -2.477 1043 HD13 LEU 122 3HD1 LEU 122 -7.534 -3.929 -2.127 1044 HD21 LEU 122 3HD2 LEU 122 -10.476 -3.333 -3.005 1045 HD22 LEU 122 1HD2 LEU 122 -11.325 -4.338 -1.832 1046 HD23 LEU 122 2HD2 LEU 122 -9.936 -4.985 -2.704 1047 H LEU 123 H LEU 123 -10.456 -4.986 2.987 1048 HA LEU 123 HA LEU 123 -8.998 -7.257 3.937 1049 HB2 LEU 123 2HB LEU 123 -10.570 -5.042 5.235 1050 HB3 LEU 123 3HB LEU 123 -10.189 -6.458 6.206 1051 HG LEU 123 HG LEU 123 -7.769 -6.098 5.812 1052 HD11 LEU 123 1HD1 LEU 123 -7.839 -4.968 3.625 1053 HD12 LEU 123 2HD1 LEU 123 -6.901 -4.060 4.806 1054 HD13 LEU 123 3HD1 LEU 123 -8.532 -3.533 4.389 1055 HD21 LEU 123 3HD2 LEU 123 -7.544 -4.103 7.233 1056 HD22 LEU 123 1HD2 LEU 123 -8.821 -5.179 7.799 1057 HD23 LEU 123 2HD2 LEU 123 -9.240 -3.698 6.932 1058 H GLU 124 H GLU 124 -12.397 -6.634 3.400 1059 HA GLU 124 HA GLU 124 -13.436 -9.018 4.578 1060 HB2 GLU 124 2HB GLU 124 -14.557 -7.286 2.326 1061 HB3 GLU 124 3HB GLU 124 -15.456 -8.538 3.179 1062 HG2 GLU 124 2HG GLU 124 -15.240 -7.261 5.288 1063 HG3 GLU 124 3HG GLU 124 -14.324 -6.020 4.439 1064 H LYS 125 H LYS 125 -11.795 -8.341 1.554 1065 HA LYS 125 HA LYS 125 -12.397 -11.057 0.517 1066 HB2 LYS 125 2HB LYS 125 -11.754 -8.647 -1.226 1067 HB3 LYS 125 3HB LYS 125 -12.437 -10.190 -1.729 1068 HG2 LYS 125 2HG LYS 125 -14.551 -9.634 -0.575 1069 HG3 LYS 125 3HG LYS 125 -13.838 -8.120 -0.015 1070 HD2 LYS 125 2HD LYS 125 -13.479 -7.597 -2.546 1071 HD3 LYS 125 3HD LYS 125 -14.641 -8.893 -2.830 1072 HE2 LYS 125 2HE LYS 125 -15.120 -6.341 -1.255 1073 HE3 LYS 125 3HE LYS 125 -15.756 -6.720 -2.854 1074 HZ1 LYS 125 3HZ LYS 125 -16.964 -8.586 -1.812 1075 HZ2 LYS 125 1HZ LYS 125 -17.441 -7.063 -1.247 1076 HZ3 LYS 125 2HZ LYS 125 -16.445 -8.043 -0.299 1077 H VAL 126 H VAL 126 -10.098 -8.922 -1.069 1078 HA VAL 126 HA VAL 126 -7.717 -9.806 0.284 1079 HB VAL 126 HB VAL 126 -6.654 -10.578 -2.035 1080 HG11 VAL 126 1HG1 VAL 126 -8.409 -12.491 -0.462 1081 HG12 VAL 126 2HG1 VAL 126 -6.747 -12.029 -0.077 1082 HG13 VAL 126 3HG1 VAL 126 -7.088 -12.942 -1.547 1083 HG21 VAL 126 3HG2 VAL 126 -8.626 -10.128 -3.448 1084 HG22 VAL 126 1HG2 VAL 126 -9.565 -11.323 -2.550 1085 HG23 VAL 126 2HG2 VAL 126 -8.180 -11.832 -3.522 1086 H GLY 127 H GLY 127 -8.840 -8.505 -2.857 1087 HA2 GLY 127 2HA GLY 127 -8.524 -5.933 -2.857 1088 HA3 GLY 127 3HA GLY 127 -6.823 -6.361 -2.722 1089 H SER 128 H SER 128 -9.471 -7.798 -4.683 1090 HA SER 128 HA SER 128 -7.912 -7.234 -7.143 1091 HB2 SER 128 2HB SER 128 -8.668 -9.545 -7.922 1092 HB3 SER 128 3HB SER 128 -7.488 -9.540 -6.610 1093 HG SER 128 HG SER 128 -9.230 -11.000 -6.223 1094 H LEU 129 H LEU 129 -11.036 -8.801 -6.439 1095 HA LEU 129 HA LEU 129 -13.180 -8.344 -6.775 1096 HB2 LEU 129 2HB LEU 129 -12.183 -5.521 -7.144 1097 HB3 LEU 129 3HB LEU 129 -13.871 -5.914 -7.430 1098 HG LEU 129 HG LEU 129 -14.041 -6.781 -5.093 1099 HD11 LEU 129 1HD1 LEU 129 -11.265 -5.620 -4.696 1100 HD12 LEU 129 2HD1 LEU 129 -11.694 -7.331 -4.658 1101 HD13 LEU 129 3HD1 LEU 129 -12.322 -6.243 -3.423 1102 HD21 LEU 129 3HD2 LEU 129 -14.095 -4.578 -3.983 1103 HD22 LEU 129 1HD2 LEU 129 -14.795 -4.508 -5.599 1104 HD23 LEU 129 2HD2 LEU 129 -13.172 -3.875 -5.314 1105 H GLU 130 H GLU 130 -14.441 -8.998 -8.322 1106 HA GLU 130 HA GLU 130 -13.502 -9.171 -11.027 1107 HB2 GLU 130 2HB GLU 130 -16.192 -10.016 -9.878 1108 HB3 GLU 130 3HB GLU 130 -15.559 -10.454 -11.461 1109 HG2 GLU 130 2HG GLU 130 -13.646 -11.616 -10.283 1110 HG3 GLU 130 3HG GLU 130 -14.481 -11.302 -8.760 1111 H HIS 131 H HIS 131 -13.339 -7.063 -11.627 1112 HA HIS 131 HA HIS 131 -15.443 -5.705 -12.913 1113 HB2 HIS 131 2HB HIS 131 -16.197 -5.076 -10.629 1114 HB3 HIS 131 3HB HIS 131 -14.583 -4.505 -10.223 1115 HD1 HIS 131 HD1 HIS 131 -17.531 -3.619 -12.438 1116 HD2 HIS 131 HD2 HIS 131 -14.093 -1.863 -10.888 1117 HE1 HIS 131 HE1 HIS 131 -17.690 -1.182 -13.025 1118 HE2 HIS 131 HE2 HIS 131 -15.681 -0.121 -11.952 1119 H HIS 132 H HIS 132 -12.401 -5.454 -11.148 1120 HA HIS 132 HA HIS 132 -11.092 -3.595 -12.872 1121 HB2 HIS 132 2HB HIS 132 -10.319 -3.987 -10.558 1122 HB3 HIS 132 3HB HIS 132 -9.956 -5.668 -10.937 1123 HD1 HIS 132 HD1 HIS 132 -8.835 -2.182 -11.962 1124 HD2 HIS 132 HD2 HIS 132 -7.372 -6.070 -11.793 1125 HE1 HIS 132 HE1 HIS 132 -6.409 -2.022 -12.581 1126 HE2 HIS 132 HE2 HIS 132 -5.512 -4.333 -12.231 1127 H HIS 133 H HIS 133 -10.224 -3.958 -14.815 1128 HA HIS 133 HA HIS 133 -9.640 -4.873 -16.776 1129 HB2 HIS 133 2HB HIS 133 -7.841 -6.078 -15.684 1130 HB3 HIS 133 3HB HIS 133 -8.943 -7.300 -15.063 1131 HD1 HIS 133 HD1 HIS 133 -9.741 -9.119 -16.723 1132 HD2 HIS 133 HD2 HIS 133 -6.968 -6.482 -18.327 1133 HE1 HIS 133 HE1 HIS 133 -8.975 -10.177 -18.863 1134 HE2 HIS 133 HE2 HIS 133 -7.201 -8.630 -19.745 1135 H HIS 134 H HIS 134 -11.716 -4.648 -17.582 1136 HA HIS 134 HA HIS 134 -13.479 -7.013 -17.698 1137 HB2 HIS 134 2HB HIS 134 -14.661 -4.946 -17.248 1138 HB3 HIS 134 3HB HIS 134 -13.844 -4.116 -18.568 1139 HD1 HIS 134 HD1 HIS 134 -15.370 -3.768 -20.491 1140 HD2 HIS 134 HD2 HIS 134 -16.263 -7.303 -18.487 1141 HE1 HIS 134 HE1 HIS 134 -17.290 -4.784 -21.741 1142 HE2 HIS 134 HE2 HIS 134 -17.658 -7.014 -20.649 1143 H HIS 135 H HIS 135 -11.747 -4.741 -19.826 1144 HA HIS 135 HA HIS 135 -10.876 -4.805 -21.877 1145 HB2 HIS 135 2HB HIS 135 -9.589 -6.744 -21.137 1146 HB3 HIS 135 3HB HIS 135 -10.923 -7.825 -21.518 1147 HD1 HIS 135 HD1 HIS 135 -10.535 -9.055 -23.640 1148 HD2 HIS 135 HD2 HIS 135 -8.800 -5.271 -23.740 1149 HE1 HIS 135 HE1 HIS 135 -9.428 -8.870 -25.888 1150 HE2 HIS 135 HE2 HIS 135 -8.513 -6.535 -25.980 1151 H HIS 136 H HIS 136 -12.959 -7.717 -22.249 1152 HA HIS 136 HA HIS 136 -14.557 -6.281 -24.293 1153 HB2 HIS 136 2HB HIS 136 -12.815 -7.672 -25.437 1154 HB3 HIS 136 3HB HIS 136 -13.428 -9.110 -24.624 1155 HD1 HIS 136 HD1 HIS 136 -15.315 -10.327 -25.790 1156 HD2 HIS 136 HD2 HIS 136 -14.730 -6.510 -27.330 1157 HE1 HIS 136 HE1 HIS 136 -16.799 -10.181 -27.803 1158 HE2 HIS 136 HE2 HIS 136 -16.299 -7.936 -28.806 Start of MODEL 16 1 H1 MET 1 1H MET 1 -4.279 -15.746 0.718 2 H2 MET 1 2H MET 1 -3.947 -14.509 1.823 3 H3 MET 1 3H MET 1 -2.703 -15.508 1.273 4 HA MET 1 HA MET 1 -2.934 -14.679 -0.946 5 HB2 MET 1 2HB MET 1 -5.042 -12.830 0.263 6 HB3 MET 1 3HB MET 1 -4.414 -12.698 -1.376 7 HG2 MET 1 2HG MET 1 -5.356 -14.889 -1.929 8 HG3 MET 1 3HG MET 1 -5.948 -15.063 -0.275 9 HE1 MET 1 3HE MET 1 -7.837 -15.452 -2.783 10 HE2 MET 1 1HE MET 1 -9.265 -14.542 -2.287 11 HE3 MET 1 2HE MET 1 -8.416 -15.556 -1.119 12 H GLY 2 H GLY 2 -1.008 -13.686 -1.122 13 HA2 GLY 2 2HA GLY 2 0.012 -11.833 0.886 14 HA3 GLY 2 3HA GLY 2 0.875 -12.468 -0.510 15 H THR 3 H THR 3 -2.003 -10.474 0.130 16 HA THR 3 HA THR 3 -1.564 -8.860 -2.256 17 HB THR 3 HB THR 3 -3.757 -8.485 -0.161 18 HG1 THR 3 HG1 THR 3 -4.807 -10.150 -0.981 19 HG21 THR 3 3HG2 THR 3 -5.043 -7.543 -2.038 20 HG22 THR 3 1HG2 THR 3 -3.692 -7.847 -3.138 21 HG23 THR 3 2HG2 THR 3 -3.525 -6.666 -1.838 22 H VAL 4 H VAL 4 -0.018 -7.319 -2.029 23 HA VAL 4 HA VAL 4 0.471 -6.025 0.577 24 HB VAL 4 HB VAL 4 2.122 -5.778 -1.999 25 HG11 VAL 4 1HG1 VAL 4 3.930 -4.985 -0.505 26 HG12 VAL 4 2HG1 VAL 4 2.861 -5.142 0.890 27 HG13 VAL 4 3HG1 VAL 4 2.500 -3.959 -0.368 28 HG21 VAL 4 3HG2 VAL 4 2.605 -7.704 0.310 29 HG22 VAL 4 1HG2 VAL 4 3.681 -7.452 -1.069 30 HG23 VAL 4 2HG2 VAL 4 2.078 -8.150 -1.317 31 H VAL 5 H VAL 5 -0.697 -4.201 0.832 32 HA VAL 5 HA VAL 5 -1.536 -2.641 -1.530 33 HB VAL 5 HB VAL 5 -3.661 -2.098 -0.258 34 HG11 VAL 5 1HG1 VAL 5 -3.184 -5.032 -0.915 35 HG12 VAL 5 2HG1 VAL 5 -3.637 -3.769 -2.059 36 HG13 VAL 5 3HG1 VAL 5 -4.767 -4.252 -0.797 37 HG21 VAL 5 3HG2 VAL 5 -2.786 -4.376 1.570 38 HG22 VAL 5 1HG2 VAL 5 -4.379 -3.606 1.576 39 HG23 VAL 5 2HG2 VAL 5 -2.949 -2.683 2.036 40 H ILE 6 H ILE 6 -0.670 -0.686 -1.561 41 HA ILE 6 HA ILE 6 0.615 0.316 0.913 42 HB ILE 6 HB ILE 6 1.406 0.922 -1.981 43 HG12 ILE 6 2HG1 ILE 6 3.589 -0.357 -1.248 44 HG13 ILE 6 3HG1 ILE 6 2.601 -1.030 0.039 45 HG21 ILE 6 1HG2 ILE 6 1.901 2.798 -0.468 46 HG22 ILE 6 2HG2 ILE 6 3.396 2.026 -0.995 47 HG23 ILE 6 3HG2 ILE 6 2.770 1.715 0.625 48 HD11 ILE 6 3HD1 ILE 6 1.151 -2.077 -1.620 49 HD12 ILE 6 1HD1 ILE 6 2.834 -2.550 -1.844 50 HD13 ILE 6 2HD1 ILE 6 2.104 -1.360 -2.919 51 H VAL 7 H VAL 7 -0.654 1.817 1.796 52 HA VAL 7 HA VAL 7 -2.356 3.584 0.215 53 HB VAL 7 HB VAL 7 -2.019 3.436 3.253 54 HG11 VAL 7 1HG1 VAL 7 -4.174 4.657 3.353 55 HG12 VAL 7 2HG1 VAL 7 -4.201 4.777 1.591 56 HG13 VAL 7 3HG1 VAL 7 -2.946 5.608 2.516 57 HG21 VAL 7 3HG2 VAL 7 -4.100 2.128 3.265 58 HG22 VAL 7 1HG2 VAL 7 -2.839 1.304 2.341 59 HG23 VAL 7 2HG2 VAL 7 -4.141 2.150 1.500 60 H VAL 8 H VAL 8 -1.313 5.255 -0.673 61 HA VAL 8 HA VAL 8 0.594 6.823 0.961 62 HB VAL 8 HB VAL 8 0.403 6.938 -2.074 63 HG11 VAL 8 1HG1 VAL 8 2.603 8.019 -1.958 64 HG12 VAL 8 2HG1 VAL 8 2.597 7.881 -0.199 65 HG13 VAL 8 3HG1 VAL 8 1.416 8.914 -1.008 66 HG21 VAL 8 3HG2 VAL 8 2.414 5.509 -2.206 67 HG22 VAL 8 1HG2 VAL 8 1.055 4.645 -1.482 68 HG23 VAL 8 2HG2 VAL 8 2.355 5.261 -0.459 69 H SER 9 H SER 9 0.325 9.042 1.090 70 HA SER 9 HA SER 9 -1.526 10.504 -0.577 71 HB2 SER 9 2HB SER 9 -3.071 9.669 1.223 72 HB3 SER 9 3HB SER 9 -2.032 10.407 2.444 73 HG SER 9 HG SER 9 -3.864 11.569 0.732 74 H ASN 10 H ASN 10 -1.141 12.781 -0.432 75 HA ASN 10 HA ASN 10 1.486 13.586 0.377 76 HB2 ASN 10 2HB ASN 10 0.711 15.895 -0.303 77 HB3 ASN 10 3HB ASN 10 0.525 14.666 -1.542 78 HD21 ASN 10 1HD2 ASN 10 -1.173 16.792 0.659 79 HD22 ASN 10 2HD2 ASN 10 -2.738 16.572 -0.038 80 H ASP 11 H ASP 11 -1.347 13.238 2.176 81 HA ASP 11 HA ASP 11 -0.460 15.152 4.262 82 HB2 ASP 11 2HB ASP 11 -2.700 15.682 3.275 83 HB3 ASP 11 3HB ASP 11 -3.281 14.088 3.749 84 H GLU 12 H GLU 12 -0.792 14.498 6.458 85 HA GLU 12 HA GLU 12 0.126 11.778 6.938 86 HB2 GLU 12 2HB GLU 12 -0.303 13.999 8.985 87 HB3 GLU 12 3HB GLU 12 0.698 12.558 9.160 88 HG2 GLU 12 2HG GLU 12 2.209 13.422 7.396 89 HG3 GLU 12 3HG GLU 12 1.227 14.881 7.284 90 H ARG 13 H ARG 13 -2.564 13.897 7.962 91 HA ARG 13 HA ARG 13 -3.674 11.980 9.766 92 HB2 ARG 13 2HB ARG 13 -4.828 14.584 8.719 93 HB3 ARG 13 3HB ARG 13 -5.585 13.587 9.966 94 HG2 ARG 13 2HG ARG 13 -3.447 13.851 11.329 95 HG3 ARG 13 3HG ARG 13 -2.920 15.038 10.133 96 HD2 ARG 13 2HD ARG 13 -5.407 15.228 11.872 97 HD3 ARG 13 3HD ARG 13 -3.905 16.133 12.102 98 HE ARG 13 HE ARG 13 -4.737 16.698 9.539 99 HH11 ARG 13 1HH1 ARG 13 -6.081 17.189 12.755 100 HH12 ARG 13 2HH1 ARG 13 -6.972 18.599 12.286 101 HH21 ARG 13 1HH2 ARG 13 -5.932 18.504 8.940 102 HH22 ARG 13 2HH2 ARG 13 -6.886 19.347 10.119 103 H ILE 14 H ILE 14 -4.211 12.666 6.367 104 HA ILE 14 HA ILE 14 -6.562 11.131 5.991 105 HB ILE 14 HB ILE 14 -4.223 11.608 4.083 106 HG12 ILE 14 2HG1 ILE 14 -5.386 13.696 4.708 107 HG13 ILE 14 3HG1 ILE 14 -5.719 13.310 3.028 108 HG21 ILE 14 1HG2 ILE 14 -6.963 10.450 3.427 109 HG22 ILE 14 2HG2 ILE 14 -5.424 9.590 3.363 110 HG23 ILE 14 3HG2 ILE 14 -5.739 10.912 2.238 111 HD11 ILE 14 3HD1 ILE 14 -7.687 14.162 4.145 112 HD12 ILE 14 1HD1 ILE 14 -7.600 12.887 5.358 113 HD13 ILE 14 2HD1 ILE 14 -7.948 12.484 3.673 114 H LEU 15 H LEU 15 -3.106 10.222 6.089 115 HA LEU 15 HA LEU 15 -3.459 7.429 5.630 116 HB2 LEU 15 2HB LEU 15 -1.210 8.950 7.004 117 HB3 LEU 15 3HB LEU 15 -1.135 7.238 6.604 118 HG LEU 15 HG LEU 15 -1.381 9.510 4.583 119 HD11 LEU 15 1HD1 LEU 15 0.822 9.470 5.625 120 HD12 LEU 15 2HD1 LEU 15 0.914 8.952 3.944 121 HD13 LEU 15 3HD1 LEU 15 1.000 7.755 5.242 122 HD21 LEU 15 3HD2 LEU 15 -1.000 7.765 2.872 123 HD22 LEU 15 1HD2 LEU 15 -2.504 7.507 3.755 124 HD23 LEU 15 2HD2 LEU 15 -1.087 6.516 4.122 125 H GLU 16 H GLU 16 -3.512 9.434 8.533 126 HA GLU 16 HA GLU 16 -3.494 7.320 10.461 127 HB2 GLU 16 2HB GLU 16 -4.383 10.229 10.674 128 HB3 GLU 16 3HB GLU 16 -4.245 9.134 12.052 129 HG2 GLU 16 2HG GLU 16 -1.863 8.912 11.715 130 HG3 GLU 16 3HG GLU 16 -1.943 9.837 10.215 131 H GLU 17 H GLU 17 -6.052 9.223 8.937 132 HA GLU 17 HA GLU 17 -8.318 8.149 10.218 133 HB2 GLU 17 2HB GLU 17 -8.474 10.218 8.948 134 HB3 GLU 17 3HB GLU 17 -7.895 9.442 7.482 135 HG2 GLU 17 2HG GLU 17 -10.325 9.947 7.417 136 HG3 GLU 17 3HG GLU 17 -9.965 8.231 7.215 137 H LEU 18 H LEU 18 -6.768 7.328 7.134 138 HA LEU 18 HA LEU 18 -8.437 5.141 6.476 139 HB2 LEU 18 2HB LEU 18 -5.908 6.322 5.351 140 HB3 LEU 18 3HB LEU 18 -6.327 4.694 4.856 141 HG LEU 18 HG LEU 18 -8.486 5.475 3.936 142 HD11 LEU 18 1HD1 LEU 18 -9.083 7.834 3.754 143 HD12 LEU 18 2HD1 LEU 18 -7.669 8.283 4.713 144 HD13 LEU 18 3HD1 LEU 18 -8.968 7.339 5.442 145 HD21 LEU 18 3HD2 LEU 18 -7.635 6.740 2.010 146 HD22 LEU 18 1HD2 LEU 18 -6.540 5.430 2.455 147 HD23 LEU 18 2HD2 LEU 18 -6.144 7.096 2.890 148 H LEU 19 H LEU 19 -5.486 5.362 8.392 149 HA LEU 19 HA LEU 19 -4.657 2.687 8.499 150 HB2 LEU 19 2HB LEU 19 -3.411 4.578 9.584 151 HB3 LEU 19 3HB LEU 19 -4.674 4.680 10.801 152 HG LEU 19 HG LEU 19 -4.060 2.143 11.295 153 HD11 LEU 19 1HD1 LEU 19 -1.502 3.053 9.960 154 HD12 LEU 19 2HD1 LEU 19 -2.604 1.794 9.391 155 HD13 LEU 19 3HD1 LEU 19 -1.720 1.570 10.897 156 HD21 LEU 19 3HD2 LEU 19 -2.171 4.334 12.182 157 HD22 LEU 19 1HD2 LEU 19 -2.420 2.774 12.969 158 HD23 LEU 19 2HD2 LEU 19 -3.731 3.950 12.915 159 H GLU 20 H GLU 20 -6.964 4.436 10.498 160 HA GLU 20 HA GLU 20 -7.481 2.349 12.340 161 HB2 GLU 20 2HB GLU 20 -9.043 4.904 11.761 162 HB3 GLU 20 3HB GLU 20 -9.230 3.889 13.198 163 HG2 GLU 20 2HG GLU 20 -6.902 4.341 13.842 164 HG3 GLU 20 3HG GLU 20 -6.672 5.315 12.387 165 H VAL 21 H VAL 21 -8.999 3.345 9.346 166 HA VAL 21 HA VAL 21 -11.387 1.850 9.482 167 HB VAL 21 HB VAL 21 -9.779 2.560 6.978 168 HG11 VAL 21 1HG1 VAL 21 -11.984 2.417 5.805 169 HG12 VAL 21 2HG1 VAL 21 -12.724 1.836 7.301 170 HG13 VAL 21 3HG1 VAL 21 -11.490 0.867 6.495 171 HG21 VAL 21 3HG2 VAL 21 -11.177 4.593 6.854 172 HG22 VAL 21 1HG2 VAL 21 -10.264 4.557 8.362 173 HG23 VAL 21 2HG2 VAL 21 -11.981 4.150 8.361 174 H VAL 22 H VAL 22 -8.106 1.011 8.362 175 HA VAL 22 HA VAL 22 -8.669 -1.593 7.374 176 HB VAL 22 HB VAL 22 -6.034 -0.440 8.421 177 HG11 VAL 22 1HG1 VAL 22 -6.507 -2.954 6.767 178 HG12 VAL 22 2HG1 VAL 22 -5.961 -2.902 8.445 179 HG13 VAL 22 3HG1 VAL 22 -4.926 -2.276 7.163 180 HG21 VAL 22 3HG2 VAL 22 -7.070 -0.676 5.566 181 HG22 VAL 22 1HG2 VAL 22 -5.477 -0.069 6.034 182 HG23 VAL 22 2HG2 VAL 22 -6.932 0.818 6.494 183 H LEU 23 H LEU 23 -7.238 -0.466 10.445 184 HA LEU 23 HA LEU 23 -6.929 -2.904 11.765 185 HB2 LEU 23 2HB LEU 23 -7.222 -0.049 12.699 186 HB3 LEU 23 3HB LEU 23 -7.244 -1.325 13.894 187 HG LEU 23 HG LEU 23 -4.981 -2.062 13.197 188 HD11 LEU 23 1HD1 LEU 23 -5.013 0.287 11.299 189 HD12 LEU 23 2HD1 LEU 23 -5.006 -1.421 10.855 190 HD13 LEU 23 3HD1 LEU 23 -3.615 -0.722 11.678 191 HD21 LEU 23 3HD2 LEU 23 -5.118 0.893 13.857 192 HD22 LEU 23 1HD2 LEU 23 -3.723 -0.165 14.101 193 HD23 LEU 23 2HD2 LEU 23 -5.205 -0.438 15.015 194 H LYS 24 H LYS 24 -9.726 -0.779 11.599 195 HA LYS 24 HA LYS 24 -11.345 -2.114 13.537 196 HB2 LYS 24 2HB LYS 24 -11.675 0.257 13.006 197 HB3 LYS 24 3HB LYS 24 -12.011 -0.128 11.322 198 HG2 LYS 24 2HG LYS 24 -14.080 -1.251 11.950 199 HG3 LYS 24 3HG LYS 24 -13.740 -0.977 13.666 200 HD2 LYS 24 2HD LYS 24 -13.802 1.519 13.191 201 HD3 LYS 24 3HD LYS 24 -14.333 1.136 11.548 202 HE2 LYS 24 2HE LYS 24 -16.331 -0.000 12.484 203 HE3 LYS 24 3HE LYS 24 -15.802 0.429 14.113 204 HZ1 LYS 24 3HZ LYS 24 -17.445 1.974 13.350 205 HZ2 LYS 24 1HZ LYS 24 -16.559 2.312 11.951 206 HZ3 LYS 24 2HZ LYS 24 -15.961 2.774 13.463 207 H SER 25 H SER 25 -11.133 -2.179 9.985 208 HA SER 25 HA SER 25 -13.387 -3.824 9.459 209 HB2 SER 25 2HB SER 25 -12.449 -2.394 7.719 210 HB3 SER 25 3HB SER 25 -10.904 -3.232 7.792 211 HG SER 25 HG SER 25 -12.992 -4.930 7.292 212 H ASP 26 H ASP 26 -10.038 -4.516 10.189 213 HA ASP 26 HA ASP 26 -10.518 -7.208 10.954 214 HB2 ASP 26 2HB ASP 26 -10.458 -7.421 8.387 215 HB3 ASP 26 3HB ASP 26 -8.765 -6.952 8.459 216 HA PRO 27 HA PRO 27 -6.899 -5.439 13.096 217 HB2 PRO 27 2HB PRO 27 -7.278 -7.477 15.185 218 HB3 PRO 27 3HB PRO 27 -7.622 -5.739 15.258 219 HG2 PRO 27 2HG PRO 27 -9.589 -7.627 15.302 220 HG3 PRO 27 3HG PRO 27 -9.826 -5.992 14.642 221 HD2 PRO 27 2HD PRO 27 -9.247 -8.556 13.149 222 HD3 PRO 27 3HD PRO 27 -10.451 -7.290 12.796 223 H ASN 28 H ASN 28 -7.156 -8.538 11.709 224 HA ASN 28 HA ASN 28 -4.525 -9.503 12.591 225 HB2 ASN 28 2HB ASN 28 -6.637 -10.807 10.812 226 HB3 ASN 28 3HB ASN 28 -5.084 -11.545 11.203 227 HD21 ASN 28 1HD2 ASN 28 -7.546 -12.742 11.783 228 HD22 ASN 28 2HD2 ASN 28 -7.725 -12.836 13.502 229 H VAL 29 H VAL 29 -6.000 -7.900 9.864 230 HA VAL 29 HA VAL 29 -3.821 -8.297 8.026 231 HB VAL 29 HB VAL 29 -5.966 -6.121 8.090 232 HG11 VAL 29 1HG1 VAL 29 -5.366 -5.690 5.725 233 HG12 VAL 29 2HG1 VAL 29 -4.035 -6.845 5.845 234 HG13 VAL 29 3HG1 VAL 29 -4.005 -5.358 6.800 235 HG21 VAL 29 3HG2 VAL 29 -7.058 -7.460 6.313 236 HG22 VAL 29 1HG2 VAL 29 -6.898 -8.387 7.805 237 HG23 VAL 29 2HG2 VAL 29 -5.800 -8.688 6.456 238 H LYS 30 H LYS 30 -1.833 -7.509 8.339 239 HA LYS 30 HA LYS 30 -1.297 -5.727 10.556 240 HB2 LYS 30 2HB LYS 30 0.048 -7.796 10.130 241 HB3 LYS 30 3HB LYS 30 0.644 -7.085 8.636 242 HG2 LYS 30 2HG LYS 30 2.322 -6.873 10.388 243 HG3 LYS 30 3HG LYS 30 1.731 -5.270 9.934 244 HD2 LYS 30 2HD LYS 30 0.221 -5.305 11.941 245 HD3 LYS 30 3HD LYS 30 0.901 -6.870 12.396 246 HE2 LYS 30 2HE LYS 30 3.124 -5.819 12.642 247 HE3 LYS 30 3HE LYS 30 2.435 -4.259 12.188 248 HZ1 LYS 30 3HZ LYS 30 1.008 -4.371 14.135 249 HZ2 LYS 30 1HZ LYS 30 2.636 -4.477 14.577 250 HZ3 LYS 30 2HZ LYS 30 1.673 -5.862 14.571 251 H THR 31 H THR 31 -1.165 -3.563 10.335 252 HA THR 31 HA THR 31 -0.409 -2.324 7.767 253 HB THR 31 HB THR 31 -1.079 -0.180 8.858 254 HG1 THR 31 HG1 THR 31 -1.150 -0.163 10.966 255 HG21 THR 31 3HG2 THR 31 -3.495 -0.614 8.995 256 HG22 THR 31 1HG2 THR 31 -3.185 -2.347 9.102 257 HG23 THR 31 2HG2 THR 31 -2.783 -1.468 7.624 258 H VAL 32 H VAL 32 1.398 -1.069 7.559 259 HA VAL 32 HA VAL 32 3.318 -0.834 9.795 260 HB VAL 32 HB VAL 32 3.931 -1.890 6.986 261 HG11 VAL 32 1HG1 VAL 32 5.919 -1.206 9.187 262 HG12 VAL 32 2HG1 VAL 32 5.735 -0.361 7.648 263 HG13 VAL 32 3HG1 VAL 32 6.310 -2.026 7.672 264 HG21 VAL 32 3HG2 VAL 32 4.325 -3.232 9.689 265 HG22 VAL 32 1HG2 VAL 32 4.723 -3.927 8.114 266 HG23 VAL 32 2HG2 VAL 32 3.040 -3.608 8.537 267 H ARG 33 H ARG 33 3.527 1.331 10.039 268 HA ARG 33 HA ARG 33 3.592 3.164 7.736 269 HB2 ARG 33 2HB ARG 33 3.731 3.744 10.727 270 HB3 ARG 33 3HB ARG 33 3.754 4.967 9.459 271 HG2 ARG 33 2HG ARG 33 1.425 4.227 8.808 272 HG3 ARG 33 3HG ARG 33 1.430 3.170 10.233 273 HD2 ARG 33 2HD ARG 33 1.934 5.156 11.648 274 HD3 ARG 33 3HD ARG 33 1.815 6.183 10.224 275 HE ARG 33 HE ARG 33 -0.584 4.726 10.558 276 HH11 ARG 33 1HH1 ARG 33 1.209 7.400 11.995 277 HH12 ARG 33 2HH1 ARG 33 -0.209 8.185 12.614 278 HH21 ARG 33 1HH2 ARG 33 -2.437 5.772 11.402 279 HH22 ARG 33 2HH2 ARG 33 -2.265 7.257 12.278 280 H THR 34 H THR 34 5.613 2.762 6.816 281 HA THR 34 HA THR 34 7.718 4.322 7.829 282 HB THR 34 HB THR 34 8.161 2.363 9.321 283 HG1 THR 34 HG1 THR 34 10.196 2.852 9.137 284 HG21 THR 34 3HG2 THR 34 8.866 0.839 6.785 285 HG22 THR 34 1HG2 THR 34 7.467 0.518 7.806 286 HG23 THR 34 2HG2 THR 34 9.092 0.272 8.442 287 H ASP 35 H ASP 35 9.127 4.887 6.248 288 HA ASP 35 HA ASP 35 8.817 3.728 3.568 289 HB2 ASP 35 2HB ASP 35 10.100 5.633 2.753 290 HB3 ASP 35 3HB ASP 35 8.813 6.218 3.801 291 H ASP 36 H ASP 36 10.658 3.083 6.303 292 HA ASP 36 HA ASP 36 13.214 2.496 5.192 293 HB2 ASP 36 2HB ASP 36 11.775 1.316 7.619 294 HB3 ASP 36 3HB ASP 36 13.417 0.865 7.167 295 H LYS 37 H LYS 37 12.810 1.564 3.233 296 HA LYS 37 HA LYS 37 11.102 -0.485 2.514 297 HB2 LYS 37 2HB LYS 37 12.853 -0.825 0.582 298 HB3 LYS 37 3HB LYS 37 11.988 0.698 0.726 299 HG2 LYS 37 2HG LYS 37 13.941 1.713 1.864 300 HG3 LYS 37 3HG LYS 37 14.834 0.197 1.688 301 HD2 LYS 37 2HD LYS 37 15.061 0.458 -0.647 302 HD3 LYS 37 3HD LYS 37 13.684 1.554 -0.761 303 HE2 LYS 37 2HE LYS 37 14.983 3.323 0.343 304 HE3 LYS 37 3HE LYS 37 16.371 2.233 0.468 305 HZ1 LYS 37 3HZ LYS 37 16.431 2.108 -1.939 306 HZ2 LYS 37 1HZ LYS 37 16.563 3.708 -1.418 307 HZ3 LYS 37 2HZ LYS 37 15.103 3.144 -2.049 308 H GLU 38 H GLU 38 14.430 -0.763 3.690 309 HA GLU 38 HA GLU 38 14.833 -3.509 3.368 310 HB2 GLU 38 2HB GLU 38 16.527 -3.319 5.204 311 HB3 GLU 38 3HB GLU 38 16.731 -2.116 3.943 312 HG2 GLU 38 2HG GLU 38 15.143 -1.304 6.364 313 HG3 GLU 38 3HG GLU 38 16.877 -1.525 6.576 314 H LYS 39 H LYS 39 13.147 -1.716 5.906 315 HA LYS 39 HA LYS 39 12.720 -3.981 7.631 316 HB2 LYS 39 2HB LYS 39 12.798 -1.567 8.419 317 HB3 LYS 39 3HB LYS 39 11.246 -1.307 7.627 318 HG2 LYS 39 2HG LYS 39 10.295 -3.146 9.122 319 HG3 LYS 39 3HG LYS 39 11.840 -3.134 9.977 320 HD2 LYS 39 2HD LYS 39 11.431 -0.631 10.400 321 HD3 LYS 39 3HD LYS 39 9.789 -0.900 9.803 322 HE2 LYS 39 2HE LYS 39 11.092 -2.119 12.256 323 HE3 LYS 39 3HE LYS 39 9.708 -1.029 12.201 324 HZ1 LYS 39 3HZ LYS 39 8.478 -2.807 11.052 325 HZ2 LYS 39 1HZ LYS 39 8.960 -3.238 12.613 326 HZ3 LYS 39 2HZ LYS 39 9.789 -3.844 11.271 327 H VAL 40 H VAL 40 10.784 -2.127 5.285 328 HA VAL 40 HA VAL 40 8.268 -3.273 5.663 329 HB VAL 40 HB VAL 40 9.423 -2.111 3.073 330 HG11 VAL 40 1HG1 VAL 40 7.054 -1.758 2.385 331 HG12 VAL 40 2HG1 VAL 40 6.516 -2.644 3.813 332 HG13 VAL 40 3HG1 VAL 40 7.443 -3.471 2.559 333 HG21 VAL 40 3HG2 VAL 40 8.251 -0.028 3.725 334 HG22 VAL 40 1HG2 VAL 40 9.437 -0.497 4.946 335 HG23 VAL 40 2HG2 VAL 40 7.721 -0.787 5.229 336 H LYS 41 H LYS 41 10.961 -4.410 3.675 337 HA LYS 41 HA LYS 41 9.629 -6.411 2.189 338 HB2 LYS 41 2HB LYS 41 12.546 -6.243 3.050 339 HB3 LYS 41 3HB LYS 41 11.919 -7.353 1.826 340 HG2 LYS 41 2HG LYS 41 11.288 -5.515 0.383 341 HG3 LYS 41 3HG LYS 41 11.719 -4.335 1.626 342 HD2 LYS 41 2HD LYS 41 14.095 -5.080 1.487 343 HD3 LYS 41 3HD LYS 41 13.646 -6.223 0.213 344 HE2 LYS 41 2HE LYS 41 12.937 -4.334 -1.221 345 HE3 LYS 41 3HE LYS 41 13.394 -3.198 0.052 346 HZ1 LYS 41 3HZ LYS 41 15.673 -3.939 -0.135 347 HZ2 LYS 41 1HZ LYS 41 15.110 -3.418 -1.643 348 HZ3 LYS 41 2HZ LYS 41 15.251 -5.066 -1.320 349 H GLU 42 H GLU 42 11.213 -6.468 5.343 350 HA GLU 42 HA GLU 42 10.924 -9.288 5.822 351 HB2 GLU 42 2HB GLU 42 11.340 -7.119 7.920 352 HB3 GLU 42 3HB GLU 42 11.782 -8.824 8.035 353 HG2 GLU 42 2HG GLU 42 13.063 -6.710 6.272 354 HG3 GLU 42 3HG GLU 42 13.767 -7.459 7.700 355 H GLU 43 H GLU 43 9.094 -6.370 6.551 356 HA GLU 43 HA GLU 43 7.142 -7.395 8.286 357 HB2 GLU 43 2HB GLU 43 6.899 -5.117 6.273 358 HB3 GLU 43 3HB GLU 43 5.759 -5.433 7.580 359 HG2 GLU 43 2HG GLU 43 8.649 -4.576 7.841 360 HG3 GLU 43 3HG GLU 43 7.222 -3.608 8.196 361 H ILE 44 H ILE 44 7.238 -7.135 4.749 362 HA ILE 44 HA ILE 44 4.721 -8.102 4.036 363 HB ILE 44 HB ILE 44 7.401 -8.377 2.590 364 HG12 ILE 44 2HG1 ILE 44 5.064 -6.482 2.030 365 HG13 ILE 44 3HG1 ILE 44 6.575 -6.032 2.814 366 HG21 ILE 44 1HG2 ILE 44 4.652 -9.023 1.468 367 HG22 ILE 44 2HG2 ILE 44 5.936 -10.183 1.812 368 HG23 ILE 44 3HG2 ILE 44 6.156 -8.981 0.545 369 HD11 ILE 44 3HD1 ILE 44 6.549 -5.344 0.481 370 HD12 ILE 44 1HD1 ILE 44 6.295 -7.014 -0.036 371 HD13 ILE 44 2HD1 ILE 44 7.805 -6.551 0.757 372 H GLU 45 H GLU 45 7.778 -9.811 4.650 373 HA GLU 45 HA GLU 45 6.922 -12.353 3.754 374 HB2 GLU 45 2HB GLU 45 9.314 -11.459 3.975 375 HB3 GLU 45 3HB GLU 45 9.201 -11.816 5.692 376 HG2 GLU 45 2HG GLU 45 10.379 -13.598 4.501 377 HG3 GLU 45 3HG GLU 45 8.868 -14.208 5.190 378 H LYS 46 H LYS 46 6.848 -10.810 6.925 379 HA LYS 46 HA LYS 46 6.095 -13.103 8.453 380 HB2 LYS 46 2HB LYS 46 5.711 -10.129 8.996 381 HB3 LYS 46 3HB LYS 46 5.404 -11.405 10.178 382 HG2 LYS 46 2HG LYS 46 7.796 -12.074 10.056 383 HG3 LYS 46 3HG LYS 46 8.094 -10.762 8.912 384 HD2 LYS 46 2HD LYS 46 7.140 -10.433 11.786 385 HD3 LYS 46 3HD LYS 46 8.786 -10.158 11.213 386 HE2 LYS 46 2HE LYS 46 7.996 -8.308 9.795 387 HE3 LYS 46 3HE LYS 46 6.335 -8.603 10.317 388 HZ1 LYS 46 3HZ LYS 46 8.563 -7.823 12.107 389 HZ2 LYS 46 1HZ LYS 46 6.950 -8.025 12.555 390 HZ3 LYS 46 2HZ LYS 46 7.387 -6.770 11.504 391 H ALA 47 H ALA 47 4.310 -10.604 6.688 392 HA ALA 47 HA ALA 47 1.675 -11.393 7.454 393 HB1 ALA 47 3HB ALA 47 0.923 -9.987 5.574 394 HB2 ALA 47 1HB ALA 47 2.588 -9.868 4.991 395 HB3 ALA 47 2HB ALA 47 2.143 -9.157 6.542 396 H ARG 48 H ARG 48 3.872 -12.348 4.824 397 HA ARG 48 HA ARG 48 2.106 -13.991 3.332 398 HB2 ARG 48 2HB ARG 48 5.133 -14.233 3.653 399 HB3 ARG 48 3HB ARG 48 4.178 -15.080 2.437 400 HG2 ARG 48 2HG ARG 48 3.563 -12.903 1.420 401 HG3 ARG 48 3HG ARG 48 4.544 -12.071 2.633 402 HD2 ARG 48 2HD ARG 48 5.850 -12.243 0.613 403 HD3 ARG 48 3HD ARG 48 6.544 -13.351 1.800 404 HE ARG 48 HE ARG 48 4.610 -14.554 -0.001 405 HH11 ARG 48 1HH1 ARG 48 8.020 -13.881 0.506 406 HH12 ARG 48 2HH1 ARG 48 8.552 -15.097 -0.604 407 HH21 ARG 48 1HH2 ARG 48 5.320 -16.096 -1.506 408 HH22 ARG 48 2HH2 ARG 48 7.020 -16.352 -1.745 409 H LYS 49 H LYS 49 4.171 -14.585 6.144 410 HA LYS 49 HA LYS 49 3.920 -17.404 6.271 411 HB2 LYS 49 2HB LYS 49 5.663 -15.978 7.455 412 HB3 LYS 49 3HB LYS 49 4.419 -15.500 8.602 413 HG2 LYS 49 2HG LYS 49 5.753 -17.255 9.596 414 HG3 LYS 49 3HG LYS 49 4.148 -17.904 9.259 415 HD2 LYS 49 2HD LYS 49 5.846 -19.554 8.648 416 HD3 LYS 49 3HD LYS 49 5.045 -18.981 7.183 417 HE2 LYS 49 2HE LYS 49 6.969 -17.454 6.764 418 HE3 LYS 49 3HE LYS 49 7.762 -18.075 8.211 419 HZ1 LYS 49 3HZ LYS 49 8.560 -19.105 6.168 420 HZ2 LYS 49 1HZ LYS 49 7.018 -19.713 5.855 421 HZ3 LYS 49 2HZ LYS 49 7.872 -20.236 7.213 422 H GLN 50 H GLN 50 2.051 -14.746 7.700 423 HA GLN 50 HA GLN 50 0.115 -16.391 9.055 424 HB2 GLN 50 2HB GLN 50 0.029 -13.455 8.230 425 HB3 GLN 50 3HB GLN 50 -1.151 -14.236 9.279 426 HG2 GLN 50 2HG GLN 50 1.802 -13.903 9.899 427 HG3 GLN 50 3HG GLN 50 0.497 -12.911 10.542 428 HE21 GLN 50 1HE2 GLN 50 -0.938 -13.824 12.051 429 HE22 GLN 50 2HE2 GLN 50 -0.534 -15.241 12.952 430 H GLY 51 H GLY 51 0.546 -15.297 5.794 431 HA2 GLY 51 2HA GLY 51 -0.539 -15.942 3.857 432 HA3 GLY 51 3HA GLY 51 -1.765 -16.758 4.814 433 H ARG 52 H ARG 52 -0.996 -13.481 5.522 434 HA ARG 52 HA ARG 52 -3.712 -12.629 4.723 435 HB2 ARG 52 2HB ARG 52 -1.897 -11.669 6.989 436 HB3 ARG 52 3HB ARG 52 -3.505 -11.025 6.639 437 HG2 ARG 52 2HG ARG 52 -4.518 -13.186 7.141 438 HG3 ARG 52 3HG ARG 52 -2.926 -13.905 7.392 439 HD2 ARG 52 2HD ARG 52 -2.567 -12.386 9.317 440 HD3 ARG 52 3HD ARG 52 -4.196 -11.726 9.085 441 HE ARG 52 HE ARG 52 -4.727 -14.335 9.282 442 HH11 ARG 52 1HH1 ARG 52 -2.687 -12.316 11.322 443 HH12 ARG 52 2HH1 ARG 52 -2.972 -13.275 12.739 444 HH21 ARG 52 1HH2 ARG 52 -5.089 -15.551 11.118 445 HH22 ARG 52 2HH2 ARG 52 -4.340 -15.119 12.624 446 HA PRO 53 HA PRO 53 -1.907 -9.164 2.388 447 HB2 PRO 53 2HB PRO 53 -3.852 -7.230 2.779 448 HB3 PRO 53 3HB PRO 53 -4.046 -8.591 1.654 449 HG2 PRO 53 2HG PRO 53 -5.088 -8.308 4.459 450 HG3 PRO 53 3HG PRO 53 -5.921 -8.912 3.007 451 HD2 PRO 53 2HD PRO 53 -4.892 -10.607 4.848 452 HD3 PRO 53 3HD PRO 53 -4.892 -11.006 3.116 453 H ILE 54 H ILE 54 -0.893 -7.113 2.742 454 HA ILE 54 HA ILE 54 -0.706 -6.149 5.531 455 HB ILE 54 HB ILE 54 1.276 -7.528 5.163 456 HG12 ILE 54 2HG1 ILE 54 1.980 -4.559 5.106 457 HG13 ILE 54 3HG1 ILE 54 1.504 -5.469 6.535 458 HG21 ILE 54 1HG2 ILE 54 2.965 -7.055 3.428 459 HG22 ILE 54 2HG2 ILE 54 1.927 -5.794 2.755 460 HG23 ILE 54 3HG2 ILE 54 1.408 -7.481 2.707 461 HD11 ILE 54 3HD1 ILE 54 3.872 -5.118 6.491 462 HD12 ILE 54 1HD1 ILE 54 4.000 -5.879 4.908 463 HD13 ILE 54 2HD1 ILE 54 3.520 -6.835 6.314 464 H VAL 55 H VAL 55 -0.701 -3.957 5.739 465 HA VAL 55 HA VAL 55 -1.166 -2.404 3.271 466 HB VAL 55 HB VAL 55 -2.240 -1.674 6.031 467 HG11 VAL 55 1HG1 VAL 55 -3.147 -0.929 3.225 468 HG12 VAL 55 2HG1 VAL 55 -2.251 0.112 4.335 469 HG13 VAL 55 3HG1 VAL 55 -3.898 -0.388 4.731 470 HG21 VAL 55 3HG2 VAL 55 -3.092 -3.922 5.556 471 HG22 VAL 55 1HG2 VAL 55 -3.630 -3.410 3.957 472 HG23 VAL 55 2HG2 VAL 55 -4.392 -2.740 5.398 473 H ILE 56 H ILE 56 0.585 -1.173 2.817 474 HA ILE 56 HA ILE 56 2.395 -0.284 4.971 475 HB ILE 56 HB ILE 56 2.856 -0.211 1.946 476 HG12 ILE 56 2HG1 ILE 56 2.575 -2.560 2.675 477 HG13 ILE 56 3HG1 ILE 56 4.260 -2.256 2.266 478 HG21 ILE 56 1HG2 ILE 56 5.258 0.036 2.546 479 HG22 ILE 56 2HG2 ILE 56 4.823 0.093 4.256 480 HG23 ILE 56 3HG2 ILE 56 4.289 1.374 3.166 481 HD11 ILE 56 3HD1 ILE 56 3.087 -2.427 5.041 482 HD12 ILE 56 1HD1 ILE 56 4.774 -2.039 4.675 483 HD13 ILE 56 2HD1 ILE 56 4.113 -3.612 4.238 484 H PHE 57 H PHE 57 2.145 1.769 5.697 485 HA PHE 57 HA PHE 57 0.731 3.765 4.080 486 HB2 PHE 57 2HB PHE 57 1.366 3.603 7.045 487 HB3 PHE 57 3HB PHE 57 0.752 5.079 6.299 488 HD1 PHE 57 HD2 PHE 57 -0.055 1.456 6.819 489 HD2 PHE 57 HD1 PHE 57 -1.566 5.352 5.884 490 HE1 PHE 57 HE2 PHE 57 -2.356 0.609 6.923 491 HE2 PHE 57 HE1 PHE 57 -3.861 4.482 6.004 492 HZ PHE 57 HZ PHE 57 -4.248 2.114 6.502 493 H ILE 58 H ILE 58 1.849 5.004 2.893 494 HA ILE 58 HA ILE 58 4.526 6.031 3.627 495 HB ILE 58 HB ILE 58 3.481 5.299 0.842 496 HG12 ILE 58 2HG1 ILE 58 4.012 3.282 2.285 497 HG13 ILE 58 3HG1 ILE 58 5.001 3.395 0.837 498 HG21 ILE 58 1HG2 ILE 58 5.767 5.742 0.050 499 HG22 ILE 58 2HG2 ILE 58 6.222 6.285 1.664 500 HG23 ILE 58 3HG2 ILE 58 5.015 7.180 0.740 501 HD11 ILE 58 3HD1 ILE 58 6.296 2.678 2.744 502 HD12 ILE 58 1HD1 ILE 58 5.859 4.136 3.630 503 HD13 ILE 58 2HD1 ILE 58 6.865 4.248 2.181 504 H ARG 59 H ARG 59 4.850 8.271 3.039 505 HA ARG 59 HA ARG 59 2.402 9.779 2.294 506 HB2 ARG 59 2HB ARG 59 3.932 10.197 4.453 507 HB3 ARG 59 3HB ARG 59 4.921 11.113 3.322 508 HG2 ARG 59 2HG ARG 59 2.978 12.555 2.803 509 HG3 ARG 59 3HG ARG 59 1.982 11.610 3.917 510 HD2 ARG 59 2HD ARG 59 4.406 13.295 4.624 511 HD3 ARG 59 3HD ARG 59 2.721 13.646 5.023 512 HE ARG 59 HE ARG 59 2.838 11.457 6.332 513 HH11 ARG 59 1HH1 ARG 59 5.625 13.585 5.991 514 HH12 ARG 59 2HH1 ARG 59 6.348 13.068 7.481 515 HH21 ARG 59 1HH2 ARG 59 3.766 10.808 8.261 516 HH22 ARG 59 2HH2 ARG 59 5.279 11.479 8.780 517 H GLY 60 H GLY 60 2.901 11.799 0.895 518 HA2 GLY 60 2HA GLY 60 3.500 10.852 -1.663 519 HA3 GLY 60 3HA GLY 60 3.313 12.535 -1.234 520 H ALA 61 H ALA 61 5.613 12.606 0.545 521 HA ALA 61 HA ALA 61 7.726 13.149 -1.306 522 HB1 ALA 61 3HB ALA 61 7.456 14.413 0.791 523 HB2 ALA 61 1HB ALA 61 9.054 13.658 0.725 524 HB3 ALA 61 2HB ALA 61 7.778 12.959 1.730 525 H TYR 62 H TYR 62 6.988 10.580 0.941 526 HA TYR 62 HA TYR 62 9.456 9.131 0.659 527 HB2 TYR 62 2HB TYR 62 6.848 8.277 1.991 528 HB3 TYR 62 3HB TYR 62 8.415 7.489 2.174 529 HD1 TYR 62 HD2 TYR 62 10.362 9.375 2.811 530 HD2 TYR 62 HD1 TYR 62 6.238 9.558 3.880 531 HE1 TYR 62 HE2 TYR 62 10.910 10.890 4.662 532 HE2 TYR 62 HE1 TYR 62 6.779 11.083 5.728 533 HH TYR 62 HH TYR 62 9.763 12.646 5.983 534 H GLU 63 H GLU 63 6.488 9.234 -1.092 535 HA GLU 63 HA GLU 63 5.843 6.631 -1.716 536 HB2 GLU 63 2HB GLU 63 4.415 8.536 -2.209 537 HB3 GLU 63 3HB GLU 63 5.540 9.119 -3.436 538 HG2 GLU 63 2HG GLU 63 5.080 6.950 -4.703 539 HG3 GLU 63 3HG GLU 63 3.794 6.640 -3.540 540 H GLU 64 H GLU 64 8.401 8.518 -3.246 541 HA GLU 64 HA GLU 64 8.765 6.902 -5.522 542 HB2 GLU 64 2HB GLU 64 10.920 8.049 -5.758 543 HB3 GLU 64 3HB GLU 64 9.610 9.159 -5.409 544 HG2 GLU 64 2HG GLU 64 11.043 10.076 -3.910 545 HG3 GLU 64 3HG GLU 64 10.581 8.732 -2.870 546 H VAL 65 H VAL 65 9.898 6.526 -2.231 547 HA VAL 65 HA VAL 65 11.828 4.474 -2.557 548 HB VAL 65 HB VAL 65 10.074 4.978 -0.102 549 HG11 VAL 65 1HG1 VAL 65 12.744 3.564 -0.322 550 HG12 VAL 65 2HG1 VAL 65 11.191 2.807 0.025 551 HG13 VAL 65 3HG1 VAL 65 11.903 3.926 1.189 552 HG21 VAL 65 3HG2 VAL 65 11.259 7.037 -0.750 553 HG22 VAL 65 1HG2 VAL 65 12.792 6.162 -0.758 554 HG23 VAL 65 2HG2 VAL 65 11.913 6.388 0.758 555 H VAL 66 H VAL 66 8.307 4.391 -2.463 556 HA VAL 66 HA VAL 66 7.800 1.735 -1.750 557 HB VAL 66 HB VAL 66 6.191 3.395 -3.745 558 HG11 VAL 66 1HG1 VAL 66 5.566 1.015 -3.905 559 HG12 VAL 66 2HG1 VAL 66 4.260 1.938 -3.156 560 HG13 VAL 66 3HG1 VAL 66 5.323 0.940 -2.157 561 HG21 VAL 66 3HG2 VAL 66 6.442 4.538 -1.594 562 HG22 VAL 66 1HG2 VAL 66 5.856 3.107 -0.744 563 HG23 VAL 66 2HG2 VAL 66 4.775 4.003 -1.816 564 H ARG 67 H ARG 67 8.956 3.030 -4.821 565 HA ARG 67 HA ARG 67 8.425 0.917 -6.575 566 HB2 ARG 67 2HB ARG 67 9.380 3.189 -7.194 567 HB3 ARG 67 3HB ARG 67 10.946 2.638 -6.605 568 HG2 ARG 67 2HG ARG 67 10.865 0.792 -8.319 569 HG3 ARG 67 3HG ARG 67 9.375 1.505 -8.946 570 HD2 ARG 67 2HD ARG 67 11.292 2.196 -10.301 571 HD3 ARG 67 3HD ARG 67 10.601 3.590 -9.471 572 HE ARG 67 HE ARG 67 12.487 3.731 -8.114 573 HH11 ARG 67 1HH1 ARG 67 12.802 0.972 -10.270 574 HH12 ARG 67 2HH1 ARG 67 14.499 0.791 -9.980 575 HH21 ARG 67 1HH2 ARG 67 14.720 3.475 -7.738 576 HH22 ARG 67 2HH2 ARG 67 15.589 2.208 -8.542 577 H ASP 68 H ASP 68 11.041 1.351 -4.237 578 HA ASP 68 HA ASP 68 12.618 -0.928 -4.917 579 HB2 ASP 68 2HB ASP 68 12.442 0.535 -2.250 580 HB3 ASP 68 3HB ASP 68 13.726 -0.571 -2.742 581 H ILE 69 H ILE 69 10.034 -0.362 -2.569 582 HA ILE 69 HA ILE 69 9.944 -2.892 -1.304 583 HB ILE 69 HB ILE 69 7.677 -0.906 -1.835 584 HG12 ILE 69 2HG1 ILE 69 9.440 -1.163 0.654 585 HG13 ILE 69 3HG1 ILE 69 9.643 0.064 -0.592 586 HG21 ILE 69 1HG2 ILE 69 6.499 -1.949 0.076 587 HG22 ILE 69 2HG2 ILE 69 7.779 -3.155 0.206 588 HG23 ILE 69 3HG2 ILE 69 6.760 -3.105 -1.233 589 HD11 ILE 69 3HD1 ILE 69 7.411 0.950 -0.058 590 HD12 ILE 69 1HD1 ILE 69 8.510 0.985 1.320 591 HD13 ILE 69 2HD1 ILE 69 7.256 -0.251 1.228 592 H VAL 70 H VAL 70 8.494 -1.610 -4.241 593 HA VAL 70 HA VAL 70 6.871 -3.812 -4.990 594 HB VAL 70 HB VAL 70 8.001 -1.476 -6.608 595 HG11 VAL 70 1HG1 VAL 70 7.573 -3.343 -8.159 596 HG12 VAL 70 2HG1 VAL 70 6.399 -2.049 -8.402 597 HG13 VAL 70 3HG1 VAL 70 5.935 -3.508 -7.522 598 HG21 VAL 70 3HG2 VAL 70 5.689 -0.583 -6.479 599 HG22 VAL 70 1HG2 VAL 70 6.365 -0.846 -4.867 600 HG23 VAL 70 2HG2 VAL 70 5.200 -1.991 -5.532 601 H GLU 71 H GLU 71 10.288 -2.944 -5.655 602 HA GLU 71 HA GLU 71 10.912 -4.828 -7.635 603 HB2 GLU 71 2HB GLU 71 12.715 -3.847 -5.380 604 HB3 GLU 71 3HB GLU 71 13.269 -4.734 -6.794 605 HG2 GLU 71 2HG GLU 71 12.459 -2.838 -8.223 606 HG3 GLU 71 3HG GLU 71 12.090 -1.945 -6.745 607 H TYR 72 H TYR 72 11.175 -5.135 -4.087 608 HA TYR 72 HA TYR 72 11.972 -7.836 -3.917 609 HB2 TYR 72 2HB TYR 72 12.168 -6.288 -2.017 610 HB3 TYR 72 3HB TYR 72 10.423 -6.097 -1.943 611 HD1 TYR 72 HD1 TYR 72 13.233 -8.444 -1.258 612 HD2 TYR 72 HD2 TYR 72 9.025 -7.775 -0.803 613 HE1 TYR 72 HE1 TYR 72 13.106 -10.289 0.358 614 HE2 TYR 72 HE2 TYR 72 8.909 -9.628 0.809 615 HH TYR 72 HH TYR 72 10.199 -11.669 1.349 616 H ALA 73 H ALA 73 8.805 -6.291 -3.922 617 HA ALA 73 HA ALA 73 7.224 -8.555 -3.354 618 HB1 ALA 73 3HB ALA 73 6.472 -6.230 -3.026 619 HB2 ALA 73 1HB ALA 73 5.342 -7.147 -4.027 620 HB3 ALA 73 2HB ALA 73 6.452 -5.993 -4.776 621 H GLN 74 H GLN 74 8.483 -7.245 -6.376 622 HA GLN 74 HA GLN 74 7.046 -8.949 -8.168 623 HB2 GLN 74 2HB GLN 74 9.619 -7.339 -8.495 624 HB3 GLN 74 3HB GLN 74 8.921 -8.282 -9.809 625 HG2 GLN 74 2HG GLN 74 6.959 -6.899 -9.881 626 HG3 GLN 74 3HG GLN 74 7.395 -6.085 -8.380 627 HE21 GLN 74 1HE2 GLN 74 6.859 -4.941 -11.073 628 HE22 GLN 74 2HE2 GLN 74 8.264 -4.016 -11.460 629 H LYS 75 H LYS 75 10.136 -9.204 -6.403 630 HA LYS 75 HA LYS 75 11.194 -11.504 -7.692 631 HB2 LYS 75 2HB LYS 75 11.636 -10.704 -4.774 632 HB3 LYS 75 3HB LYS 75 12.645 -11.806 -5.712 633 HG2 LYS 75 2HG LYS 75 12.311 -8.830 -6.143 634 HG3 LYS 75 3HG LYS 75 13.730 -9.647 -5.484 635 HD2 LYS 75 2HD LYS 75 14.022 -10.802 -7.707 636 HD3 LYS 75 3HD LYS 75 12.667 -9.858 -8.337 637 HE2 LYS 75 2HE LYS 75 13.921 -7.773 -7.870 638 HE3 LYS 75 3HE LYS 75 15.280 -8.728 -7.267 639 HZ1 LYS 75 3HZ LYS 75 15.616 -9.639 -9.419 640 HZ2 LYS 75 1HZ LYS 75 15.512 -7.963 -9.588 641 HZ3 LYS 75 2HZ LYS 75 14.203 -8.938 -10.020 642 H GLU 76 H GLU 76 9.130 -11.099 -4.851 643 HA GLU 76 HA GLU 76 9.040 -13.929 -4.242 644 HB2 GLU 76 2HB GLU 76 7.649 -11.553 -2.917 645 HB3 GLU 76 3HB GLU 76 7.674 -13.203 -2.288 646 HG2 GLU 76 2HG GLU 76 10.013 -11.300 -2.585 647 HG3 GLU 76 3HG GLU 76 9.314 -11.921 -1.091 648 H GLY 77 H GLY 77 7.434 -12.174 -6.527 649 HA2 GLY 77 2HA GLY 77 5.687 -12.679 -7.917 650 HA3 GLY 77 3HA GLY 77 5.635 -14.268 -7.170 651 H LEU 78 H LEU 78 5.107 -11.049 -5.814 652 HA LEU 78 HA LEU 78 2.766 -12.013 -4.366 653 HB2 LEU 78 2HB LEU 78 4.216 -9.338 -4.170 654 HB3 LEU 78 3HB LEU 78 2.986 -9.940 -3.058 655 HG LEU 78 HG LEU 78 5.743 -11.168 -3.471 656 HD11 LEU 78 1HD1 LEU 78 4.673 -9.603 -1.112 657 HD12 LEU 78 2HD1 LEU 78 5.839 -9.019 -2.302 658 HD13 LEU 78 3HD1 LEU 78 6.265 -10.360 -1.246 659 HD21 LEU 78 3HD2 LEU 78 4.101 -12.886 -2.913 660 HD22 LEU 78 1HD2 LEU 78 3.550 -11.945 -1.521 661 HD23 LEU 78 2HD2 LEU 78 5.188 -12.607 -1.556 662 H ARG 79 H ARG 79 0.862 -10.776 -4.203 663 HA ARG 79 HA ARG 79 -0.075 -9.498 -6.634 664 HB2 ARG 79 2HB ARG 79 -1.381 -11.095 -4.939 665 HB3 ARG 79 3HB ARG 79 -1.618 -9.632 -4.001 666 HG2 ARG 79 2HG ARG 79 -2.520 -10.027 -6.875 667 HG3 ARG 79 3HG ARG 79 -3.550 -10.219 -5.458 668 HD2 ARG 79 2HD ARG 79 -3.404 -7.865 -4.945 669 HD3 ARG 79 3HD ARG 79 -2.152 -7.617 -6.169 670 HE ARG 79 HE ARG 79 -4.617 -8.678 -7.214 671 HH11 ARG 79 1HH1 ARG 79 -2.928 -5.691 -6.426 672 HH12 ARG 79 2HH1 ARG 79 -3.872 -4.750 -7.534 673 HH21 ARG 79 1HH2 ARG 79 -5.743 -7.439 -8.690 674 HH22 ARG 79 2HH2 ARG 79 -5.452 -5.732 -8.805 675 H VAL 80 H VAL 80 0.803 -7.438 -6.873 676 HA VAL 80 HA VAL 80 1.316 -5.801 -4.461 677 HB VAL 80 HB VAL 80 2.509 -5.239 -7.214 678 HG11 VAL 80 1HG1 VAL 80 2.628 -3.409 -5.561 679 HG12 VAL 80 2HG1 VAL 80 4.243 -4.033 -5.909 680 HG13 VAL 80 3HG1 VAL 80 3.427 -4.480 -4.407 681 HG21 VAL 80 3HG2 VAL 80 4.546 -6.478 -6.548 682 HG22 VAL 80 1HG2 VAL 80 3.143 -7.548 -6.667 683 HG23 VAL 80 2HG2 VAL 80 3.728 -7.033 -5.084 684 H LEU 81 H LEU 81 0.082 -4.106 -4.151 685 HA LEU 81 HA LEU 81 -1.435 -2.797 -6.305 686 HB2 LEU 81 2HB LEU 81 -2.837 -4.573 -5.269 687 HB3 LEU 81 3HB LEU 81 -2.560 -3.873 -3.687 688 HG LEU 81 HG LEU 81 -3.898 -1.927 -4.236 689 HD11 LEU 81 1HD1 LEU 81 -4.161 -3.048 -7.008 690 HD12 LEU 81 2HD1 LEU 81 -3.266 -1.604 -6.535 691 HD13 LEU 81 3HD1 LEU 81 -5.023 -1.638 -6.381 692 HD21 LEU 81 3HD2 LEU 81 -5.333 -4.455 -5.106 693 HD22 LEU 81 1HD2 LEU 81 -6.103 -2.964 -4.553 694 HD23 LEU 81 2HD2 LEU 81 -5.117 -3.908 -3.440 695 H VAL 82 H VAL 82 -0.585 -0.724 -6.147 696 HA VAL 82 HA VAL 82 -0.224 0.458 -3.444 697 HB VAL 82 HB VAL 82 0.701 1.526 -6.162 698 HG11 VAL 82 1HG1 VAL 82 0.331 3.368 -4.576 699 HG12 VAL 82 2HG1 VAL 82 2.060 3.154 -4.860 700 HG13 VAL 82 3HG1 VAL 82 1.331 2.558 -3.366 701 HG21 VAL 82 3HG2 VAL 82 2.981 0.872 -5.466 702 HG22 VAL 82 1HG2 VAL 82 1.913 -0.532 -5.549 703 HG23 VAL 82 2HG2 VAL 82 2.333 0.169 -3.983 704 H ILE 83 H ILE 83 -2.035 1.428 -2.734 705 HA ILE 83 HA ILE 83 -3.880 2.762 -4.633 706 HB ILE 83 HB ILE 83 -4.379 1.722 -1.805 707 HG12 ILE 83 2HG1 ILE 83 -5.537 0.733 -4.454 708 HG13 ILE 83 3HG1 ILE 83 -4.180 -0.027 -3.626 709 HG21 ILE 83 1HG2 ILE 83 -6.760 2.329 -2.149 710 HG22 ILE 83 2HG2 ILE 83 -6.353 3.064 -3.702 711 HG23 ILE 83 3HG2 ILE 83 -5.721 3.755 -2.206 712 HD11 ILE 83 3HD1 ILE 83 -5.591 -0.564 -1.742 713 HD12 ILE 83 1HD1 ILE 83 -6.259 -1.204 -3.241 714 HD13 ILE 83 2HD1 ILE 83 -6.972 0.235 -2.513 715 H LYS 84 H LYS 84 -3.538 4.931 -4.670 716 HA LYS 84 HA LYS 84 -2.590 6.302 -2.223 717 HB2 LYS 84 2HB LYS 84 -0.891 7.500 -3.616 718 HB3 LYS 84 3HB LYS 84 -0.593 5.773 -3.441 719 HG2 LYS 84 2HG LYS 84 -1.538 5.389 -5.704 720 HG3 LYS 84 3HG LYS 84 -1.764 7.138 -5.881 721 HD2 LYS 84 2HD LYS 84 0.746 7.382 -5.464 722 HD3 LYS 84 3HD LYS 84 0.857 5.622 -5.603 723 HE2 LYS 84 2HE LYS 84 0.052 5.709 -7.889 724 HE3 LYS 84 3HE LYS 84 -0.281 7.440 -7.738 725 HZ1 LYS 84 3HZ LYS 84 2.391 6.157 -7.635 726 HZ2 LYS 84 1HZ LYS 84 2.097 7.801 -7.382 727 HZ3 LYS 84 2HZ LYS 84 1.786 7.109 -8.889 728 H VAL 85 H VAL 85 -3.352 8.290 -1.936 729 HA VAL 85 HA VAL 85 -5.542 9.142 -3.637 730 HB VAL 85 HB VAL 85 -4.688 10.206 -0.895 731 HG11 VAL 85 1HG1 VAL 85 -6.069 11.814 -2.147 732 HG12 VAL 85 2HG1 VAL 85 -6.958 11.167 -0.766 733 HG13 VAL 85 3HG1 VAL 85 -7.309 10.580 -2.393 734 HG21 VAL 85 3HG2 VAL 85 -5.293 7.826 -0.707 735 HG22 VAL 85 1HG2 VAL 85 -6.835 8.134 -1.514 736 HG23 VAL 85 2HG2 VAL 85 -6.510 8.838 0.074 737 H ALA 86 H ALA 86 -4.793 10.300 -5.317 738 HA ALA 86 HA ALA 86 -2.800 12.397 -5.062 739 HB1 ALA 86 3HB ALA 86 -2.906 11.047 -7.117 740 HB2 ALA 86 1HB ALA 86 -3.199 12.753 -7.465 741 HB3 ALA 86 2HB ALA 86 -4.550 11.616 -7.419 742 H GLN 87 H GLN 87 -3.800 13.762 -3.533 743 HA GLN 87 HA GLN 87 -6.259 15.163 -4.041 744 HB2 GLN 87 2HB GLN 87 -3.867 15.861 -2.285 745 HB3 GLN 87 3HB GLN 87 -5.379 16.764 -2.288 746 HG2 GLN 87 2HG GLN 87 -5.133 13.830 -1.533 747 HG3 GLN 87 3HG GLN 87 -5.138 15.158 -0.374 748 HE21 GLN 87 1HE2 GLN 87 -7.083 16.308 -0.036 749 HE22 GLN 87 2HE2 GLN 87 -8.614 15.659 -0.492 750 H ASP 88 H ASP 88 -2.827 16.110 -4.223 751 HA ASP 88 HA ASP 88 -3.124 17.503 -6.738 752 HB2 ASP 88 2HB ASP 88 -3.863 19.286 -5.146 753 HB3 ASP 88 3HB ASP 88 -2.388 19.091 -4.214 754 H GLN 89 H GLN 89 -1.661 15.779 -7.255 755 HA GLN 89 HA GLN 89 1.151 16.205 -6.467 756 HB2 GLN 89 2HB GLN 89 -0.362 13.568 -6.197 757 HB3 GLN 89 3HB GLN 89 1.392 13.683 -6.182 758 HG2 GLN 89 2HG GLN 89 1.300 15.036 -4.130 759 HG3 GLN 89 3HG GLN 89 -0.461 14.950 -4.151 760 HE21 GLN 89 1HE2 GLN 89 2.485 13.083 -3.732 761 HE22 GLN 89 2HE2 GLN 89 1.751 11.745 -2.921 762 H GLU 90 H GLU 90 1.758 16.838 -8.486 763 HA GLU 90 HA GLU 90 1.133 15.444 -10.925 764 HB2 GLU 90 2HB GLU 90 1.674 17.888 -10.854 765 HB3 GLU 90 3HB GLU 90 3.326 17.502 -10.372 766 HG2 GLU 90 2HG GLU 90 3.546 16.210 -12.551 767 HG3 GLU 90 3HG GLU 90 1.981 16.869 -13.021 768 H LEU 91 H LEU 91 3.838 15.480 -8.643 769 HA LEU 91 HA LEU 91 5.749 14.015 -10.118 770 HB2 LEU 91 2HB LEU 91 5.405 14.404 -7.118 771 HB3 LEU 91 3HB LEU 91 6.759 13.520 -7.805 772 HG LEU 91 HG LEU 91 7.450 15.634 -9.029 773 HD11 LEU 91 1HD1 LEU 91 5.377 17.005 -7.296 774 HD12 LEU 91 2HD1 LEU 91 5.311 16.830 -9.050 775 HD13 LEU 91 3HD1 LEU 91 6.581 17.807 -8.313 776 HD21 LEU 91 3HD2 LEU 91 7.357 15.845 -6.002 777 HD22 LEU 91 1HD2 LEU 91 8.471 16.704 -7.071 778 HD23 LEU 91 2HD2 LEU 91 8.551 14.949 -6.943 779 H LEU 92 H LEU 92 3.133 13.076 -8.054 780 HA LEU 92 HA LEU 92 3.604 10.362 -7.630 781 HB2 LEU 92 2HB LEU 92 2.040 11.439 -6.281 782 HB3 LEU 92 3HB LEU 92 1.230 12.204 -7.621 783 HG LEU 92 HG LEU 92 0.928 9.220 -7.268 784 HD11 LEU 92 1HD1 LEU 92 -0.691 11.271 -5.719 785 HD12 LEU 92 2HD1 LEU 92 0.483 10.150 -5.027 786 HD13 LEU 92 3HD1 LEU 92 -0.986 9.528 -5.774 787 HD21 LEU 92 3HD2 LEU 92 -0.033 10.199 -9.297 788 HD22 LEU 92 1HD2 LEU 92 -0.922 11.388 -8.340 789 HD23 LEU 92 2HD2 LEU 92 -1.324 9.676 -8.223 790 H GLU 93 H GLU 93 2.276 12.025 -10.458 791 HA GLU 93 HA GLU 93 1.003 9.835 -11.733 792 HB2 GLU 93 2HB GLU 93 2.219 12.318 -13.014 793 HB3 GLU 93 3HB GLU 93 1.094 11.209 -13.803 794 HG2 GLU 93 2HG GLU 93 -0.658 11.825 -12.171 795 HG3 GLU 93 3HG GLU 93 0.469 12.940 -11.384 796 H ARG 94 H ARG 94 4.340 11.063 -11.895 797 HA ARG 94 HA ARG 94 5.308 9.485 -14.029 798 HB2 ARG 94 2HB ARG 94 6.538 11.437 -13.147 799 HB3 ARG 94 3HB ARG 94 6.793 10.610 -11.614 800 HG2 ARG 94 2HG ARG 94 8.140 8.868 -12.895 801 HG3 ARG 94 3HG ARG 94 8.008 9.914 -14.312 802 HD2 ARG 94 2HD ARG 94 10.155 10.253 -13.181 803 HD3 ARG 94 3HD ARG 94 9.171 11.716 -13.094 804 HE ARG 94 HE ARG 94 8.677 10.244 -10.775 805 HH11 ARG 94 1HH1 ARG 94 11.406 11.971 -12.193 806 HH12 ARG 94 2HH1 ARG 94 12.127 12.326 -10.655 807 HH21 ARG 94 1HH2 ARG 94 9.629 10.709 -8.782 808 HH22 ARG 94 2HH2 ARG 94 11.116 11.611 -8.717 809 H PHE 95 H PHE 95 5.276 8.958 -10.526 810 HA PHE 95 HA PHE 95 6.544 6.439 -10.452 811 HB2 PHE 95 2HB PHE 95 6.280 7.916 -8.463 812 HB3 PHE 95 3HB PHE 95 4.538 7.665 -8.498 813 HD1 PHE 95 HD2 PHE 95 7.804 6.018 -7.871 814 HD2 PHE 95 HD1 PHE 95 3.554 5.647 -7.527 815 HE1 PHE 95 HE2 PHE 95 8.071 4.027 -6.465 816 HE2 PHE 95 HE1 PHE 95 3.842 3.656 -6.121 817 HZ PHE 95 HZ PHE 95 6.102 2.846 -5.600 818 H TYR 96 H TYR 96 3.157 7.416 -10.655 819 HA TYR 96 HA TYR 96 1.859 4.949 -10.378 820 HB2 TYR 96 2HB TYR 96 0.636 7.034 -10.209 821 HB3 TYR 96 3HB TYR 96 1.114 7.524 -11.829 822 HD1 TYR 96 HD1 TYR 96 -0.807 4.835 -10.058 823 HD2 TYR 96 HD2 TYR 96 -0.431 7.195 -13.590 824 HE1 TYR 96 HE1 TYR 96 -2.900 3.899 -10.903 825 HE2 TYR 96 HE2 TYR 96 -2.527 6.256 -14.445 826 HH TYR 96 HH TYR 96 -4.686 4.473 -12.507 827 H GLU 97 H GLU 97 2.910 6.688 -13.284 828 HA GLU 97 HA GLU 97 1.868 4.940 -15.245 829 HB2 GLU 97 2HB GLU 97 2.416 7.347 -15.588 830 HB3 GLU 97 3HB GLU 97 4.136 6.974 -15.445 831 HG2 GLU 97 2HG GLU 97 4.035 5.626 -17.491 832 HG3 GLU 97 3HG GLU 97 2.293 5.888 -17.607 833 H GLN 98 H GLN 98 4.906 5.064 -13.508 834 HA GLN 98 HA GLN 98 6.463 3.328 -15.101 835 HB2 GLN 98 2HB GLN 98 7.470 4.824 -13.428 836 HB3 GLN 98 3HB GLN 98 6.653 3.964 -12.129 837 HG2 GLN 98 2HG GLN 98 9.059 3.375 -12.303 838 HG3 GLN 98 3HG GLN 98 8.012 1.976 -12.508 839 HE21 GLN 98 1HE2 GLN 98 7.928 0.950 -14.527 840 HE22 GLN 98 2HE2 GLN 98 9.058 1.286 -15.795 841 H LEU 99 H LEU 99 4.520 2.666 -12.135 842 HA LEU 99 HA LEU 99 5.079 -0.132 -12.067 843 HB2 LEU 99 2HB LEU 99 2.949 1.560 -10.726 844 HB3 LEU 99 3HB LEU 99 2.961 -0.185 -10.542 845 HG LEU 99 HG LEU 99 5.202 -0.074 -9.467 846 HD11 LEU 99 1HD1 LEU 99 6.111 1.911 -10.538 847 HD12 LEU 99 2HD1 LEU 99 6.164 2.092 -8.782 848 HD13 LEU 99 3HD1 LEU 99 4.917 2.923 -9.725 849 HD21 LEU 99 3HD2 LEU 99 3.202 -0.021 -8.062 850 HD22 LEU 99 1HD2 LEU 99 3.135 1.740 -8.185 851 HD23 LEU 99 2HD2 LEU 99 4.482 0.959 -7.348 852 H LYS 100 H LYS 100 2.539 1.788 -13.550 853 HA LYS 100 HA LYS 100 0.821 -0.285 -14.423 854 HB2 LYS 100 2HB LYS 100 1.327 2.487 -15.584 855 HB3 LYS 100 3HB LYS 100 -0.007 1.440 -16.066 856 HG2 LYS 100 2HG LYS 100 0.427 2.423 -13.226 857 HG3 LYS 100 3HG LYS 100 -0.586 3.268 -14.404 858 HD2 LYS 100 2HD LYS 100 -1.116 0.353 -13.697 859 HD3 LYS 100 3HD LYS 100 -1.723 1.660 -12.682 860 HE2 LYS 100 2HE LYS 100 -3.454 0.914 -14.236 861 HE3 LYS 100 3HE LYS 100 -2.984 2.573 -14.590 862 HZ1 LYS 100 3HZ LYS 100 -2.018 0.190 -16.073 863 HZ2 LYS 100 1HZ LYS 100 -1.708 1.807 -16.455 864 HZ3 LYS 100 2HZ LYS 100 -3.277 1.198 -16.579 865 H LYS 101 H LYS 101 3.822 1.025 -15.709 866 HA LYS 101 HA LYS 101 3.782 -0.340 -18.231 867 HB2 LYS 101 2HB LYS 101 5.164 1.656 -17.926 868 HB3 LYS 101 3HB LYS 101 6.073 0.883 -16.633 869 HG2 LYS 101 2HG LYS 101 6.999 -0.749 -18.252 870 HG3 LYS 101 3HG LYS 101 6.079 0.019 -19.550 871 HD2 LYS 101 2HD LYS 101 8.254 1.359 -17.896 872 HD3 LYS 101 3HD LYS 101 8.461 0.718 -19.526 873 HE2 LYS 101 2HE LYS 101 6.793 2.353 -20.365 874 HE3 LYS 101 3HE LYS 101 6.617 3.000 -18.731 875 HZ1 LYS 101 3HZ LYS 101 8.959 3.612 -18.773 876 HZ2 LYS 101 1HZ LYS 101 8.106 4.348 -20.035 877 HZ3 LYS 101 2HZ LYS 101 9.103 3.020 -20.351 878 H ASP 102 H ASP 102 5.299 -0.993 -15.046 879 HA ASP 102 HA ASP 102 6.677 -3.363 -15.671 880 HB2 ASP 102 2HB ASP 102 5.450 -2.420 -13.042 881 HB3 ASP 102 3HB ASP 102 6.443 -3.871 -13.154 882 H GLY 103 H GLY 103 3.312 -2.844 -14.747 883 HA2 GLY 103 2HA GLY 103 1.615 -4.484 -15.475 884 HA3 GLY 103 3HA GLY 103 2.721 -5.763 -14.981 885 H VAL 104 H VAL 104 3.329 -3.642 -12.728 886 HA VAL 104 HA VAL 104 1.867 -4.837 -10.624 887 HB VAL 104 HB VAL 104 3.455 -2.223 -10.727 888 HG11 VAL 104 1HG1 VAL 104 2.443 -3.715 -8.276 889 HG12 VAL 104 2HG1 VAL 104 1.895 -2.132 -8.829 890 HG13 VAL 104 3HG1 VAL 104 3.547 -2.338 -8.246 891 HG21 VAL 104 3HG2 VAL 104 5.271 -3.525 -9.700 892 HG22 VAL 104 1HG2 VAL 104 4.786 -4.249 -11.232 893 HG23 VAL 104 2HG2 VAL 104 4.267 -4.974 -9.706 894 H ASP 105 H ASP 105 -0.125 -4.374 -9.873 895 HA ASP 105 HA ASP 105 -1.817 -2.423 -11.088 896 HB2 ASP 105 2HB ASP 105 -2.542 -4.658 -9.983 897 HB3 ASP 105 3HB ASP 105 -2.381 -3.835 -8.451 898 H VAL 106 H VAL 106 -1.714 -0.322 -10.647 899 HA VAL 106 HA VAL 106 -1.559 0.585 -7.852 900 HB VAL 106 HB VAL 106 0.672 1.031 -8.685 901 HG11 VAL 106 1HG1 VAL 106 1.169 2.401 -10.663 902 HG12 VAL 106 2HG1 VAL 106 -0.552 2.462 -11.046 903 HG13 VAL 106 3HG1 VAL 106 0.305 0.919 -11.083 904 HG21 VAL 106 3HG2 VAL 106 0.850 3.472 -8.418 905 HG22 VAL 106 1HG2 VAL 106 -0.283 2.783 -7.252 906 HG23 VAL 106 2HG2 VAL 106 -0.889 3.635 -8.674 907 H ARG 107 H ARG 107 -3.064 2.053 -7.398 908 HA ARG 107 HA ARG 107 -4.770 3.144 -9.546 909 HB2 ARG 107 2HB ARG 107 -5.509 2.279 -6.713 910 HB3 ARG 107 3HB ARG 107 -6.598 3.121 -7.814 911 HG2 ARG 107 2HG ARG 107 -6.462 1.195 -9.388 912 HG3 ARG 107 3HG ARG 107 -5.429 0.346 -8.231 913 HD2 ARG 107 2HD ARG 107 -7.786 -0.380 -8.087 914 HD3 ARG 107 3HD ARG 107 -7.236 0.344 -6.576 915 HE ARG 107 HE ARG 107 -8.400 2.420 -7.944 916 HH11 ARG 107 1HH1 ARG 107 -9.562 -0.745 -6.912 917 HH12 ARG 107 2HH1 ARG 107 -11.202 -0.205 -6.757 918 HH21 ARG 107 1HH2 ARG 107 -10.544 3.090 -7.715 919 HH22 ARG 107 2HH2 ARG 107 -11.759 1.963 -7.210 920 H VAL 108 H VAL 108 -5.153 5.280 -9.489 921 HA VAL 108 HA VAL 108 -4.286 6.870 -7.150 922 HB VAL 108 HB VAL 108 -4.571 8.878 -8.703 923 HG11 VAL 108 1HG1 VAL 108 -2.499 6.796 -9.499 924 HG12 VAL 108 2HG1 VAL 108 -2.360 7.949 -8.170 925 HG13 VAL 108 3HG1 VAL 108 -2.395 8.528 -9.836 926 HG21 VAL 108 3HG2 VAL 108 -4.698 6.757 -10.899 927 HG22 VAL 108 1HG2 VAL 108 -4.521 8.497 -11.158 928 HG23 VAL 108 2HG2 VAL 108 -6.003 7.856 -10.450 929 H THR 109 H THR 109 -5.854 7.016 -5.767 930 HA THR 109 HA THR 109 -8.664 7.209 -6.580 931 HB THR 109 HB THR 109 -9.080 6.865 -4.075 932 HG1 THR 109 HG1 THR 109 -7.085 7.422 -3.226 933 HG21 THR 109 3HG2 THR 109 -9.274 4.969 -5.662 934 HG22 THR 109 1HG2 THR 109 -8.618 4.436 -4.113 935 HG23 THR 109 2HG2 THR 109 -7.545 4.649 -5.498 936 H ASP 110 H ASP 110 -8.343 9.378 -7.391 937 HA ASP 110 HA ASP 110 -7.741 11.621 -5.792 938 HB2 ASP 110 2HB ASP 110 -8.991 12.954 -7.473 939 HB3 ASP 110 3HB ASP 110 -7.914 11.803 -8.250 940 H ASN 111 H ASN 111 -10.638 9.680 -6.157 941 HA ASN 111 HA ASN 111 -12.266 11.129 -4.287 942 HB2 ASN 111 2HB ASN 111 -12.433 8.215 -5.171 943 HB3 ASN 111 3HB ASN 111 -13.689 9.097 -4.307 944 HD21 ASN 111 1HD2 ASN 111 -14.917 10.659 -5.446 945 HD22 ASN 111 2HD2 ASN 111 -14.914 10.733 -7.173 946 H GLU 112 H GLU 112 -11.039 11.483 -2.486 947 HA GLU 112 HA GLU 112 -9.414 9.658 -1.080 948 HB2 GLU 112 2HB GLU 112 -9.525 11.372 0.763 949 HB3 GLU 112 3HB GLU 112 -9.115 12.053 -0.811 950 HG2 GLU 112 2HG GLU 112 -11.570 12.666 -1.057 951 HG3 GLU 112 3HG GLU 112 -11.770 12.212 0.634 952 H ASP 113 H ASP 113 -12.832 10.451 -0.867 953 HA ASP 113 HA ASP 113 -13.571 9.031 1.459 954 HB2 ASP 113 2HB ASP 113 -15.108 10.655 0.562 955 HB3 ASP 113 3HB ASP 113 -15.109 9.895 -1.025 956 H GLU 114 H GLU 114 -13.462 8.101 -1.980 957 HA GLU 114 HA GLU 114 -14.463 5.465 -1.707 958 HB2 GLU 114 2HB GLU 114 -14.359 6.675 -3.891 959 HB3 GLU 114 3HB GLU 114 -12.602 6.542 -3.868 960 HG2 GLU 114 2HG GLU 114 -12.973 3.989 -3.753 961 HG3 GLU 114 3HG GLU 114 -14.648 4.328 -4.173 962 H ALA 115 H ALA 115 -11.168 6.828 -1.581 963 HA ALA 115 HA ALA 115 -9.641 4.491 -1.622 964 HB1 ALA 115 3HB ALA 115 -8.696 6.758 -1.787 965 HB2 ALA 115 1HB ALA 115 -7.890 5.819 -0.529 966 HB3 ALA 115 2HB ALA 115 -9.081 7.051 -0.089 967 H LYS 116 H LYS 116 -11.002 6.238 1.143 968 HA LYS 116 HA LYS 116 -10.332 4.563 3.267 969 HB2 LYS 116 2HB LYS 116 -11.196 6.837 3.542 970 HB3 LYS 116 3HB LYS 116 -12.727 6.408 2.802 971 HG2 LYS 116 2HG LYS 116 -11.864 5.044 5.350 972 HG3 LYS 116 3HG LYS 116 -12.514 6.683 5.423 973 HD2 LYS 116 2HD LYS 116 -14.623 5.918 4.405 974 HD3 LYS 116 3HD LYS 116 -13.967 4.295 4.200 975 HE2 LYS 116 2HE LYS 116 -13.789 4.083 6.672 976 HE3 LYS 116 3HE LYS 116 -14.525 5.678 6.843 977 HZ1 LYS 116 3HZ LYS 116 -16.504 4.847 5.748 978 HZ2 LYS 116 1HZ LYS 116 -16.141 3.908 7.105 979 HZ3 LYS 116 2HZ LYS 116 -15.799 3.323 5.556 980 H LYS 117 H LYS 117 -13.151 4.477 1.102 981 HA LYS 117 HA LYS 117 -14.512 2.274 2.240 982 HB2 LYS 117 2HB LYS 117 -14.560 3.504 -0.543 983 HB3 LYS 117 3HB LYS 117 -15.595 2.147 -0.115 984 HG2 LYS 117 2HG LYS 117 -16.686 3.482 1.617 985 HG3 LYS 117 3HG LYS 117 -15.615 4.849 1.271 986 HD2 LYS 117 2HD LYS 117 -16.601 5.241 -0.851 987 HD3 LYS 117 3HD LYS 117 -17.351 3.643 -0.907 988 HE2 LYS 117 2HE LYS 117 -18.991 5.461 -0.522 989 HE3 LYS 117 3HE LYS 117 -18.963 4.293 0.797 990 HZ1 LYS 117 3HZ LYS 117 -17.560 6.901 0.834 991 HZ2 LYS 117 1HZ LYS 117 -17.687 5.808 2.109 992 HZ3 LYS 117 2HZ LYS 117 -19.061 6.610 1.545 993 H ARG 118 H ARG 118 -11.986 2.468 -0.260 994 HA ARG 118 HA ARG 118 -12.371 -0.126 -1.357 995 HB2 ARG 118 2HB ARG 118 -9.993 1.765 -1.624 996 HB3 ARG 118 3HB ARG 118 -10.137 0.248 -2.502 997 HG2 ARG 118 2HG ARG 118 -12.027 2.608 -2.768 998 HG3 ARG 118 3HG ARG 118 -10.716 2.224 -3.876 999 HD2 ARG 118 2HD ARG 118 -12.709 1.463 -4.910 1000 HD3 ARG 118 3HD ARG 118 -11.896 0.013 -4.327 1001 HE ARG 118 HE ARG 118 -13.654 0.622 -2.324 1002 HH11 ARG 118 1HH1 ARG 118 -14.114 0.173 -5.762 1003 HH12 ARG 118 2HH1 ARG 118 -15.726 -0.432 -5.595 1004 HH21 ARG 118 1HH2 ARG 118 -15.729 -0.276 -2.140 1005 HH22 ARG 118 2HH2 ARG 118 -16.632 -0.682 -3.557 1006 H LEU 119 H LEU 119 -10.293 1.180 1.175 1007 HA LEU 119 HA LEU 119 -8.525 -0.968 1.518 1008 HB2 LEU 119 2HB LEU 119 -9.585 0.993 3.590 1009 HB3 LEU 119 3HB LEU 119 -8.224 -0.096 3.856 1010 HG LEU 119 HG LEU 119 -8.344 2.186 1.851 1011 HD11 LEU 119 1HD1 LEU 119 -8.016 2.932 4.144 1012 HD12 LEU 119 2HD1 LEU 119 -6.555 3.170 3.189 1013 HD13 LEU 119 3HD1 LEU 119 -6.649 1.827 4.333 1014 HD21 LEU 119 3HD2 LEU 119 -7.119 0.317 0.858 1015 HD22 LEU 119 1HD2 LEU 119 -6.109 0.179 2.302 1016 HD23 LEU 119 2HD2 LEU 119 -6.013 1.618 1.283 1017 H LYS 120 H LYS 120 -11.601 -0.295 3.203 1018 HA LYS 120 HA LYS 120 -11.729 -2.698 4.674 1019 HB2 LYS 120 2HB LYS 120 -13.129 -0.731 5.204 1020 HB3 LYS 120 3HB LYS 120 -13.997 -0.915 3.681 1021 HG2 LYS 120 2HG LYS 120 -14.875 -3.103 4.435 1022 HG3 LYS 120 3HG LYS 120 -13.984 -2.938 5.951 1023 HD2 LYS 120 2HD LYS 120 -15.350 -0.979 6.565 1024 HD3 LYS 120 3HD LYS 120 -16.198 -1.060 5.014 1025 HE2 LYS 120 2HE LYS 120 -17.124 -3.254 5.612 1026 HE3 LYS 120 3HE LYS 120 -16.233 -3.235 7.135 1027 HZ1 LYS 120 3HZ LYS 120 -18.515 -2.607 7.470 1028 HZ2 LYS 120 1HZ LYS 120 -18.385 -1.350 6.349 1029 HZ3 LYS 120 2HZ LYS 120 -17.510 -1.288 7.792 1030 H GLU 121 H GLU 121 -12.864 -1.830 1.436 1031 HA GLU 121 HA GLU 121 -14.403 -4.063 0.757 1032 HB2 GLU 121 2HB GLU 121 -14.323 -1.892 -0.496 1033 HB3 GLU 121 3HB GLU 121 -12.720 -2.304 -1.079 1034 HG2 GLU 121 2HG GLU 121 -14.408 -2.686 -2.806 1035 HG3 GLU 121 3HG GLU 121 -13.625 -4.198 -2.334 1036 H LEU 122 H LEU 122 -10.906 -3.530 0.592 1037 HA LEU 122 HA LEU 122 -10.171 -5.922 -0.786 1038 HB2 LEU 122 2HB LEU 122 -8.520 -4.375 1.255 1039 HB3 LEU 122 3HB LEU 122 -7.901 -5.522 0.072 1040 HG LEU 122 HG LEU 122 -9.195 -2.871 -0.619 1041 HD11 LEU 122 1HD1 LEU 122 -7.120 -2.502 0.583 1042 HD12 LEU 122 2HD1 LEU 122 -6.966 -2.056 -1.109 1043 HD13 LEU 122 3HD1 LEU 122 -6.266 -3.566 -0.535 1044 HD21 LEU 122 3HD2 LEU 122 -8.304 -3.241 -2.874 1045 HD22 LEU 122 1HD2 LEU 122 -9.442 -4.505 -2.411 1046 HD23 LEU 122 2HD2 LEU 122 -7.706 -4.830 -2.385 1047 H LEU 123 H LEU 123 -10.278 -5.005 2.664 1048 HA LEU 123 HA LEU 123 -9.127 -7.350 3.719 1049 HB2 LEU 123 2HB LEU 123 -10.647 -5.019 4.860 1050 HB3 LEU 123 3HB LEU 123 -10.420 -6.424 5.889 1051 HG LEU 123 HG LEU 123 -7.984 -6.216 5.725 1052 HD11 LEU 123 1HD1 LEU 123 -8.385 -3.732 4.055 1053 HD12 LEU 123 2HD1 LEU 123 -7.747 -5.267 3.474 1054 HD13 LEU 123 3HD1 LEU 123 -6.849 -4.342 4.677 1055 HD21 LEU 123 3HD2 LEU 123 -9.380 -3.658 6.511 1056 HD22 LEU 123 1HD2 LEU 123 -7.761 -4.152 7.021 1057 HD23 LEU 123 2HD2 LEU 123 -9.159 -5.098 7.511 1058 H GLU 124 H GLU 124 -12.534 -6.433 3.358 1059 HA GLU 124 HA GLU 124 -13.710 -8.618 4.697 1060 HB2 GLU 124 2HB GLU 124 -14.835 -6.936 2.422 1061 HB3 GLU 124 3HB GLU 124 -15.788 -7.987 3.467 1062 HG2 GLU 124 2HG GLU 124 -14.267 -5.504 4.331 1063 HG3 GLU 124 3HG GLU 124 -16.005 -5.614 4.088 1064 H LYS 125 H LYS 125 -12.269 -8.355 1.563 1065 HA LYS 125 HA LYS 125 -13.304 -11.001 0.703 1066 HB2 LYS 125 2HB LYS 125 -13.882 -8.956 -0.675 1067 HB3 LYS 125 3HB LYS 125 -12.171 -8.742 -1.017 1068 HG2 LYS 125 2HG LYS 125 -12.088 -10.751 -2.328 1069 HG3 LYS 125 3HG LYS 125 -13.665 -11.284 -1.747 1070 HD2 LYS 125 2HD LYS 125 -13.161 -8.871 -3.542 1071 HD3 LYS 125 3HD LYS 125 -13.782 -10.438 -4.072 1072 HE2 LYS 125 2HE LYS 125 -15.756 -10.108 -2.547 1073 HE3 LYS 125 3HE LYS 125 -15.148 -8.491 -2.178 1074 HZ1 LYS 125 3HZ LYS 125 -15.962 -9.474 -4.862 1075 HZ2 LYS 125 1HZ LYS 125 -15.363 -7.932 -4.521 1076 HZ3 LYS 125 2HZ LYS 125 -16.843 -8.425 -3.874 1077 H VAL 126 H VAL 126 -10.637 -9.569 2.068 1078 HA VAL 126 HA VAL 126 -8.495 -10.095 2.489 1079 HB VAL 126 HB VAL 126 -8.837 -12.655 0.846 1080 HG11 VAL 126 1HG1 VAL 126 -7.000 -13.582 2.212 1081 HG12 VAL 126 2HG1 VAL 126 -6.821 -12.026 3.029 1082 HG13 VAL 126 3HG1 VAL 126 -6.472 -12.161 1.307 1083 HG21 VAL 126 3HG2 VAL 126 -10.555 -12.588 2.614 1084 HG22 VAL 126 1HG2 VAL 126 -9.320 -12.259 3.833 1085 HG23 VAL 126 2HG2 VAL 126 -9.344 -13.814 2.995 1086 H GLY 127 H GLY 127 -9.619 -9.240 -0.478 1087 HA2 GLY 127 2HA GLY 127 -7.559 -7.714 -1.353 1088 HA3 GLY 127 3HA GLY 127 -7.182 -9.285 -2.051 1089 H SER 128 H SER 128 -8.097 -6.649 -3.299 1090 HA SER 128 HA SER 128 -10.102 -7.736 -5.135 1091 HB2 SER 128 2HB SER 128 -10.667 -5.180 -3.541 1092 HB3 SER 128 3HB SER 128 -11.674 -5.837 -4.836 1093 HG SER 128 HG SER 128 -11.429 -7.805 -3.205 1094 H LEU 129 H LEU 129 -10.601 -6.104 -6.925 1095 HA LEU 129 HA LEU 129 -8.829 -3.869 -7.361 1096 HB2 LEU 129 2HB LEU 129 -7.746 -4.610 -9.381 1097 HB3 LEU 129 3HB LEU 129 -7.389 -5.773 -8.123 1098 HG LEU 129 HG LEU 129 -9.483 -6.251 -10.302 1099 HD11 LEU 129 1HD1 LEU 129 -7.273 -6.024 -11.339 1100 HD12 LEU 129 2HD1 LEU 129 -7.840 -7.689 -11.420 1101 HD13 LEU 129 3HD1 LEU 129 -6.609 -7.235 -10.238 1102 HD21 LEU 129 3HD2 LEU 129 -9.325 -8.624 -9.647 1103 HD22 LEU 129 1HD2 LEU 129 -9.858 -7.624 -8.296 1104 HD23 LEU 129 2HD2 LEU 129 -8.192 -8.205 -8.358 1105 H GLU 130 H GLU 130 -9.393 -2.626 -9.271 1106 HA GLU 130 HA GLU 130 -11.906 -3.285 -10.687 1107 HB2 GLU 130 2HB GLU 130 -11.268 -0.549 -9.445 1108 HB3 GLU 130 3HB GLU 130 -12.636 -0.887 -10.508 1109 HG2 GLU 130 2HG GLU 130 -13.491 -2.499 -8.798 1110 HG3 GLU 130 3HG GLU 130 -12.182 -2.004 -7.727 1111 H HIS 131 H HIS 131 -12.064 -2.274 -12.757 1112 HA HIS 131 HA HIS 131 -9.704 -0.812 -13.770 1113 HB2 HIS 131 2HB HIS 131 -9.730 -3.324 -14.412 1114 HB3 HIS 131 3HB HIS 131 -11.136 -2.959 -15.406 1115 HD1 HIS 131 HD1 HIS 131 -7.513 -3.004 -15.459 1116 HD2 HIS 131 HD2 HIS 131 -10.483 -0.994 -17.556 1117 HE1 HIS 131 HE1 HIS 131 -6.406 -2.150 -17.538 1118 HE2 HIS 131 HE2 HIS 131 -8.226 -0.964 -18.807 1119 H HIS 132 H HIS 132 -10.915 1.080 -13.525 1120 HA HIS 132 HA HIS 132 -13.476 1.375 -14.958 1121 HB2 HIS 132 2HB HIS 132 -12.088 3.124 -12.875 1122 HB3 HIS 132 3HB HIS 132 -13.562 3.596 -13.712 1123 HD1 HIS 132 HD1 HIS 132 -13.993 3.590 -10.877 1124 HD2 HIS 132 HD2 HIS 132 -14.220 0.023 -12.994 1125 HE1 HIS 132 HE1 HIS 132 -15.417 2.069 -9.483 1126 HE2 HIS 132 HE2 HIS 132 -15.378 -0.130 -10.698 1127 H HIS 133 H HIS 133 -13.838 3.211 -16.323 1128 HA HIS 133 HA HIS 133 -11.427 4.403 -17.585 1129 HB2 HIS 133 2HB HIS 133 -13.987 3.455 -18.958 1130 HB3 HIS 133 3HB HIS 133 -12.702 4.361 -19.758 1131 HD1 HIS 133 HD1 HIS 133 -13.732 0.939 -18.932 1132 HD2 HIS 133 HD2 HIS 133 -10.183 2.870 -19.902 1133 HE1 HIS 133 HE1 HIS 133 -12.124 -0.878 -19.567 1134 HE2 HIS 133 HE2 HIS 133 -10.088 0.345 -20.378 1135 H HIS 134 H HIS 134 -11.662 6.517 -18.380 1136 HA HIS 134 HA HIS 134 -14.075 8.051 -17.719 1137 HB2 HIS 134 2HB HIS 134 -12.750 9.821 -16.598 1138 HB3 HIS 134 3HB HIS 134 -12.636 8.301 -15.729 1139 HD1 HIS 134 HD1 HIS 134 -10.309 7.283 -15.428 1140 HD2 HIS 134 HD2 HIS 134 -10.299 10.644 -17.882 1141 HE1 HIS 134 HE1 HIS 134 -7.890 7.890 -15.745 1142 HE2 HIS 134 HE2 HIS 134 -7.920 9.794 -17.384 1143 H HIS 135 H HIS 135 -14.306 9.953 -18.937 1144 HA HIS 135 HA HIS 135 -12.538 10.225 -21.309 1145 HB2 HIS 135 2HB HIS 135 -15.481 11.002 -20.991 1146 HB3 HIS 135 3HB HIS 135 -14.504 11.296 -22.427 1147 HD1 HIS 135 HD1 HIS 135 -14.818 9.598 -24.194 1148 HD2 HIS 135 HD2 HIS 135 -15.567 8.023 -20.427 1149 HE1 HIS 135 HE1 HIS 135 -15.613 7.251 -24.586 1150 HE2 HIS 135 HE2 HIS 135 -15.800 6.259 -22.283 1151 H HIS 136 H HIS 136 -11.068 11.702 -20.624 1152 HA HIS 136 HA HIS 136 -11.953 14.381 -19.859 1153 HB2 HIS 136 2HB HIS 136 -11.750 13.198 -17.704 1154 HB3 HIS 136 3HB HIS 136 -10.103 12.712 -18.099 1155 HD1 HIS 136 HD1 HIS 136 -8.296 14.621 -18.148 1156 HD2 HIS 136 HD2 HIS 136 -11.999 15.788 -16.669 1157 HE1 HIS 136 HE1 HIS 136 -7.908 16.821 -17.019 1158 HE2 HIS 136 HE2 HIS 136 -10.184 17.567 -16.253 Start of MODEL 17 1 H1 MET 1 1H MET 1 -2.579 -16.011 -1.115 2 H2 MET 1 2H MET 1 -4.085 -16.556 -0.578 3 H3 MET 1 3H MET 1 -2.801 -16.400 0.507 4 HA MET 1 HA MET 1 -4.063 -14.177 -0.959 5 HB2 MET 1 2HB MET 1 -4.336 -14.979 1.981 6 HB3 MET 1 3HB MET 1 -5.003 -13.512 1.271 7 HG2 MET 1 2HG MET 1 -6.463 -14.881 -0.175 8 HG3 MET 1 3HG MET 1 -5.797 -16.347 0.549 9 HE1 MET 1 3HE MET 1 -8.295 -17.198 1.187 10 HE2 MET 1 1HE MET 1 -8.937 -15.748 0.407 11 HE3 MET 1 2HE MET 1 -9.456 -16.177 2.036 12 H GLY 2 H GLY 2 -1.827 -13.814 -1.594 13 HA2 GLY 2 2HA GLY 2 -0.138 -12.521 0.481 14 HA3 GLY 2 3HA GLY 2 0.467 -13.275 -0.993 15 H THR 3 H THR 3 -1.994 -10.890 -0.095 16 HA THR 3 HA THR 3 -1.350 -9.234 -2.442 17 HB THR 3 HB THR 3 -3.487 -7.968 -1.527 18 HG1 THR 3 HG1 THR 3 -4.436 -8.884 0.117 19 HG21 THR 3 3HG2 THR 3 -3.516 -9.317 -3.606 20 HG22 THR 3 1HG2 THR 3 -5.004 -9.526 -2.684 21 HG23 THR 3 2HG2 THR 3 -3.762 -10.781 -2.648 22 H VAL 4 H VAL 4 -0.657 -7.155 -2.268 23 HA VAL 4 HA VAL 4 0.118 -6.098 0.396 24 HB VAL 4 HB VAL 4 1.707 -5.726 -2.212 25 HG11 VAL 4 1HG1 VAL 4 3.493 -4.840 -0.755 26 HG12 VAL 4 2HG1 VAL 4 2.459 -5.056 0.660 27 HG13 VAL 4 3HG1 VAL 4 2.008 -3.899 -0.594 28 HG21 VAL 4 3HG2 VAL 4 2.372 -7.625 0.071 29 HG22 VAL 4 1HG2 VAL 4 3.395 -7.292 -1.331 30 HG23 VAL 4 2HG2 VAL 4 1.837 -8.096 -1.543 31 H VAL 5 H VAL 5 -1.124 -4.310 0.725 32 HA VAL 5 HA VAL 5 -1.866 -2.600 -1.584 33 HB VAL 5 HB VAL 5 -3.954 -1.960 -0.282 34 HG11 VAL 5 1HG1 VAL 5 -5.236 -3.958 -0.967 35 HG12 VAL 5 2HG1 VAL 5 -3.738 -4.882 -1.111 36 HG13 VAL 5 3HG1 VAL 5 -4.040 -3.519 -2.190 37 HG21 VAL 5 3HG2 VAL 5 -4.799 -3.484 1.472 38 HG22 VAL 5 1HG2 VAL 5 -3.282 -2.731 1.974 39 HG23 VAL 5 2HG2 VAL 5 -3.292 -4.405 1.417 40 H ILE 6 H ILE 6 -0.951 -0.692 -1.519 41 HA ILE 6 HA ILE 6 0.338 0.253 0.981 42 HB ILE 6 HB ILE 6 0.937 1.134 -1.889 43 HG12 ILE 6 2HG1 ILE 6 1.380 -1.323 -1.654 44 HG13 ILE 6 3HG1 ILE 6 2.840 -0.398 -1.963 45 HG21 ILE 6 1HG2 ILE 6 3.080 1.942 -0.951 46 HG22 ILE 6 2HG2 ILE 6 2.565 1.441 0.661 47 HG23 ILE 6 3HG2 ILE 6 1.694 2.721 -0.186 48 HD11 ILE 6 3HD1 ILE 6 3.246 -2.136 -0.361 49 HD12 ILE 6 1HD1 ILE 6 1.965 -1.530 0.684 50 HD13 ILE 6 2HD1 ILE 6 3.420 -0.564 0.418 51 H VAL 7 H VAL 7 -0.816 1.874 1.973 52 HA VAL 7 HA VAL 7 -2.623 3.605 0.446 53 HB VAL 7 HB VAL 7 -2.041 3.619 3.451 54 HG11 VAL 7 1HG1 VAL 7 -4.302 4.943 1.891 55 HG12 VAL 7 2HG1 VAL 7 -2.957 5.774 2.676 56 HG13 VAL 7 3HG1 VAL 7 -4.148 4.912 3.652 57 HG21 VAL 7 3HG2 VAL 7 -4.160 2.392 3.702 58 HG22 VAL 7 1HG2 VAL 7 -2.998 1.472 2.742 59 HG23 VAL 7 2HG2 VAL 7 -4.333 2.311 1.947 60 H VAL 8 H VAL 8 -1.786 5.289 -0.516 61 HA VAL 8 HA VAL 8 0.567 6.721 0.563 62 HB VAL 8 HB VAL 8 -0.295 6.712 -2.360 63 HG11 VAL 8 1HG1 VAL 8 2.347 7.459 -1.086 64 HG12 VAL 8 2HG1 VAL 8 1.121 8.589 -1.668 65 HG13 VAL 8 3HG1 VAL 8 1.960 7.537 -2.806 66 HG21 VAL 8 3HG2 VAL 8 1.468 5.049 -2.857 67 HG22 VAL 8 1HG2 VAL 8 0.185 4.386 -1.841 68 HG23 VAL 8 2HG2 VAL 8 1.732 4.832 -1.125 69 H SER 9 H SER 9 0.291 8.799 1.014 70 HA SER 9 HA SER 9 -1.384 10.641 -0.367 71 HB2 SER 9 2HB SER 9 -3.227 9.639 0.904 72 HB3 SER 9 3HB SER 9 -2.314 9.746 2.404 73 HG SER 9 HG SER 9 -3.999 11.499 1.496 74 H ASN 10 H ASN 10 -1.045 12.813 0.426 75 HA ASN 10 HA ASN 10 1.478 13.135 1.941 76 HB2 ASN 10 2HB ASN 10 0.022 14.915 -0.057 77 HB3 ASN 10 3HB ASN 10 1.315 15.543 0.961 78 HD21 ASN 10 1HD2 ASN 10 1.087 15.103 -2.001 79 HD22 ASN 10 2HD2 ASN 10 2.507 14.215 -2.414 80 H ASP 11 H ASP 11 -1.650 12.995 2.697 81 HA ASP 11 HA ASP 11 -1.614 15.186 4.688 82 HB2 ASP 11 2HB ASP 11 -3.946 13.474 3.717 83 HB3 ASP 11 3HB ASP 11 -4.053 14.805 4.868 84 H GLU 12 H GLU 12 -1.212 14.651 6.717 85 HA GLU 12 HA GLU 12 -0.508 12.068 7.603 86 HB2 GLU 12 2HB GLU 12 -1.094 14.634 9.146 87 HB3 GLU 12 3HB GLU 12 -0.397 13.192 9.880 88 HG2 GLU 12 2HG GLU 12 0.855 14.849 7.668 89 HG3 GLU 12 3HG GLU 12 1.321 14.866 9.370 90 H ARG 13 H ARG 13 -3.337 14.089 8.289 91 HA ARG 13 HA ARG 13 -4.564 12.304 10.118 92 HB2 ARG 13 2HB ARG 13 -5.837 14.593 8.567 93 HB3 ARG 13 3HB ARG 13 -6.531 13.774 9.966 94 HG2 ARG 13 2HG ARG 13 -4.587 14.576 11.338 95 HG3 ARG 13 3HG ARG 13 -4.025 15.492 9.936 96 HD2 ARG 13 2HD ARG 13 -6.641 15.880 11.437 97 HD3 ARG 13 3HD ARG 13 -5.255 16.971 11.433 98 HE ARG 13 HE ARG 13 -5.708 17.316 9.008 99 HH11 ARG 13 1HH1 ARG 13 -8.378 16.293 11.082 100 HH12 ARG 13 2HH1 ARG 13 -9.593 16.965 10.043 101 HH21 ARG 13 1HH2 ARG 13 -7.303 18.153 7.650 102 HH22 ARG 13 2HH2 ARG 13 -8.977 18.024 8.088 103 H ILE 14 H ILE 14 -4.682 12.585 6.623 104 HA ILE 14 HA ILE 14 -6.989 10.900 6.278 105 HB ILE 14 HB ILE 14 -4.808 11.768 4.327 106 HG12 ILE 14 2HG1 ILE 14 -6.209 13.631 4.991 107 HG13 ILE 14 3HG1 ILE 14 -6.699 13.176 3.366 108 HG21 ILE 14 1HG2 ILE 14 -6.216 10.921 2.477 109 HG22 ILE 14 2HG2 ILE 14 -7.327 10.205 3.647 110 HG23 ILE 14 3HG2 ILE 14 -5.670 9.610 3.529 111 HD11 ILE 14 3HD1 ILE 14 -8.620 13.713 4.703 112 HD12 ILE 14 1HD1 ILE 14 -8.161 12.535 5.930 113 HD13 ILE 14 2HD1 ILE 14 -8.651 11.993 4.322 114 H LEU 15 H LEU 15 -3.454 10.358 6.380 115 HA LEU 15 HA LEU 15 -3.549 7.548 5.920 116 HB2 LEU 15 2HB LEU 15 -1.522 9.266 7.398 117 HB3 LEU 15 3HB LEU 15 -1.282 7.552 7.083 118 HG LEU 15 HG LEU 15 -1.647 9.652 4.906 119 HD11 LEU 15 1HD1 LEU 15 0.447 10.023 6.133 120 HD12 LEU 15 2HD1 LEU 15 0.749 9.466 4.490 121 HD13 LEU 15 3HD1 LEU 15 0.926 8.346 5.844 122 HD21 LEU 15 3HD2 LEU 15 -0.874 6.710 4.730 123 HD22 LEU 15 1HD2 LEU 15 -0.870 7.854 3.381 124 HD23 LEU 15 2HD2 LEU 15 -2.385 7.439 4.181 125 H GLU 16 H GLU 16 -3.874 9.506 8.844 126 HA GLU 16 HA GLU 16 -3.943 7.349 10.725 127 HB2 GLU 16 2HB GLU 16 -4.903 10.236 10.928 128 HB3 GLU 16 3HB GLU 16 -4.827 9.115 12.291 129 HG2 GLU 16 2HG GLU 16 -2.384 8.917 12.007 130 HG3 GLU 16 3HG GLU 16 -2.449 10.016 10.630 131 H GLU 17 H GLU 17 -6.465 9.260 9.088 132 HA GLU 17 HA GLU 17 -8.761 8.176 10.321 133 HB2 GLU 17 2HB GLU 17 -8.842 10.257 9.026 134 HB3 GLU 17 3HB GLU 17 -8.327 9.422 7.566 135 HG2 GLU 17 2HG GLU 17 -10.718 9.985 7.509 136 HG3 GLU 17 3HG GLU 17 -10.454 8.244 7.432 137 H LEU 18 H LEU 18 -7.139 7.378 7.268 138 HA LEU 18 HA LEU 18 -8.822 5.231 6.491 139 HB2 LEU 18 2HB LEU 18 -6.181 6.344 5.552 140 HB3 LEU 18 3HB LEU 18 -6.674 4.772 4.960 141 HG LEU 18 HG LEU 18 -8.667 5.714 3.896 142 HD11 LEU 18 1HD1 LEU 18 -9.204 8.087 3.849 143 HD12 LEU 18 2HD1 LEU 18 -7.886 8.432 4.972 144 HD13 LEU 18 3HD1 LEU 18 -9.263 7.463 5.497 145 HD21 LEU 18 3HD2 LEU 18 -6.588 5.748 2.610 146 HD22 LEU 18 1HD2 LEU 18 -6.214 7.361 3.224 147 HD23 LEU 18 2HD2 LEU 18 -7.615 7.113 2.177 148 H LEU 19 H LEU 19 -5.894 5.421 8.454 149 HA LEU 19 HA LEU 19 -5.214 2.704 8.671 150 HB2 LEU 19 2HB LEU 19 -3.832 4.573 9.590 151 HB3 LEU 19 3HB LEU 19 -5.053 4.856 10.818 152 HG LEU 19 HG LEU 19 -4.594 2.434 11.619 153 HD11 LEU 19 1HD1 LEU 19 -3.422 1.600 9.667 154 HD12 LEU 19 2HD1 LEU 19 -2.389 1.498 11.091 155 HD13 LEU 19 3HD1 LEU 19 -2.124 2.775 9.900 156 HD21 LEU 19 3HD2 LEU 19 -2.684 3.101 12.990 157 HD22 LEU 19 1HD2 LEU 19 -3.886 4.387 12.892 158 HD23 LEU 19 2HD2 LEU 19 -2.399 4.497 11.946 159 H GLU 20 H GLU 20 -7.395 4.713 10.613 160 HA GLU 20 HA GLU 20 -8.165 2.784 12.518 161 HB2 GLU 20 2HB GLU 20 -9.628 5.288 11.582 162 HB3 GLU 20 3HB GLU 20 -9.993 4.389 13.056 163 HG2 GLU 20 2HG GLU 20 -7.802 4.918 13.979 164 HG3 GLU 20 3HG GLU 20 -7.324 5.702 12.468 165 H VAL 21 H VAL 21 -9.434 3.554 9.335 166 HA VAL 21 HA VAL 21 -11.898 2.136 9.501 167 HB VAL 21 HB VAL 21 -10.271 2.813 7.000 168 HG11 VAL 21 1HG1 VAL 21 -13.223 2.129 7.281 169 HG12 VAL 21 2HG1 VAL 21 -11.987 1.124 6.519 170 HG13 VAL 21 3HG1 VAL 21 -12.434 2.669 5.796 171 HG21 VAL 21 3HG2 VAL 21 -10.767 4.830 8.321 172 HG22 VAL 21 1HG2 VAL 21 -12.479 4.409 8.355 173 HG23 VAL 21 2HG2 VAL 21 -11.700 4.826 6.827 174 H VAL 22 H VAL 22 -8.621 1.234 8.494 175 HA VAL 22 HA VAL 22 -9.214 -1.435 7.629 176 HB VAL 22 HB VAL 22 -6.552 -0.186 8.482 177 HG11 VAL 22 1HG1 VAL 22 -7.042 -2.767 6.954 178 HG12 VAL 22 2HG1 VAL 22 -6.408 -2.632 8.593 179 HG13 VAL 22 3HG1 VAL 22 -5.464 -2.027 7.232 180 HG21 VAL 22 3HG2 VAL 22 -7.566 0.974 6.554 181 HG22 VAL 22 1HG2 VAL 22 -7.708 -0.559 5.691 182 HG23 VAL 22 2HG2 VAL 22 -6.112 0.101 6.067 183 H LEU 23 H LEU 23 -7.957 -0.002 10.669 184 HA LEU 23 HA LEU 23 -7.502 -2.419 12.054 185 HB2 LEU 23 2HB LEU 23 -7.674 0.474 12.851 186 HB3 LEU 23 3HB LEU 23 -7.778 -0.719 14.129 187 HG LEU 23 HG LEU 23 -5.571 -1.653 13.452 188 HD11 LEU 23 1HD1 LEU 23 -4.119 -0.478 11.877 189 HD12 LEU 23 2HD1 LEU 23 -5.441 0.614 11.464 190 HD13 LEU 23 3HD1 LEU 23 -5.566 -1.103 11.085 191 HD21 LEU 23 3HD2 LEU 23 -4.184 0.178 14.290 192 HD22 LEU 23 1HD2 LEU 23 -5.681 0.047 15.212 193 HD23 LEU 23 2HD2 LEU 23 -5.497 1.323 14.004 194 H LYS 24 H LYS 24 -10.418 -0.333 11.992 195 HA LYS 24 HA LYS 24 -11.799 -1.822 14.029 196 HB2 LYS 24 2HB LYS 24 -13.745 -0.443 13.538 197 HB3 LYS 24 3HB LYS 24 -12.310 0.552 13.623 198 HG2 LYS 24 2HG LYS 24 -13.473 1.495 11.853 199 HG3 LYS 24 3HG LYS 24 -12.315 0.453 11.037 200 HD2 LYS 24 2HD LYS 24 -14.510 0.351 9.950 201 HD3 LYS 24 3HD LYS 24 -14.093 -1.216 10.630 202 HE2 LYS 24 2HE LYS 24 -15.907 0.746 12.076 203 HE3 LYS 24 3HE LYS 24 -16.517 -0.431 10.915 204 HZ1 LYS 24 3HZ LYS 24 -15.122 -1.015 13.468 205 HZ2 LYS 24 1HZ LYS 24 -15.508 -2.187 12.311 206 HZ3 LYS 24 2HZ LYS 24 -16.734 -1.324 13.086 207 H SER 25 H SER 25 -11.509 -2.066 10.590 208 HA SER 25 HA SER 25 -13.654 -3.874 10.087 209 HB2 SER 25 2HB SER 25 -12.670 -2.550 8.285 210 HB3 SER 25 3HB SER 25 -11.088 -3.287 8.549 211 HG SER 25 HG SER 25 -11.785 -5.138 7.652 212 H ASP 26 H ASP 26 -10.179 -4.255 10.761 213 HA ASP 26 HA ASP 26 -10.484 -6.688 12.175 214 HB2 ASP 26 2HB ASP 26 -10.728 -7.588 9.813 215 HB3 ASP 26 3HB ASP 26 -9.100 -7.020 9.466 216 HA PRO 27 HA PRO 27 -6.703 -4.505 13.498 217 HB2 PRO 27 2HB PRO 27 -6.255 -5.844 15.835 218 HB3 PRO 27 3HB PRO 27 -7.609 -4.712 15.643 219 HG2 PRO 27 2HG PRO 27 -7.636 -7.713 15.463 220 HG3 PRO 27 3HG PRO 27 -8.755 -6.630 16.327 221 HD2 PRO 27 2HD PRO 27 -9.336 -7.679 13.872 222 HD3 PRO 27 3HD PRO 27 -9.939 -6.091 14.400 223 H ASN 28 H ASN 28 -6.863 -7.949 12.882 224 HA ASN 28 HA ASN 28 -4.058 -8.499 13.410 225 HB2 ASN 28 2HB ASN 28 -5.801 -10.151 13.953 226 HB3 ASN 28 3HB ASN 28 -6.287 -10.227 12.263 227 HD21 ASN 28 1HD2 ASN 28 -5.933 -12.425 12.211 228 HD22 ASN 28 2HD2 ASN 28 -4.352 -13.116 12.165 229 H VAL 29 H VAL 29 -5.965 -7.528 10.677 230 HA VAL 29 HA VAL 29 -4.194 -8.150 8.575 231 HB VAL 29 HB VAL 29 -6.129 -5.821 8.946 232 HG11 VAL 29 1HG1 VAL 29 -5.896 -5.347 6.526 233 HG12 VAL 29 2HG1 VAL 29 -4.589 -6.529 6.422 234 HG13 VAL 29 3HG1 VAL 29 -4.382 -5.066 7.386 235 HG21 VAL 29 3HG2 VAL 29 -6.275 -8.343 7.251 236 HG22 VAL 29 1HG2 VAL 29 -7.512 -7.091 7.335 237 HG23 VAL 29 2HG2 VAL 29 -7.146 -8.060 8.760 238 H LYS 30 H LYS 30 -2.174 -7.490 8.203 239 HA LYS 30 HA LYS 30 -0.826 -6.147 10.334 240 HB2 LYS 30 2HB LYS 30 0.037 -8.190 9.192 241 HB3 LYS 30 3HB LYS 30 0.284 -7.250 7.724 242 HG2 LYS 30 2HG LYS 30 2.385 -7.579 8.924 243 HG3 LYS 30 3HG LYS 30 1.958 -5.866 8.872 244 HD2 LYS 30 2HD LYS 30 1.096 -6.032 11.210 245 HD3 LYS 30 3HD LYS 30 1.557 -7.738 11.245 246 HE2 LYS 30 2HE LYS 30 3.915 -7.126 10.978 247 HE3 LYS 30 3HE LYS 30 3.474 -5.425 10.843 248 HZ1 LYS 30 3HZ LYS 30 2.700 -5.443 13.098 249 HZ2 LYS 30 1HZ LYS 30 4.286 -6.023 13.051 250 HZ3 LYS 30 2HZ LYS 30 2.995 -7.095 13.246 251 H THR 31 H THR 31 -1.230 -3.971 10.382 252 HA THR 31 HA THR 31 -0.669 -2.292 8.026 253 HB THR 31 HB THR 31 -1.621 -0.428 9.405 254 HG1 THR 31 HG1 THR 31 -1.203 -1.180 11.485 255 HG21 THR 31 3HG2 THR 31 -3.127 -1.673 7.913 256 HG22 THR 31 1HG2 THR 31 -3.970 -1.194 9.392 257 HG23 THR 31 2HG2 THR 31 -3.429 -2.859 9.187 258 H VAL 32 H VAL 32 1.384 -1.645 7.797 259 HA VAL 32 HA VAL 32 3.005 -0.904 10.185 260 HB VAL 32 HB VAL 32 4.207 -1.984 7.588 261 HG11 VAL 32 1HG1 VAL 32 5.395 -1.734 10.373 262 HG12 VAL 32 2HG1 VAL 32 5.720 -0.666 9.003 263 HG13 VAL 32 3HG1 VAL 32 6.221 -2.356 8.939 264 HG21 VAL 32 3HG2 VAL 32 4.507 -4.181 8.649 265 HG22 VAL 32 1HG2 VAL 32 2.795 -3.777 8.496 266 HG23 VAL 32 2HG2 VAL 32 3.598 -3.637 10.062 267 H ARG 33 H ARG 33 3.443 1.246 10.160 268 HA ARG 33 HA ARG 33 3.475 2.714 7.589 269 HB2 ARG 33 2HB ARG 33 1.912 3.611 9.292 270 HB3 ARG 33 3HB ARG 33 3.243 3.811 10.430 271 HG2 ARG 33 2HG ARG 33 4.260 5.522 9.059 272 HG3 ARG 33 3HG ARG 33 3.139 5.204 7.737 273 HD2 ARG 33 2HD ARG 33 1.270 6.035 9.149 274 HD3 ARG 33 3HD ARG 33 2.430 6.387 10.441 275 HE ARG 33 HE ARG 33 3.451 7.718 8.302 276 HH11 ARG 33 1HH1 ARG 33 0.296 7.799 9.875 277 HH12 ARG 33 2HH1 ARG 33 -0.001 9.460 9.453 278 HH21 ARG 33 1HH2 ARG 33 3.042 9.857 7.740 279 HH22 ARG 33 2HH2 ARG 33 1.574 10.633 8.234 280 H THR 34 H THR 34 5.470 2.854 6.738 281 HA THR 34 HA THR 34 7.743 3.853 8.153 282 HB THR 34 HB THR 34 7.882 1.632 9.134 283 HG1 THR 34 HG1 THR 34 9.920 2.154 8.765 284 HG21 THR 34 3HG2 THR 34 6.526 0.365 7.530 285 HG22 THR 34 1HG2 THR 34 8.081 -0.426 7.778 286 HG23 THR 34 2HG2 THR 34 7.793 0.514 6.315 287 H ASP 35 H ASP 35 9.632 3.997 6.842 288 HA ASP 35 HA ASP 35 9.396 3.576 3.928 289 HB2 ASP 35 2HB ASP 35 10.295 5.851 3.526 290 HB3 ASP 35 3HB ASP 35 8.776 5.940 4.410 291 H ASP 36 H ASP 36 10.959 2.546 6.484 292 HA ASP 36 HA ASP 36 13.724 3.153 6.046 293 HB2 ASP 36 2HB ASP 36 12.814 2.489 8.251 294 HB3 ASP 36 3HB ASP 36 12.385 0.915 7.619 295 H LYS 37 H LYS 37 11.571 1.146 4.369 296 HA LYS 37 HA LYS 37 11.777 0.289 2.311 297 HB2 LYS 37 2HB LYS 37 13.786 1.833 2.032 298 HB3 LYS 37 3HB LYS 37 14.810 0.473 2.474 299 HG2 LYS 37 2HG LYS 37 14.038 -0.777 0.509 300 HG3 LYS 37 3HG LYS 37 12.919 0.522 0.094 301 HD2 LYS 37 2HD LYS 37 15.954 0.719 0.101 302 HD3 LYS 37 3HD LYS 37 14.927 0.588 -1.318 303 HE2 LYS 37 2HE LYS 37 13.884 2.769 -0.701 304 HE3 LYS 37 3HE LYS 37 15.058 2.917 0.608 305 HZ1 LYS 37 3HZ LYS 37 15.635 2.811 -2.307 306 HZ2 LYS 37 1HZ LYS 37 16.827 2.791 -1.103 307 HZ3 LYS 37 2HZ LYS 37 15.825 4.139 -1.280 308 H GLU 38 H GLU 38 14.710 -1.044 3.846 309 HA GLU 38 HA GLU 38 14.165 -3.757 3.249 310 HB2 GLU 38 2HB GLU 38 15.997 -4.256 4.848 311 HB3 GLU 38 3HB GLU 38 16.427 -2.973 3.720 312 HG2 GLU 38 2HG GLU 38 15.883 -1.291 5.492 313 HG3 GLU 38 3HG GLU 38 15.588 -2.620 6.612 314 H LYS 39 H LYS 39 13.237 -1.692 5.918 315 HA LYS 39 HA LYS 39 12.170 -3.495 7.764 316 HB2 LYS 39 2HB LYS 39 12.418 -1.085 8.191 317 HB3 LYS 39 3HB LYS 39 11.230 -0.718 6.958 318 HG2 LYS 39 2HG LYS 39 10.114 -0.379 8.989 319 HG3 LYS 39 3HG LYS 39 9.517 -1.935 8.423 320 HD2 LYS 39 2HD LYS 39 11.823 -1.811 10.381 321 HD3 LYS 39 3HD LYS 39 10.172 -1.592 10.950 322 HE2 LYS 39 2HE LYS 39 9.547 -3.798 10.116 323 HE3 LYS 39 3HE LYS 39 11.156 -4.025 9.431 324 HZ1 LYS 39 3HZ LYS 39 11.024 -5.175 11.498 325 HZ2 LYS 39 1HZ LYS 39 10.462 -3.800 12.308 326 HZ3 LYS 39 2HZ LYS 39 12.045 -3.844 11.721 327 H VAL 40 H VAL 40 10.582 -1.942 4.937 328 HA VAL 40 HA VAL 40 8.048 -3.191 5.357 329 HB VAL 40 HB VAL 40 9.089 -2.060 2.719 330 HG11 VAL 40 1HG1 VAL 40 6.698 -1.684 2.190 331 HG12 VAL 40 2HG1 VAL 40 6.239 -2.448 3.713 332 HG13 VAL 40 3HG1 VAL 40 7.044 -3.395 2.461 333 HG21 VAL 40 3HG2 VAL 40 7.634 -0.559 4.922 334 HG22 VAL 40 1HG2 VAL 40 8.068 0.089 3.337 335 HG23 VAL 40 2HG2 VAL 40 9.332 -0.360 4.483 336 H LYS 41 H LYS 41 10.939 -4.008 3.502 337 HA LYS 41 HA LYS 41 9.897 -6.101 1.908 338 HB2 LYS 41 2HB LYS 41 12.746 -5.611 2.870 339 HB3 LYS 41 3HB LYS 41 12.301 -6.783 1.628 340 HG2 LYS 41 2HG LYS 41 11.490 -4.991 0.178 341 HG3 LYS 41 3HG LYS 41 11.830 -3.791 1.428 342 HD2 LYS 41 2HD LYS 41 14.270 -4.426 1.288 343 HD3 LYS 41 3HD LYS 41 13.872 -5.498 -0.060 344 HE2 LYS 41 2HE LYS 41 13.058 -3.552 -1.354 345 HE3 LYS 41 3HE LYS 41 13.458 -2.488 -0.001 346 HZ1 LYS 41 3HZ LYS 41 15.793 -3.225 -0.246 347 HZ2 LYS 41 1HZ LYS 41 15.206 -2.406 -1.604 348 HZ3 LYS 41 2HZ LYS 41 15.356 -4.087 -1.632 349 H GLU 42 H GLU 42 11.427 -6.160 5.161 350 HA GLU 42 HA GLU 42 11.307 -9.018 5.397 351 HB2 GLU 42 2HB GLU 42 11.886 -8.745 7.746 352 HB3 GLU 42 3HB GLU 42 12.903 -7.704 6.759 353 HG2 GLU 42 2HG GLU 42 11.649 -5.749 7.411 354 HG3 GLU 42 3HG GLU 42 10.449 -6.737 8.239 355 H GLU 43 H GLU 43 9.059 -6.385 6.138 356 HA GLU 43 HA GLU 43 7.110 -7.928 7.521 357 HB2 GLU 43 2HB GLU 43 6.686 -5.415 5.847 358 HB3 GLU 43 3HB GLU 43 5.525 -6.097 6.980 359 HG2 GLU 43 2HG GLU 43 8.170 -4.796 7.605 360 HG3 GLU 43 3HG GLU 43 6.566 -4.222 8.031 361 H ILE 44 H ILE 44 7.683 -7.273 4.086 362 HA ILE 44 HA ILE 44 5.382 -8.501 2.985 363 HB ILE 44 HB ILE 44 8.159 -8.001 1.805 364 HG12 ILE 44 2HG1 ILE 44 5.492 -6.577 1.350 365 HG13 ILE 44 3HG1 ILE 44 6.858 -5.949 2.265 366 HG21 ILE 44 1HG2 ILE 44 7.270 -8.503 -0.433 367 HG22 ILE 44 2HG2 ILE 44 5.726 -8.976 0.276 368 HG23 ILE 44 3HG2 ILE 44 7.174 -9.923 0.614 369 HD11 ILE 44 3HD1 ILE 44 8.199 -5.899 0.210 370 HD12 ILE 44 1HD1 ILE 44 6.739 -4.918 0.087 371 HD13 ILE 44 2HD1 ILE 44 6.810 -6.494 -0.705 372 H GLU 45 H GLU 45 8.615 -9.745 3.823 373 HA GLU 45 HA GLU 45 8.389 -12.396 2.954 374 HB2 GLU 45 2HB GLU 45 10.542 -11.517 3.664 375 HB3 GLU 45 3HB GLU 45 9.946 -11.225 5.295 376 HG2 GLU 45 2HG GLU 45 9.722 -13.643 5.671 377 HG3 GLU 45 3HG GLU 45 10.239 -13.964 4.020 378 H LYS 46 H LYS 46 7.520 -10.929 6.075 379 HA LYS 46 HA LYS 46 6.532 -13.283 7.324 380 HB2 LYS 46 2HB LYS 46 5.767 -10.390 7.895 381 HB3 LYS 46 3HB LYS 46 5.503 -11.762 8.970 382 HG2 LYS 46 2HG LYS 46 7.950 -12.045 9.208 383 HG3 LYS 46 3HG LYS 46 8.210 -10.675 8.125 384 HD2 LYS 46 2HD LYS 46 6.929 -9.235 9.777 385 HD3 LYS 46 3HD LYS 46 6.916 -10.616 10.878 386 HE2 LYS 46 2HE LYS 46 8.718 -9.097 11.490 387 HE3 LYS 46 3HE LYS 46 9.409 -10.598 10.869 388 HZ1 LYS 46 3HZ LYS 46 9.087 -8.089 9.310 389 HZ2 LYS 46 1HZ LYS 46 9.802 -9.521 8.760 390 HZ3 LYS 46 2HZ LYS 46 10.528 -8.636 10.005 391 H ALA 47 H ALA 47 5.094 -10.882 5.204 392 HA ALA 47 HA ALA 47 2.336 -11.457 5.757 393 HB1 ALA 47 3HB ALA 47 1.872 -9.906 3.919 394 HB2 ALA 47 1HB ALA 47 3.576 -9.933 3.435 395 HB3 ALA 47 2HB ALA 47 3.106 -9.250 4.992 396 H ARG 48 H ARG 48 4.601 -12.504 3.196 397 HA ARG 48 HA ARG 48 2.560 -13.941 1.741 398 HB2 ARG 48 2HB ARG 48 4.467 -14.842 0.388 399 HB3 ARG 48 3HB ARG 48 4.354 -13.098 0.443 400 HG2 ARG 48 2HG ARG 48 6.621 -13.404 0.587 401 HG3 ARG 48 3HG ARG 48 6.194 -13.266 2.289 402 HD2 ARG 48 2HD ARG 48 6.471 -15.622 2.634 403 HD3 ARG 48 3HD ARG 48 6.519 -15.948 0.899 404 HE ARG 48 HE ARG 48 8.629 -14.439 1.030 405 HH11 ARG 48 1HH1 ARG 48 7.722 -16.833 3.459 406 HH12 ARG 48 2HH1 ARG 48 9.361 -17.124 3.942 407 HH21 ARG 48 1HH2 ARG 48 10.742 -14.853 1.658 408 HH22 ARG 48 2HH2 ARG 48 11.074 -15.997 2.914 409 H LYS 49 H LYS 49 4.830 -14.689 4.264 410 HA LYS 49 HA LYS 49 4.642 -17.555 4.092 411 HB2 LYS 49 2HB LYS 49 6.626 -16.353 4.999 412 HB3 LYS 49 3HB LYS 49 5.654 -15.766 6.344 413 HG2 LYS 49 2HG LYS 49 5.356 -18.080 7.151 414 HG3 LYS 49 3HG LYS 49 6.277 -18.684 5.771 415 HD2 LYS 49 2HD LYS 49 7.675 -18.606 7.798 416 HD3 LYS 49 3HD LYS 49 8.287 -17.498 6.567 417 HE2 LYS 49 2HE LYS 49 7.206 -15.606 7.761 418 HE3 LYS 49 3HE LYS 49 6.631 -16.728 8.998 419 HZ1 LYS 49 3HZ LYS 49 8.930 -17.261 9.527 420 HZ2 LYS 49 1HZ LYS 49 8.651 -15.597 9.690 421 HZ3 LYS 49 2HZ LYS 49 9.478 -16.188 8.341 422 H GLN 50 H GLN 50 3.128 -15.024 6.007 423 HA GLN 50 HA GLN 50 1.474 -16.825 7.604 424 HB2 GLN 50 2HB GLN 50 2.475 -14.747 8.573 425 HB3 GLN 50 3HB GLN 50 1.573 -13.774 7.421 426 HG2 GLN 50 2HG GLN 50 0.520 -13.690 9.610 427 HG3 GLN 50 3HG GLN 50 -0.544 -14.500 8.459 428 HE21 GLN 50 1HE2 GLN 50 -1.686 -15.521 10.140 429 HE22 GLN 50 2HE2 GLN 50 -1.017 -16.830 11.046 430 H GLY 51 H GLY 51 0.882 -14.092 5.386 431 HA2 GLY 51 2HA GLY 51 -0.703 -14.509 3.473 432 HA3 GLY 51 3HA GLY 51 -1.798 -15.186 4.680 433 H ARG 52 H ARG 52 -3.280 -13.514 3.866 434 HA ARG 52 HA ARG 52 -4.608 -11.771 4.359 435 HB2 ARG 52 2HB ARG 52 -2.551 -11.195 6.536 436 HB3 ARG 52 3HB ARG 52 -3.995 -10.209 6.316 437 HG2 ARG 52 2HG ARG 52 -5.429 -12.153 6.730 438 HG3 ARG 52 3HG ARG 52 -4.014 -13.197 6.880 439 HD2 ARG 52 2HD ARG 52 -3.392 -12.255 8.967 440 HD3 ARG 52 3HD ARG 52 -4.383 -10.815 8.719 441 HE ARG 52 HE ARG 52 -6.187 -11.914 9.564 442 HH11 ARG 52 1HH1 ARG 52 -3.793 -14.391 8.858 443 HH12 ARG 52 2HH1 ARG 52 -4.715 -15.655 9.610 444 HH21 ARG 52 1HH2 ARG 52 -7.373 -13.573 10.500 445 HH22 ARG 52 2HH2 ARG 52 -6.740 -15.187 10.539 446 HA PRO 53 HA PRO 53 -3.015 -8.363 1.900 447 HB2 PRO 53 2HB PRO 53 -5.023 -6.446 2.738 448 HB3 PRO 53 3HB PRO 53 -5.024 -7.439 1.280 449 HG2 PRO 53 2HG PRO 53 -6.804 -7.708 3.418 450 HG3 PRO 53 3HG PRO 53 -6.517 -8.908 2.144 451 HD2 PRO 53 2HD PRO 53 -5.483 -8.851 4.943 452 HD3 PRO 53 3HD PRO 53 -5.875 -10.241 3.905 453 H ILE 54 H ILE 54 -1.053 -7.810 2.865 454 HA ILE 54 HA ILE 54 -0.852 -6.382 5.348 455 HB ILE 54 HB ILE 54 1.003 -7.803 4.701 456 HG12 ILE 54 2HG1 ILE 54 1.839 -4.865 4.668 457 HG13 ILE 54 3HG1 ILE 54 1.545 -5.842 6.101 458 HG21 ILE 54 1HG2 ILE 54 2.487 -7.368 2.790 459 HG22 ILE 54 2HG2 ILE 54 1.464 -6.022 2.287 460 HG23 ILE 54 3HG2 ILE 54 0.831 -7.669 2.252 461 HD11 ILE 54 3HD1 ILE 54 3.460 -7.257 5.504 462 HD12 ILE 54 1HD1 ILE 54 3.899 -5.566 5.736 463 HD13 ILE 54 2HD1 ILE 54 3.770 -6.224 4.105 464 H VAL 55 H VAL 55 -1.136 -4.264 5.667 465 HA VAL 55 HA VAL 55 -1.415 -2.463 3.347 466 HB VAL 55 HB VAL 55 -2.521 -1.840 6.118 467 HG11 VAL 55 1HG1 VAL 55 -2.434 -0.017 4.444 468 HG12 VAL 55 2HG1 VAL 55 -4.098 -0.440 4.851 469 HG13 VAL 55 3HG1 VAL 55 -3.397 -0.995 3.327 470 HG21 VAL 55 3HG2 VAL 55 -3.997 -3.429 3.982 471 HG22 VAL 55 1HG2 VAL 55 -4.691 -2.820 5.486 472 HG23 VAL 55 2HG2 VAL 55 -3.433 -4.058 5.530 473 H ILE 56 H ILE 56 0.284 -1.098 3.049 474 HA ILE 56 HA ILE 56 1.929 -0.292 5.390 475 HB ILE 56 HB ILE 56 2.712 -0.280 2.441 476 HG12 ILE 56 2HG1 ILE 56 2.497 -2.597 3.317 477 HG13 ILE 56 3HG1 ILE 56 4.168 -2.205 2.944 478 HG21 ILE 56 1HG2 ILE 56 5.020 0.171 3.236 479 HG22 ILE 56 2HG2 ILE 56 4.413 0.322 4.887 480 HG23 ILE 56 3HG2 ILE 56 3.905 1.475 3.650 481 HD11 ILE 56 3HD1 ILE 56 4.003 -3.489 4.978 482 HD12 ILE 56 1HD1 ILE 56 2.929 -2.287 5.694 483 HD13 ILE 56 2HD1 ILE 56 4.610 -1.876 5.338 484 H PHE 57 H PHE 57 1.610 1.717 6.077 485 HA PHE 57 HA PHE 57 0.369 3.757 4.356 486 HB2 PHE 57 2HB PHE 57 0.804 3.556 7.369 487 HB3 PHE 57 3HB PHE 57 0.270 5.050 6.601 488 HD1 PHE 57 HD2 PHE 57 -0.642 1.423 6.931 489 HD2 PHE 57 HD1 PHE 57 -2.023 5.406 6.202 490 HE1 PHE 57 HE2 PHE 57 -2.970 0.630 6.934 491 HE2 PHE 57 HE1 PHE 57 -4.342 4.600 6.224 492 HZ PHE 57 HZ PHE 57 -4.807 2.223 6.553 493 H ILE 58 H ILE 58 1.433 5.485 3.639 494 HA ILE 58 HA ILE 58 4.090 6.303 4.592 495 HB ILE 58 HB ILE 58 4.988 6.304 2.207 496 HG12 ILE 58 2HG1 ILE 58 2.636 4.450 1.609 497 HG13 ILE 58 3HG1 ILE 58 2.710 6.144 1.138 498 HG21 ILE 58 1HG2 ILE 58 5.750 4.557 3.756 499 HG22 ILE 58 2HG2 ILE 58 5.642 3.940 2.106 500 HG23 ILE 58 3HG2 ILE 58 4.394 3.529 3.285 501 HD11 ILE 58 3HD1 ILE 58 3.282 4.817 -0.718 502 HD12 ILE 58 1HD1 ILE 58 4.494 3.938 0.201 503 HD13 ILE 58 2HD1 ILE 58 4.731 5.644 -0.168 504 H ARG 59 H ARG 59 4.791 8.300 3.430 505 HA ARG 59 HA ARG 59 2.574 9.987 2.488 506 HB2 ARG 59 2HB ARG 59 4.295 10.710 4.288 507 HB3 ARG 59 3HB ARG 59 5.450 10.861 2.969 508 HG2 ARG 59 2HG ARG 59 4.116 12.607 1.931 509 HG3 ARG 59 3HG ARG 59 2.810 12.355 3.093 510 HD2 ARG 59 2HD ARG 59 5.582 13.447 3.677 511 HD3 ARG 59 3HD ARG 59 4.057 14.336 3.732 512 HE ARG 59 HE ARG 59 3.431 12.737 5.590 513 HH11 ARG 59 1HH1 ARG 59 6.803 13.631 5.045 514 HH12 ARG 59 2HH1 ARG 59 7.258 13.346 6.695 515 HH21 ARG 59 1HH2 ARG 59 4.047 12.373 7.729 516 HH22 ARG 59 2HH2 ARG 59 5.695 12.634 8.214 517 H GLY 60 H GLY 60 2.893 11.250 0.489 518 HA2 GLY 60 2HA GLY 60 3.508 9.685 -1.758 519 HA3 GLY 60 3HA GLY 60 3.246 11.416 -1.766 520 H ALA 61 H ALA 61 5.617 11.753 0.102 521 HA ALA 61 HA ALA 61 7.725 12.017 -1.840 522 HB1 ALA 61 3HB ALA 61 7.795 12.261 1.193 523 HB2 ALA 61 1HB ALA 61 7.503 13.575 0.057 524 HB3 ALA 61 2HB ALA 61 9.079 12.782 0.094 525 H TYR 62 H TYR 62 7.024 9.914 0.883 526 HA TYR 62 HA TYR 62 9.338 8.278 0.776 527 HB2 TYR 62 2HB TYR 62 6.648 7.806 2.135 528 HB3 TYR 62 3HB TYR 62 8.085 6.816 2.387 529 HD1 TYR 62 HD2 TYR 62 10.260 8.725 2.641 530 HD2 TYR 62 HD1 TYR 62 6.275 9.017 4.150 531 HE1 TYR 62 HE2 TYR 62 11.044 10.216 4.419 532 HE2 TYR 62 HE1 TYR 62 7.070 10.507 5.951 533 HH TYR 62 HH TYR 62 9.150 11.020 7.136 534 H GLU 63 H GLU 63 6.322 8.165 -0.946 535 HA GLU 63 HA GLU 63 6.016 5.498 -1.592 536 HB2 GLU 63 2HB GLU 63 4.442 7.376 -2.114 537 HB3 GLU 63 3HB GLU 63 5.487 7.827 -3.464 538 HG2 GLU 63 2HG GLU 63 5.123 5.461 -4.368 539 HG3 GLU 63 3HG GLU 63 3.891 5.274 -3.119 540 H GLU 64 H GLU 64 8.341 7.769 -2.949 541 HA GLU 64 HA GLU 64 9.291 6.400 -5.185 542 HB2 GLU 64 2HB GLU 64 9.985 8.679 -4.654 543 HB3 GLU 64 3HB GLU 64 10.783 8.140 -3.180 544 HG2 GLU 64 2HG GLU 64 12.378 6.828 -4.578 545 HG3 GLU 64 3HG GLU 64 11.615 7.486 -6.026 546 H VAL 65 H VAL 65 10.193 6.035 -1.791 547 HA VAL 65 HA VAL 65 12.218 4.100 -1.903 548 HB VAL 65 HB VAL 65 10.113 4.644 0.223 549 HG11 VAL 65 1HG1 VAL 65 11.014 2.421 0.596 550 HG12 VAL 65 2HG1 VAL 65 11.495 3.539 1.869 551 HG13 VAL 65 3HG1 VAL 65 12.644 3.085 0.616 552 HG21 VAL 65 3HG2 VAL 65 12.975 5.637 0.054 553 HG22 VAL 65 1HG2 VAL 65 11.841 5.980 1.367 554 HG23 VAL 65 2HG2 VAL 65 11.532 6.603 -0.256 555 H VAL 66 H VAL 66 8.679 3.767 -1.866 556 HA VAL 66 HA VAL 66 8.467 0.992 -1.474 557 HB VAL 66 HB VAL 66 6.501 2.880 -2.838 558 HG11 VAL 66 1HG1 VAL 66 5.987 0.048 -1.835 559 HG12 VAL 66 2HG1 VAL 66 5.940 0.582 -3.515 560 HG13 VAL 66 3HG1 VAL 66 4.738 1.179 -2.368 561 HG21 VAL 66 3HG2 VAL 66 6.655 1.838 0.009 562 HG22 VAL 66 1HG2 VAL 66 5.356 2.844 -0.640 563 HG23 VAL 66 2HG2 VAL 66 6.996 3.486 -0.525 564 H ARG 67 H ARG 67 9.095 2.812 -4.420 565 HA ARG 67 HA ARG 67 8.595 0.775 -6.313 566 HB2 ARG 67 2HB ARG 67 8.918 3.163 -6.875 567 HB3 ARG 67 3HB ARG 67 10.619 3.048 -6.446 568 HG2 ARG 67 2HG ARG 67 11.098 1.651 -8.332 569 HG3 ARG 67 3HG ARG 67 9.385 1.372 -8.650 570 HD2 ARG 67 2HD ARG 67 9.079 3.670 -9.352 571 HD3 ARG 67 3HD ARG 67 10.720 4.093 -8.876 572 HE ARG 67 HE ARG 67 10.082 2.203 -11.077 573 HH11 ARG 67 1HH1 ARG 67 12.026 4.885 -9.840 574 HH12 ARG 67 2HH1 ARG 67 12.990 4.988 -11.280 575 HH21 ARG 67 1HH2 ARG 67 11.332 2.401 -12.962 576 HH22 ARG 67 2HH2 ARG 67 12.597 3.591 -13.037 577 H ASP 68 H ASP 68 11.447 1.403 -4.282 578 HA ASP 68 HA ASP 68 13.109 -0.670 -5.419 579 HB2 ASP 68 2HB ASP 68 13.316 0.553 -2.640 580 HB3 ASP 68 3HB ASP 68 14.585 -0.303 -3.510 581 H ILE 69 H ILE 69 10.747 -0.468 -2.852 582 HA ILE 69 HA ILE 69 11.207 -3.027 -1.635 583 HB ILE 69 HB ILE 69 8.726 -1.245 -1.511 584 HG12 ILE 69 2HG1 ILE 69 11.078 -1.309 0.440 585 HG13 ILE 69 3HG1 ILE 69 10.893 -0.105 -0.829 586 HG21 ILE 69 1HG2 ILE 69 8.233 -2.375 0.608 587 HG22 ILE 69 2HG2 ILE 69 9.651 -3.403 0.414 588 HG23 ILE 69 3HG2 ILE 69 8.299 -3.541 -0.713 589 HD11 ILE 69 3HD1 ILE 69 10.199 0.749 1.328 590 HD12 ILE 69 1HD1 ILE 69 8.990 -0.525 1.464 591 HD13 ILE 69 2HD1 ILE 69 8.846 0.696 0.202 592 H VAL 70 H VAL 70 9.234 -1.806 -4.246 593 HA VAL 70 HA VAL 70 7.550 -3.991 -4.807 594 HB VAL 70 HB VAL 70 8.632 -1.667 -6.454 595 HG11 VAL 70 1HG1 VAL 70 6.914 -3.889 -7.611 596 HG12 VAL 70 2HG1 VAL 70 8.563 -3.480 -8.089 597 HG13 VAL 70 3HG1 VAL 70 7.250 -2.345 -8.399 598 HG21 VAL 70 3HG2 VAL 70 5.792 -2.451 -5.684 599 HG22 VAL 70 1HG2 VAL 70 6.255 -0.987 -6.557 600 HG23 VAL 70 2HG2 VAL 70 6.774 -1.221 -4.886 601 H GLU 71 H GLU 71 10.852 -3.160 -5.784 602 HA GLU 71 HA GLU 71 11.418 -5.121 -7.649 603 HB2 GLU 71 2HB GLU 71 12.876 -3.108 -6.292 604 HB3 GLU 71 3HB GLU 71 13.739 -4.581 -5.890 605 HG2 GLU 71 2HG GLU 71 13.125 -3.621 -8.704 606 HG3 GLU 71 3HG GLU 71 14.658 -3.392 -7.870 607 H TYR 72 H TYR 72 11.545 -5.312 -4.120 608 HA TYR 72 HA TYR 72 12.424 -8.034 -3.930 609 HB2 TYR 72 2HB TYR 72 12.805 -6.473 -2.083 610 HB3 TYR 72 3HB TYR 72 11.081 -6.177 -1.915 611 HD1 TYR 72 HD1 TYR 72 13.750 -8.743 -1.443 612 HD2 TYR 72 HD2 TYR 72 9.705 -7.651 -0.590 613 HE1 TYR 72 HE1 TYR 72 13.584 -10.585 0.174 614 HE2 TYR 72 HE2 TYR 72 9.543 -9.494 1.014 615 HH TYR 72 HH TYR 72 10.604 -11.601 1.502 616 H ALA 73 H ALA 73 9.244 -6.424 -3.710 617 HA ALA 73 HA ALA 73 7.687 -8.608 -2.883 618 HB1 ALA 73 3HB ALA 73 6.830 -6.166 -4.464 619 HB2 ALA 73 1HB ALA 73 6.973 -6.256 -2.708 620 HB3 ALA 73 2HB ALA 73 5.763 -7.234 -3.546 621 H GLN 74 H GLN 74 8.732 -7.604 -6.075 622 HA GLN 74 HA GLN 74 7.033 -9.329 -7.597 623 HB2 GLN 74 2HB GLN 74 9.631 -7.923 -8.339 624 HB3 GLN 74 3HB GLN 74 8.588 -8.754 -9.485 625 HG2 GLN 74 2HG GLN 74 7.860 -6.292 -7.870 626 HG3 GLN 74 3HG GLN 74 8.266 -6.317 -9.580 627 HE21 GLN 74 1HE2 GLN 74 6.770 -7.253 -11.047 628 HE22 GLN 74 2HE2 GLN 74 5.099 -7.418 -10.638 629 H LYS 75 H LYS 75 10.241 -9.670 -6.100 630 HA LYS 75 HA LYS 75 10.982 -12.163 -7.305 631 HB2 LYS 75 2HB LYS 75 11.837 -11.226 -4.524 632 HB3 LYS 75 3HB LYS 75 12.684 -12.361 -5.571 633 HG2 LYS 75 2HG LYS 75 12.361 -9.384 -5.974 634 HG3 LYS 75 3HG LYS 75 13.846 -10.239 -5.553 635 HD2 LYS 75 2HD LYS 75 13.860 -11.331 -7.769 636 HD3 LYS 75 3HD LYS 75 12.326 -10.554 -8.177 637 HE2 LYS 75 2HE LYS 75 13.446 -8.330 -7.949 638 HE3 LYS 75 3HE LYS 75 14.980 -9.166 -7.683 639 HZ1 LYS 75 3HZ LYS 75 13.301 -9.468 -10.110 640 HZ2 LYS 75 1HZ LYS 75 14.845 -10.116 -9.862 641 HZ3 LYS 75 2HZ LYS 75 14.636 -8.444 -9.994 642 H GLU 76 H GLU 76 9.189 -11.266 -4.429 643 HA GLU 76 HA GLU 76 8.660 -13.829 -3.341 644 HB2 GLU 76 2HB GLU 76 7.073 -11.225 -3.143 645 HB3 GLU 76 3HB GLU 76 6.846 -12.620 -2.094 646 HG2 GLU 76 2HG GLU 76 9.489 -11.156 -2.281 647 HG3 GLU 76 3HG GLU 76 8.205 -10.643 -1.193 648 H GLY 77 H GLY 77 7.249 -12.020 -5.976 649 HA2 GLY 77 2HA GLY 77 5.759 -12.611 -7.618 650 HA3 GLY 77 3HA GLY 77 5.715 -14.240 -6.953 651 H LEU 78 H LEU 78 4.983 -11.247 -5.263 652 HA LEU 78 HA LEU 78 2.372 -12.270 -4.460 653 HB2 LEU 78 2HB LEU 78 3.960 -9.830 -3.587 654 HB3 LEU 78 3HB LEU 78 2.381 -10.257 -2.937 655 HG LEU 78 HG LEU 78 4.959 -11.837 -2.644 656 HD11 LEU 78 1HD1 LEU 78 3.227 -10.470 -0.571 657 HD12 LEU 78 2HD1 LEU 78 4.797 -9.911 -1.160 658 HD13 LEU 78 3HD1 LEU 78 4.686 -11.416 -0.253 659 HD21 LEU 78 3HD2 LEU 78 3.689 -13.469 -1.327 660 HD22 LEU 78 1HD2 LEU 78 3.122 -13.411 -2.991 661 HD23 LEU 78 2HD2 LEU 78 2.187 -12.632 -1.713 662 H ARG 79 H ARG 79 0.512 -10.924 -4.446 663 HA ARG 79 HA ARG 79 0.104 -9.442 -6.910 664 HB2 ARG 79 2HB ARG 79 -1.537 -11.159 -5.869 665 HB3 ARG 79 3HB ARG 79 -1.906 -9.945 -4.654 666 HG2 ARG 79 2HG ARG 79 -2.273 -9.466 -7.627 667 HG3 ARG 79 3HG ARG 79 -3.532 -10.157 -6.609 668 HD2 ARG 79 2HD ARG 79 -3.710 -8.129 -5.321 669 HD3 ARG 79 3HD ARG 79 -2.273 -7.440 -6.082 670 HE ARG 79 HE ARG 79 -4.876 -7.904 -7.417 671 HH11 ARG 79 1HH1 ARG 79 -1.811 -6.182 -7.264 672 HH12 ARG 79 2HH1 ARG 79 -2.236 -5.090 -8.529 673 HH21 ARG 79 1HH2 ARG 79 -5.416 -6.436 -9.045 674 HH22 ARG 79 2HH2 ARG 79 -4.283 -5.229 -9.548 675 H VAL 80 H VAL 80 0.996 -7.439 -6.819 676 HA VAL 80 HA VAL 80 0.919 -5.882 -4.303 677 HB VAL 80 HB VAL 80 2.778 -5.464 -6.703 678 HG11 VAL 80 1HG1 VAL 80 2.426 -3.416 -5.376 679 HG12 VAL 80 2HG1 VAL 80 4.075 -4.013 -5.174 680 HG13 VAL 80 3HG1 VAL 80 2.877 -4.277 -3.901 681 HG21 VAL 80 3HG2 VAL 80 4.551 -6.508 -5.336 682 HG22 VAL 80 1HG2 VAL 80 3.232 -7.642 -5.638 683 HG23 VAL 80 2HG2 VAL 80 3.378 -6.856 -4.064 684 H LEU 81 H LEU 81 -0.369 -4.212 -4.265 685 HA LEU 81 HA LEU 81 -1.440 -2.933 -6.691 686 HB2 LEU 81 2HB LEU 81 -2.954 -4.787 -5.810 687 HB3 LEU 81 3HB LEU 81 -3.058 -3.907 -4.314 688 HG LEU 81 HG LEU 81 -4.215 -2.044 -5.460 689 HD11 LEU 81 1HD1 LEU 81 -3.989 -3.823 -7.886 690 HD12 LEU 81 2HD1 LEU 81 -3.249 -2.239 -7.649 691 HD13 LEU 81 3HD1 LEU 81 -4.995 -2.381 -7.778 692 HD21 LEU 81 3HD2 LEU 81 -5.575 -3.802 -4.421 693 HD22 LEU 81 1HD2 LEU 81 -5.506 -4.762 -5.903 694 HD23 LEU 81 2HD2 LEU 81 -6.355 -3.212 -5.889 695 H VAL 82 H VAL 82 -0.673 -0.882 -6.384 696 HA VAL 82 HA VAL 82 -0.455 0.184 -3.642 697 HB VAL 82 HB VAL 82 0.996 1.953 -4.589 698 HG11 VAL 82 1HG1 VAL 82 1.866 -0.850 -5.417 699 HG12 VAL 82 2HG1 VAL 82 2.041 -0.134 -3.816 700 HG13 VAL 82 3HG1 VAL 82 2.943 0.531 -5.174 701 HG21 VAL 82 3HG2 VAL 82 0.048 2.160 -6.842 702 HG22 VAL 82 1HG2 VAL 82 0.640 0.552 -7.263 703 HG23 VAL 82 2HG2 VAL 82 1.783 1.856 -6.929 704 H ILE 83 H ILE 83 -1.862 1.565 -2.901 705 HA ILE 83 HA ILE 83 -3.852 2.852 -4.650 706 HB ILE 83 HB ILE 83 -3.862 2.280 -1.649 707 HG12 ILE 83 2HG1 ILE 83 -5.597 1.195 -3.918 708 HG13 ILE 83 3HG1 ILE 83 -4.322 0.314 -3.082 709 HG21 ILE 83 1HG2 ILE 83 -6.145 3.237 -1.557 710 HG22 ILE 83 2HG2 ILE 83 -6.003 3.743 -3.241 711 HG23 ILE 83 3HG2 ILE 83 -4.953 4.457 -2.015 712 HD11 ILE 83 3HD1 ILE 83 -5.615 0.446 -1.006 713 HD12 ILE 83 1HD1 ILE 83 -6.474 -0.384 -2.302 714 HD13 ILE 83 2HD1 ILE 83 -6.915 1.269 -1.880 715 H LYS 84 H LYS 84 -3.316 4.906 -5.157 716 HA LYS 84 HA LYS 84 -1.939 6.655 -3.188 717 HB2 LYS 84 2HB LYS 84 -0.736 7.651 -5.263 718 HB3 LYS 84 3HB LYS 84 -0.190 6.071 -4.714 719 HG2 LYS 84 2HG LYS 84 -1.653 5.031 -6.484 720 HG3 LYS 84 3HG LYS 84 -1.979 6.649 -7.094 721 HD2 LYS 84 2HD LYS 84 0.798 5.421 -6.921 722 HD3 LYS 84 3HD LYS 84 -0.226 5.335 -8.350 723 HE2 LYS 84 2HE LYS 84 1.214 7.116 -8.808 724 HE3 LYS 84 3HE LYS 84 -0.263 7.908 -8.253 725 HZ1 LYS 84 3HZ LYS 84 2.049 7.322 -6.485 726 HZ2 LYS 84 1HZ LYS 84 0.724 8.306 -6.141 727 HZ3 LYS 84 2HZ LYS 84 1.861 8.790 -7.293 728 H VAL 85 H VAL 85 -2.929 8.567 -2.871 729 HA VAL 85 HA VAL 85 -5.328 9.194 -4.395 730 HB VAL 85 HB VAL 85 -4.096 10.681 -2.018 731 HG11 VAL 85 1HG1 VAL 85 -6.868 10.987 -3.238 732 HG12 VAL 85 2HG1 VAL 85 -5.554 12.161 -3.346 733 HG13 VAL 85 3HG1 VAL 85 -6.286 11.801 -1.782 734 HG21 VAL 85 3HG2 VAL 85 -5.840 9.586 -0.640 735 HG22 VAL 85 1HG2 VAL 85 -4.773 8.397 -1.394 736 HG23 VAL 85 2HG2 VAL 85 -6.388 8.676 -2.051 737 H ALA 86 H ALA 86 -4.957 10.066 -6.327 738 HA ALA 86 HA ALA 86 -2.744 11.645 -7.091 739 HB1 ALA 86 3HB ALA 86 -4.042 10.349 -8.722 740 HB2 ALA 86 1HB ALA 86 -4.018 12.056 -9.173 741 HB3 ALA 86 2HB ALA 86 -5.457 11.360 -8.425 742 H GLN 87 H GLN 87 -2.442 13.841 -7.098 743 HA GLN 87 HA GLN 87 -4.664 15.620 -6.294 744 HB2 GLN 87 2HB GLN 87 -1.843 15.636 -5.090 745 HB3 GLN 87 3HB GLN 87 -3.053 16.883 -4.808 746 HG2 GLN 87 2HG GLN 87 -4.530 15.161 -3.763 747 HG3 GLN 87 3HG GLN 87 -3.246 13.973 -3.977 748 HE21 GLN 87 1HE2 GLN 87 -1.425 14.066 -2.591 749 HE22 GLN 87 2HE2 GLN 87 -1.410 15.041 -1.164 750 H ASP 88 H ASP 88 -3.777 15.065 -8.863 751 HA ASP 88 HA ASP 88 -3.303 16.006 -10.866 752 HB2 ASP 88 2HB ASP 88 -4.859 17.761 -9.849 753 HB3 ASP 88 3HB ASP 88 -3.435 18.679 -9.392 754 H GLN 89 H GLN 89 -1.089 15.299 -9.042 755 HA GLN 89 HA GLN 89 1.052 17.252 -9.499 756 HB2 GLN 89 2HB GLN 89 1.130 14.588 -8.015 757 HB3 GLN 89 3HB GLN 89 2.387 15.819 -8.000 758 HG2 GLN 89 2HG GLN 89 -0.408 16.143 -6.877 759 HG3 GLN 89 3HG GLN 89 1.038 15.794 -5.932 760 HE21 GLN 89 1HE2 GLN 89 -0.819 18.060 -5.755 761 HE22 GLN 89 2HE2 GLN 89 0.141 19.483 -5.959 762 H GLU 90 H GLU 90 2.432 17.089 -11.153 763 HA GLU 90 HA GLU 90 2.324 15.156 -13.192 764 HB2 GLU 90 2HB GLU 90 3.170 17.429 -13.579 765 HB3 GLU 90 3HB GLU 90 4.536 17.137 -12.504 766 HG2 GLU 90 2HG GLU 90 5.326 15.345 -14.090 767 HG3 GLU 90 3HG GLU 90 4.027 15.796 -15.189 768 H LEU 91 H LEU 91 4.466 15.495 -10.403 769 HA LEU 91 HA LEU 91 6.383 13.512 -11.056 770 HB2 LEU 91 2HB LEU 91 5.557 14.649 -8.345 771 HB3 LEU 91 3HB LEU 91 6.894 13.532 -8.556 772 HG LEU 91 HG LEU 91 8.003 15.275 -10.062 773 HD11 LEU 91 1HD1 LEU 91 5.879 17.131 -8.960 774 HD12 LEU 91 2HD1 LEU 91 6.049 16.622 -10.641 775 HD13 LEU 91 3HD1 LEU 91 7.301 17.611 -9.893 776 HD21 LEU 91 3HD2 LEU 91 8.736 14.921 -7.755 777 HD22 LEU 91 1HD2 LEU 91 7.523 16.062 -7.168 778 HD23 LEU 91 2HD2 LEU 91 8.854 16.626 -8.184 779 H LEU 92 H LEU 92 3.340 13.461 -9.330 780 HA LEU 92 HA LEU 92 3.388 10.792 -8.375 781 HB2 LEU 92 2HB LEU 92 2.010 12.515 -7.374 782 HB3 LEU 92 3HB LEU 92 1.141 12.780 -8.866 783 HG LEU 92 HG LEU 92 0.919 10.056 -7.574 784 HD11 LEU 92 1HD1 LEU 92 0.616 11.585 -5.679 785 HD12 LEU 92 2HD1 LEU 92 -0.884 10.763 -6.098 786 HD13 LEU 92 3HD1 LEU 92 -0.642 12.449 -6.567 787 HD21 LEU 92 3HD2 LEU 92 -1.128 11.767 -9.041 788 HD22 LEU 92 1HD2 LEU 92 -1.376 10.114 -8.469 789 HD23 LEU 92 2HD2 LEU 92 -0.206 10.439 -9.746 790 H GLU 93 H GLU 93 2.127 12.316 -11.326 791 HA GLU 93 HA GLU 93 0.774 9.968 -12.310 792 HB2 GLU 93 2HB GLU 93 1.416 12.648 -13.606 793 HB3 GLU 93 3HB GLU 93 0.436 11.398 -14.374 794 HG2 GLU 93 2HG GLU 93 -1.264 11.585 -12.641 795 HG3 GLU 93 3HG GLU 93 -0.249 12.690 -11.713 796 H ARG 94 H ARG 94 3.941 11.432 -12.805 797 HA ARG 94 HA ARG 94 4.757 9.830 -15.028 798 HB2 ARG 94 2HB ARG 94 5.918 11.934 -14.490 799 HB3 ARG 94 3HB ARG 94 6.391 11.311 -12.913 800 HG2 ARG 94 2HG ARG 94 7.826 9.611 -14.019 801 HG3 ARG 94 3HG ARG 94 7.350 10.243 -15.598 802 HD2 ARG 94 2HD ARG 94 8.787 11.855 -13.461 803 HD3 ARG 94 3HD ARG 94 9.594 11.049 -14.808 804 HE ARG 94 HE ARG 94 8.073 12.523 -16.249 805 HH11 ARG 94 1HH1 ARG 94 9.329 13.586 -13.139 806 HH12 ARG 94 2HH1 ARG 94 9.295 15.266 -13.569 807 HH21 ARG 94 1HH2 ARG 94 8.074 14.719 -16.816 808 HH22 ARG 94 2HH2 ARG 94 8.579 15.912 -15.661 809 H PHE 95 H PHE 95 5.364 9.679 -11.519 810 HA PHE 95 HA PHE 95 6.815 7.282 -11.374 811 HB2 PHE 95 2HB PHE 95 6.666 8.984 -9.553 812 HB3 PHE 95 3HB PHE 95 4.986 8.544 -9.273 813 HD1 PHE 95 HD2 PHE 95 8.499 7.382 -8.982 814 HD2 PHE 95 HD1 PHE 95 4.415 6.577 -7.949 815 HE1 PHE 95 HE2 PHE 95 9.230 5.649 -7.401 816 HE2 PHE 95 HE1 PHE 95 5.170 4.846 -6.375 817 HZ PHE 95 HZ PHE 95 7.568 4.379 -6.104 818 H TYR 96 H TYR 96 3.379 7.939 -11.358 819 HA TYR 96 HA TYR 96 2.206 5.553 -10.628 820 HB2 TYR 96 2HB TYR 96 0.813 7.464 -10.903 821 HB3 TYR 96 3HB TYR 96 1.393 7.776 -12.525 822 HD1 TYR 96 HD1 TYR 96 -0.744 5.528 -10.501 823 HD2 TYR 96 HD2 TYR 96 0.241 6.831 -14.442 824 HE1 TYR 96 HE1 TYR 96 -2.681 4.342 -11.367 825 HE2 TYR 96 HE2 TYR 96 -1.717 5.638 -15.324 826 HH TYR 96 HH TYR 96 -4.221 4.595 -13.504 827 H GLU 97 H GLU 97 3.614 6.479 -13.743 828 HA GLU 97 HA GLU 97 2.532 4.307 -15.250 829 HB2 GLU 97 2HB GLU 97 3.278 6.404 -16.356 830 HB3 GLU 97 3HB GLU 97 4.947 6.042 -15.914 831 HG2 GLU 97 2HG GLU 97 4.108 3.710 -17.265 832 HG3 GLU 97 3HG GLU 97 3.318 5.000 -18.153 833 H GLN 98 H GLN 98 5.669 4.965 -13.685 834 HA GLN 98 HA GLN 98 7.166 2.830 -14.668 835 HB2 GLN 98 2HB GLN 98 7.375 4.463 -12.125 836 HB3 GLN 98 3HB GLN 98 8.478 3.112 -12.395 837 HG2 GLN 98 2HG GLN 98 9.663 5.013 -13.112 838 HG3 GLN 98 3HG GLN 98 9.122 4.237 -14.597 839 HE21 GLN 98 1HE2 GLN 98 7.370 5.219 -15.758 840 HE22 GLN 98 2HE2 GLN 98 7.000 6.892 -15.545 841 H LEU 99 H LEU 99 5.047 2.931 -11.858 842 HA LEU 99 HA LEU 99 5.520 0.435 -10.685 843 HB2 LEU 99 2HB LEU 99 2.969 2.078 -10.911 844 HB3 LEU 99 3HB LEU 99 3.143 0.707 -9.824 845 HG LEU 99 HG LEU 99 5.040 3.073 -9.640 846 HD11 LEU 99 1HD1 LEU 99 3.627 4.074 -7.914 847 HD12 LEU 99 2HD1 LEU 99 2.366 2.880 -8.234 848 HD13 LEU 99 3HD1 LEU 99 2.817 4.046 -9.479 849 HD21 LEU 99 3HD2 LEU 99 5.290 2.318 -7.315 850 HD22 LEU 99 1HD2 LEU 99 5.693 1.036 -8.459 851 HD23 LEU 99 2HD2 LEU 99 4.145 1.006 -7.609 852 H LYS 100 H LYS 100 3.157 1.363 -13.162 853 HA LYS 100 HA LYS 100 2.117 -1.279 -13.596 854 HB2 LYS 100 2HB LYS 100 1.750 1.183 -15.354 855 HB3 LYS 100 3HB LYS 100 0.714 -0.237 -15.279 856 HG2 LYS 100 2HG LYS 100 0.670 0.675 -12.638 857 HG3 LYS 100 3HG LYS 100 0.753 2.174 -13.558 858 HD2 LYS 100 2HD LYS 100 -1.574 1.634 -13.141 859 HD3 LYS 100 3HD LYS 100 -1.258 1.434 -14.867 860 HE2 LYS 100 2HE LYS 100 -1.086 -1.005 -14.559 861 HE3 LYS 100 3HE LYS 100 -1.345 -0.817 -12.825 862 HZ1 LYS 100 3HZ LYS 100 -3.378 -1.462 -13.879 863 HZ2 LYS 100 1HZ LYS 100 -3.286 -0.177 -14.979 864 HZ3 LYS 100 2HZ LYS 100 -3.538 0.126 -13.338 865 H LYS 101 H LYS 101 4.651 0.621 -14.940 866 HA LYS 101 HA LYS 101 4.923 -0.635 -17.515 867 HB2 LYS 101 2HB LYS 101 5.627 1.786 -16.706 868 HB3 LYS 101 3HB LYS 101 7.079 1.002 -16.107 869 HG2 LYS 101 2HG LYS 101 7.576 1.968 -18.238 870 HG3 LYS 101 3HG LYS 101 7.528 0.214 -18.461 871 HD2 LYS 101 2HD LYS 101 5.381 0.316 -19.537 872 HD3 LYS 101 3HD LYS 101 5.123 1.989 -19.039 873 HE2 LYS 101 2HE LYS 101 7.280 1.107 -20.990 874 HE3 LYS 101 3HE LYS 101 5.697 1.725 -21.463 875 HZ1 LYS 101 3HZ LYS 101 6.208 3.812 -20.375 876 HZ2 LYS 101 1HZ LYS 101 7.401 3.444 -21.515 877 HZ3 LYS 101 2HZ LYS 101 7.708 3.223 -19.868 878 H ASP 102 H ASP 102 6.146 -1.085 -14.290 879 HA ASP 102 HA ASP 102 8.164 -3.058 -14.986 880 HB2 ASP 102 2HB ASP 102 8.568 -1.567 -13.072 881 HB3 ASP 102 3HB ASP 102 7.085 -2.105 -12.291 882 H GLY 103 H GLY 103 5.387 -3.262 -12.684 883 HA2 GLY 103 2HA GLY 103 3.854 -5.215 -13.915 884 HA3 GLY 103 3HA GLY 103 5.088 -6.096 -13.019 885 H VAL 104 H VAL 104 3.331 -3.103 -12.212 886 HA VAL 104 HA VAL 104 2.063 -4.422 -9.875 887 HB VAL 104 HB VAL 104 3.448 -1.688 -9.866 888 HG11 VAL 104 1HG1 VAL 104 1.398 -1.600 -8.491 889 HG12 VAL 104 2HG1 VAL 104 2.846 -1.508 -7.488 890 HG13 VAL 104 3HG1 VAL 104 1.937 -3.018 -7.585 891 HG21 VAL 104 3HG2 VAL 104 4.956 -2.663 -8.184 892 HG22 VAL 104 1HG2 VAL 104 5.030 -3.562 -9.701 893 HG23 VAL 104 2HG2 VAL 104 4.132 -4.217 -8.330 894 H ASP 105 H ASP 105 -0.067 -3.968 -9.696 895 HA ASP 105 HA ASP 105 -1.360 -2.183 -11.604 896 HB2 ASP 105 2HB ASP 105 -2.190 -4.552 -10.905 897 HB3 ASP 105 3HB ASP 105 -2.720 -3.807 -9.430 898 H VAL 106 H VAL 106 -2.809 -0.453 -10.889 899 HA VAL 106 HA VAL 106 -2.168 0.680 -8.227 900 HB VAL 106 HB VAL 106 -2.030 2.329 -10.799 901 HG11 VAL 106 1HG1 VAL 106 -1.289 3.028 -7.939 902 HG12 VAL 106 2HG1 VAL 106 -2.703 3.607 -8.825 903 HG13 VAL 106 3HG1 VAL 106 -1.086 4.080 -9.344 904 HG21 VAL 106 3HG2 VAL 106 0.330 1.345 -9.158 905 HG22 VAL 106 1HG2 VAL 106 0.406 2.470 -10.516 906 HG23 VAL 106 2HG2 VAL 106 -0.104 0.801 -10.775 907 H ARG 107 H ARG 107 -3.887 1.735 -7.260 908 HA ARG 107 HA ARG 107 -6.167 2.649 -8.938 909 HB2 ARG 107 2HB ARG 107 -6.108 1.736 -6.024 910 HB3 ARG 107 3HB ARG 107 -7.387 2.789 -6.614 911 HG2 ARG 107 2HG ARG 107 -8.229 0.547 -6.643 912 HG3 ARG 107 3HG ARG 107 -7.981 1.043 -8.319 913 HD2 ARG 107 2HD ARG 107 -5.703 -0.153 -8.147 914 HD3 ARG 107 3HD ARG 107 -6.319 -0.857 -6.656 915 HE ARG 107 HE ARG 107 -7.921 -2.067 -7.903 916 HH11 ARG 107 1HH1 ARG 107 -5.698 -0.307 -9.993 917 HH12 ARG 107 2HH1 ARG 107 -6.051 -1.286 -11.375 918 HH21 ARG 107 1HH2 ARG 107 -8.247 -3.390 -9.698 919 HH22 ARG 107 2HH2 ARG 107 -7.486 -3.018 -11.212 920 H VAL 108 H VAL 108 -5.635 4.758 -9.448 921 HA VAL 108 HA VAL 108 -4.842 6.609 -7.323 922 HB VAL 108 HB VAL 108 -5.128 8.422 -9.131 923 HG11 VAL 108 1HG1 VAL 108 -3.061 6.256 -9.668 924 HG12 VAL 108 2HG1 VAL 108 -2.920 7.556 -8.485 925 HG13 VAL 108 3HG1 VAL 108 -2.967 7.938 -10.205 926 HG21 VAL 108 3HG2 VAL 108 -5.291 6.035 -11.016 927 HG22 VAL 108 1HG2 VAL 108 -5.120 7.727 -11.500 928 HG23 VAL 108 2HG2 VAL 108 -6.591 7.182 -10.692 929 H THR 109 H THR 109 -6.327 7.309 -5.965 930 HA THR 109 HA THR 109 -9.156 6.919 -6.560 931 HB THR 109 HB THR 109 -7.901 7.898 -3.960 932 HG1 THR 109 HG1 THR 109 -7.966 5.402 -5.183 933 HG21 THR 109 3HG2 THR 109 -10.369 8.191 -4.114 934 HG22 THR 109 1HG2 THR 109 -9.932 6.961 -2.928 935 HG23 THR 109 2HG2 THR 109 -10.541 6.478 -4.510 936 H ASP 110 H ASP 110 -6.896 9.549 -5.887 937 HA ASP 110 HA ASP 110 -6.944 11.804 -6.046 938 HB2 ASP 110 2HB ASP 110 -7.805 11.078 -8.412 939 HB3 ASP 110 3HB ASP 110 -9.389 11.571 -7.849 940 H ASN 111 H ASN 111 -8.602 10.378 -4.015 941 HA ASN 111 HA ASN 111 -10.380 12.399 -3.016 942 HB2 ASN 111 2HB ASN 111 -11.709 11.352 -4.896 943 HB3 ASN 111 3HB ASN 111 -11.559 9.787 -4.108 944 HD21 ASN 111 1HD2 ASN 111 -13.116 12.901 -4.035 945 HD22 ASN 111 2HD2 ASN 111 -14.310 12.502 -2.850 946 H GLU 112 H GLU 112 -11.223 11.761 -0.913 947 HA GLU 112 HA GLU 112 -9.385 9.938 0.514 948 HB2 GLU 112 2HB GLU 112 -11.263 12.077 1.604 949 HB3 GLU 112 3HB GLU 112 -9.975 11.261 2.492 950 HG2 GLU 112 2HG GLU 112 -8.270 12.427 1.313 951 HG3 GLU 112 3HG GLU 112 -9.377 12.940 0.041 952 H ASP 113 H ASP 113 -12.774 10.641 -0.028 953 HA ASP 113 HA ASP 113 -13.963 9.000 1.950 954 HB2 ASP 113 2HB ASP 113 -15.144 10.900 0.973 955 HB3 ASP 113 3HB ASP 113 -15.030 10.213 -0.639 956 H GLU 114 H GLU 114 -13.657 8.517 -1.589 957 HA GLU 114 HA GLU 114 -14.549 5.843 -1.669 958 HB2 GLU 114 2HB GLU 114 -14.629 7.131 -3.675 959 HB3 GLU 114 3HB GLU 114 -12.937 7.572 -3.573 960 HG2 GLU 114 2HG GLU 114 -13.433 5.983 -5.420 961 HG3 GLU 114 3HG GLU 114 -12.237 5.382 -4.281 962 H ALA 115 H ALA 115 -11.396 7.217 -0.945 963 HA ALA 115 HA ALA 115 -9.782 4.920 -1.327 964 HB1 ALA 115 3HB ALA 115 -8.852 7.190 -1.144 965 HB2 ALA 115 1HB ALA 115 -8.112 6.108 0.037 966 HB3 ALA 115 2HB ALA 115 -9.344 7.268 0.549 967 H LYS 116 H LYS 116 -11.293 6.260 1.643 968 HA LYS 116 HA LYS 116 -10.364 4.180 3.363 969 HB2 LYS 116 2HB LYS 116 -11.845 5.199 5.082 970 HB3 LYS 116 3HB LYS 116 -10.812 6.373 4.285 971 HG2 LYS 116 2HG LYS 116 -12.749 7.058 2.862 972 HG3 LYS 116 3HG LYS 116 -13.772 5.954 3.781 973 HD2 LYS 116 2HD LYS 116 -12.267 8.339 4.945 974 HD3 LYS 116 3HD LYS 116 -13.983 8.317 4.541 975 HE2 LYS 116 2HE LYS 116 -14.294 6.465 6.207 976 HE3 LYS 116 3HE LYS 116 -12.601 6.652 6.667 977 HZ1 LYS 116 3HZ LYS 116 -13.093 8.960 7.284 978 HZ2 LYS 116 1HZ LYS 116 -14.004 7.858 8.181 979 HZ3 LYS 116 2HZ LYS 116 -14.721 8.718 6.918 980 H LYS 117 H LYS 117 -13.451 4.730 1.680 981 HA LYS 117 HA LYS 117 -15.003 2.684 2.816 982 HB2 LYS 117 2HB LYS 117 -15.073 3.951 0.046 983 HB3 LYS 117 3HB LYS 117 -16.258 2.750 0.554 984 HG2 LYS 117 2HG LYS 117 -16.927 4.238 2.423 985 HG3 LYS 117 3HG LYS 117 -15.795 5.458 1.835 986 HD2 LYS 117 2HD LYS 117 -17.051 5.704 -0.240 987 HD3 LYS 117 3HD LYS 117 -18.106 4.350 0.187 988 HE2 LYS 117 2HE LYS 117 -17.937 7.010 1.649 989 HE3 LYS 117 3HE LYS 117 -19.238 6.495 0.575 990 HZ1 LYS 117 3HZ LYS 117 -19.694 4.660 2.124 991 HZ2 LYS 117 1HZ LYS 117 -19.883 6.175 2.853 992 HZ3 LYS 117 2HZ LYS 117 -18.505 5.250 3.172 993 H ARG 118 H ARG 118 -12.893 2.654 -0.046 994 HA ARG 118 HA ARG 118 -13.401 -0.052 -0.769 995 HB2 ARG 118 2HB ARG 118 -12.652 1.754 -2.352 996 HB3 ARG 118 3HB ARG 118 -11.064 1.714 -1.595 997 HG2 ARG 118 2HG ARG 118 -10.773 -0.640 -2.331 998 HG3 ARG 118 3HG ARG 118 -12.376 -0.597 -3.074 999 HD2 ARG 118 2HD ARG 118 -10.651 -0.279 -4.778 1000 HD3 ARG 118 3HD ARG 118 -11.609 1.195 -4.613 1001 HE ARG 118 HE ARG 118 -8.830 0.784 -3.720 1002 HH11 ARG 118 1HH1 ARG 118 -11.496 3.048 -4.208 1003 HH12 ARG 118 2HH1 ARG 118 -10.487 4.441 -3.999 1004 HH21 ARG 118 1HH2 ARG 118 -7.564 2.613 -3.411 1005 HH22 ARG 118 2HH2 ARG 118 -8.262 4.191 -3.545 1006 H LEU 119 H LEU 119 -10.941 1.530 1.258 1007 HA LEU 119 HA LEU 119 -9.089 -0.567 1.518 1008 HB2 LEU 119 2HB LEU 119 -9.821 1.747 3.319 1009 HB3 LEU 119 3HB LEU 119 -8.703 0.528 3.906 1010 HG LEU 119 HG LEU 119 -8.276 2.270 1.444 1011 HD11 LEU 119 1HD1 LEU 119 -6.507 3.335 2.757 1012 HD12 LEU 119 2HD1 LEU 119 -6.920 2.339 4.156 1013 HD13 LEU 119 3HD1 LEU 119 -8.077 3.523 3.539 1014 HD21 LEU 119 3HD2 LEU 119 -6.439 0.204 2.707 1015 HD22 LEU 119 1HD2 LEU 119 -6.010 1.298 1.387 1016 HD23 LEU 119 2HD2 LEU 119 -7.246 0.069 1.141 1017 H LYS 120 H LYS 120 -11.945 0.176 3.509 1018 HA LYS 120 HA LYS 120 -11.775 -1.981 5.315 1019 HB2 LYS 120 2HB LYS 120 -13.232 -0.005 5.636 1020 HB3 LYS 120 3HB LYS 120 -14.233 -0.504 4.279 1021 HG2 LYS 120 2HG LYS 120 -14.891 -2.538 5.514 1022 HG3 LYS 120 3HG LYS 120 -13.876 -2.039 6.875 1023 HD2 LYS 120 2HD LYS 120 -15.282 -0.088 7.278 1024 HD3 LYS 120 3HD LYS 120 -16.218 -0.400 5.810 1025 HE2 LYS 120 2HE LYS 120 -16.104 -2.220 8.239 1026 HE3 LYS 120 3HE LYS 120 -17.422 -1.114 7.848 1027 HZ1 LYS 120 3HZ LYS 120 -17.817 -2.356 5.813 1028 HZ2 LYS 120 1HZ LYS 120 -17.920 -3.376 7.158 1029 HZ3 LYS 120 2HZ LYS 120 -16.547 -3.409 6.170 1030 H GLU 121 H GLU 121 -13.303 -1.649 2.157 1031 HA GLU 121 HA GLU 121 -14.621 -4.134 1.960 1032 HB2 GLU 121 2HB GLU 121 -15.125 -2.146 0.549 1033 HB3 GLU 121 3HB GLU 121 -13.555 -2.293 -0.225 1034 HG2 GLU 121 2HG GLU 121 -15.200 -3.151 -1.734 1035 HG3 GLU 121 3HG GLU 121 -14.266 -4.518 -1.134 1036 H LEU 122 H LEU 122 -11.273 -3.167 1.311 1037 HA LEU 122 HA LEU 122 -10.401 -5.313 -0.302 1038 HB2 LEU 122 2HB LEU 122 -8.776 -3.694 1.705 1039 HB3 LEU 122 3HB LEU 122 -8.090 -4.752 0.484 1040 HG LEU 122 HG LEU 122 -9.524 -2.119 0.048 1041 HD11 LEU 122 1HD1 LEU 122 -7.424 -1.395 -0.927 1042 HD12 LEU 122 2HD1 LEU 122 -6.705 -2.972 -0.602 1043 HD13 LEU 122 3HD1 LEU 122 -7.203 -1.931 0.735 1044 HD21 LEU 122 3HD2 LEU 122 -9.202 -2.379 -2.361 1045 HD22 LEU 122 1HD2 LEU 122 -10.266 -3.633 -1.729 1046 HD23 LEU 122 2HD2 LEU 122 -8.589 -4.017 -2.124 1047 H LEU 123 H LEU 123 -10.337 -4.853 3.206 1048 HA LEU 123 HA LEU 123 -9.017 -7.213 3.986 1049 HB2 LEU 123 2HB LEU 123 -10.902 -5.317 5.410 1050 HB3 LEU 123 3HB LEU 123 -10.340 -6.770 6.219 1051 HG LEU 123 HG LEU 123 -7.988 -5.988 5.986 1052 HD11 LEU 123 1HD1 LEU 123 -9.132 -3.404 4.920 1053 HD12 LEU 123 2HD1 LEU 123 -8.176 -4.569 4.003 1054 HD13 LEU 123 3HD1 LEU 123 -7.447 -3.705 5.356 1055 HD21 LEU 123 3HD2 LEU 123 -9.819 -4.018 7.368 1056 HD22 LEU 123 1HD2 LEU 123 -8.107 -4.280 7.717 1057 HD23 LEU 123 2HD2 LEU 123 -9.272 -5.565 8.023 1058 H GLU 124 H GLU 124 -12.340 -6.591 3.179 1059 HA GLU 124 HA GLU 124 -13.483 -8.949 4.331 1060 HB2 GLU 124 2HB GLU 124 -14.554 -6.958 2.284 1061 HB3 GLU 124 3HB GLU 124 -15.520 -8.222 3.047 1062 HG2 GLU 124 2HG GLU 124 -15.135 -7.213 5.258 1063 HG3 GLU 124 3HG GLU 124 -14.119 -5.972 4.529 1064 H LYS 125 H LYS 125 -11.965 -8.244 1.247 1065 HA LYS 125 HA LYS 125 -12.444 -10.992 0.312 1066 HB2 LYS 125 2HB LYS 125 -13.129 -10.112 -1.970 1067 HB3 LYS 125 3HB LYS 125 -14.307 -9.858 -0.688 1068 HG2 LYS 125 2HG LYS 125 -13.540 -7.498 -0.475 1069 HG3 LYS 125 3HG LYS 125 -12.409 -7.767 -1.801 1070 HD2 LYS 125 2HD LYS 125 -14.416 -6.629 -2.618 1071 HD3 LYS 125 3HD LYS 125 -14.301 -8.242 -3.323 1072 HE2 LYS 125 2HE LYS 125 -16.006 -9.082 -1.807 1073 HE3 LYS 125 3HE LYS 125 -16.033 -7.554 -0.921 1074 HZ1 LYS 125 3HZ LYS 125 -16.870 -7.954 -3.744 1075 HZ2 LYS 125 1HZ LYS 125 -16.821 -6.466 -2.949 1076 HZ3 LYS 125 2HZ LYS 125 -17.890 -7.665 -2.427 1077 H VAL 126 H VAL 126 -10.103 -10.008 1.329 1078 HA VAL 126 HA VAL 126 -7.947 -10.530 1.041 1079 HB VAL 126 HB VAL 126 -8.574 -11.193 -1.863 1080 HG11 VAL 126 1HG1 VAL 126 -6.170 -10.816 -1.581 1081 HG12 VAL 126 2HG1 VAL 126 -6.482 -12.536 -1.828 1082 HG13 VAL 126 3HG1 VAL 126 -6.128 -11.924 -0.209 1083 HG21 VAL 126 3HG2 VAL 126 -8.642 -13.552 -1.126 1084 HG22 VAL 126 1HG2 VAL 126 -9.882 -12.592 -0.316 1085 HG23 VAL 126 2HG2 VAL 126 -8.408 -13.043 0.547 1086 H GLY 127 H GLY 127 -9.291 -8.192 -1.262 1087 HA2 GLY 127 2HA GLY 127 -8.478 -5.950 -1.206 1088 HA3 GLY 127 3HA GLY 127 -6.872 -6.531 -0.817 1089 H SER 128 H SER 128 -7.900 -8.521 -3.205 1090 HA SER 128 HA SER 128 -6.413 -7.057 -5.254 1091 HB2 SER 128 2HB SER 128 -5.936 -9.480 -4.760 1092 HB3 SER 128 3HB SER 128 -7.571 -9.882 -5.282 1093 HG SER 128 HG SER 128 -6.378 -10.192 -7.056 1094 H LEU 129 H LEU 129 -8.332 -5.463 -5.181 1095 HA LEU 129 HA LEU 129 -10.722 -6.338 -6.659 1096 HB2 LEU 129 2HB LEU 129 -10.080 -3.881 -5.014 1097 HB3 LEU 129 3HB LEU 129 -11.394 -3.830 -6.177 1098 HG LEU 129 HG LEU 129 -12.465 -5.779 -5.008 1099 HD11 LEU 129 1HD1 LEU 129 -10.338 -5.377 -2.897 1100 HD12 LEU 129 2HD1 LEU 129 -10.554 -6.793 -3.924 1101 HD13 LEU 129 3HD1 LEU 129 -11.780 -6.378 -2.730 1102 HD21 LEU 129 3HD2 LEU 129 -13.347 -4.496 -3.117 1103 HD22 LEU 129 1HD2 LEU 129 -13.225 -3.499 -4.567 1104 HD23 LEU 129 2HD2 LEU 129 -12.033 -3.326 -3.273 1105 H GLU 130 H GLU 130 -11.261 -5.690 -8.609 1106 HA GLU 130 HA GLU 130 -9.810 -3.711 -10.166 1107 HB2 GLU 130 2HB GLU 130 -9.176 -5.315 -11.938 1108 HB3 GLU 130 3HB GLU 130 -8.374 -5.709 -10.421 1109 HG2 GLU 130 2HG GLU 130 -9.863 -7.582 -10.029 1110 HG3 GLU 130 3HG GLU 130 -10.888 -7.122 -11.389 1111 H HIS 131 H HIS 131 -10.766 -4.451 -12.696 1112 HA HIS 131 HA HIS 131 -12.501 -4.584 -14.112 1113 HB2 HIS 131 2HB HIS 131 -12.772 -6.838 -13.031 1114 HB3 HIS 131 3HB HIS 131 -13.925 -6.140 -11.900 1115 HD1 HIS 131 HD1 HIS 131 -13.548 -7.243 -15.455 1116 HD2 HIS 131 HD2 HIS 131 -16.500 -5.686 -12.977 1117 HE1 HIS 131 HE1 HIS 131 -15.705 -7.552 -16.696 1118 HE2 HIS 131 HE2 HIS 131 -17.482 -6.738 -15.118 1119 H HIS 132 H HIS 132 -12.673 -2.293 -13.916 1120 HA HIS 132 HA HIS 132 -14.977 -1.201 -12.453 1121 HB2 HIS 132 2HB HIS 132 -12.801 0.239 -14.045 1122 HB3 HIS 132 3HB HIS 132 -14.040 1.007 -13.057 1123 HD1 HIS 132 HD1 HIS 132 -10.652 -0.352 -12.884 1124 HD2 HIS 132 HD2 HIS 132 -13.710 0.456 -10.188 1125 HE1 HIS 132 HE1 HIS 132 -9.571 -0.349 -10.618 1126 HE2 HIS 132 HE2 HIS 132 -11.395 0.407 -9.058 1127 H HIS 133 H HIS 133 -16.554 0.028 -13.542 1128 HA HIS 133 HA HIS 133 -17.302 -0.934 -16.176 1129 HB2 HIS 133 2HB HIS 133 -18.916 -0.666 -14.241 1130 HB3 HIS 133 3HB HIS 133 -18.744 1.077 -14.384 1131 HD1 HIS 133 HD1 HIS 133 -19.873 -1.877 -16.519 1132 HD2 HIS 133 HD2 HIS 133 -20.607 2.192 -16.060 1133 HE1 HIS 133 HE1 HIS 133 -21.783 -1.357 -18.060 1134 HE2 HIS 133 HE2 HIS 133 -22.235 1.095 -17.741 1135 H HIS 134 H HIS 134 -15.247 1.444 -15.214 1136 HA HIS 134 HA HIS 134 -15.550 2.936 -17.751 1137 HB2 HIS 134 2HB HIS 134 -14.662 4.014 -15.030 1138 HB3 HIS 134 3HB HIS 134 -14.457 4.895 -16.540 1139 HD1 HIS 134 HD1 HIS 134 -16.452 5.301 -13.833 1140 HD2 HIS 134 HD2 HIS 134 -17.432 4.649 -17.816 1141 HE1 HIS 134 HE1 HIS 134 -18.778 6.214 -14.117 1142 HE2 HIS 134 HE2 HIS 134 -19.225 6.017 -16.579 1143 H HIS 135 H HIS 135 -14.076 1.938 -18.978 1144 HA HIS 135 HA HIS 135 -11.397 1.252 -17.959 1145 HB2 HIS 135 2HB HIS 135 -12.674 0.654 -20.679 1146 HB3 HIS 135 3HB HIS 135 -11.115 0.052 -20.116 1147 HD1 HIS 135 HD1 HIS 135 -14.694 -0.714 -20.100 1148 HD2 HIS 135 HD2 HIS 135 -11.352 -1.837 -17.897 1149 HE1 HIS 135 HE1 HIS 135 -15.386 -2.764 -18.823 1150 HE2 HIS 135 HE2 HIS 135 -13.346 -3.431 -17.513 1151 H HIS 136 H HIS 136 -9.682 2.543 -18.391 1152 HA HIS 136 HA HIS 136 -9.619 4.464 -20.551 1153 HB2 HIS 136 2HB HIS 136 -9.342 6.459 -18.957 1154 HB3 HIS 136 3HB HIS 136 -10.971 5.814 -19.106 1155 HD1 HIS 136 HD1 HIS 136 -8.058 5.837 -16.674 1156 HD2 HIS 136 HD2 HIS 136 -12.124 4.994 -16.723 1157 HE1 HIS 136 HE1 HIS 136 -8.713 5.525 -14.267 1158 HE2 HIS 136 HE2 HIS 136 -11.196 5.142 -14.321 Start of MODEL 18 1 H1 MET 1 1H MET 1 -4.773 -14.705 -2.370 2 H2 MET 1 2H MET 1 -5.194 -13.078 -2.452 3 H3 MET 1 3H MET 1 -5.948 -14.084 -1.325 4 HA MET 1 HA MET 1 -4.322 -12.689 -0.245 5 HB2 MET 1 2HB MET 1 -3.401 -15.592 -0.434 6 HB3 MET 1 3HB MET 1 -3.018 -14.480 0.877 7 HG2 MET 1 2HG MET 1 -5.380 -14.383 1.512 8 HG3 MET 1 3HG MET 1 -5.799 -15.436 0.160 9 HE1 MET 1 3HE MET 1 -6.716 -15.984 3.144 10 HE2 MET 1 1HE MET 1 -6.388 -17.709 3.322 11 HE3 MET 1 2HE MET 1 -7.108 -17.098 1.832 12 H GLY 2 H GLY 2 -1.648 -13.131 0.177 13 HA2 GLY 2 2HA GLY 2 0.468 -12.644 -0.586 14 HA3 GLY 2 3HA GLY 2 -0.016 -13.290 -2.144 15 H THR 3 H THR 3 -1.922 -10.719 -0.916 16 HA THR 3 HA THR 3 -0.905 -8.895 -2.986 17 HB THR 3 HB THR 3 -3.198 -7.749 -2.531 18 HG1 THR 3 HG1 THR 3 -4.234 -8.603 -0.888 19 HG21 THR 3 3HG2 THR 3 -3.145 -10.568 -3.677 20 HG22 THR 3 1HG2 THR 3 -2.816 -9.076 -4.563 21 HG23 THR 3 2HG2 THR 3 -4.435 -9.390 -3.938 22 H VAL 4 H VAL 4 0.480 -7.450 -2.237 23 HA VAL 4 HA VAL 4 0.418 -6.506 0.548 24 HB VAL 4 HB VAL 4 2.425 -5.930 -1.710 25 HG11 VAL 4 1HG1 VAL 4 2.417 -4.120 -0.037 26 HG12 VAL 4 2HG1 VAL 4 3.918 -5.039 0.055 27 HG13 VAL 4 3HG1 VAL 4 2.656 -5.292 1.261 28 HG21 VAL 4 3HG2 VAL 4 3.947 -7.509 -0.555 29 HG22 VAL 4 1HG2 VAL 4 2.460 -8.309 -1.077 30 HG23 VAL 4 2HG2 VAL 4 2.681 -7.875 0.620 31 H VAL 5 H VAL 5 -0.896 -4.775 0.890 32 HA VAL 5 HA VAL 5 -1.508 -2.954 -1.359 33 HB VAL 5 HB VAL 5 -3.613 -2.362 -0.059 34 HG11 VAL 5 1HG1 VAL 5 -3.659 -3.900 -1.983 35 HG12 VAL 5 2HG1 VAL 5 -4.858 -4.375 -0.780 36 HG13 VAL 5 3HG1 VAL 5 -3.341 -5.275 -0.920 37 HG21 VAL 5 3HG2 VAL 5 -2.970 -3.150 2.195 38 HG22 VAL 5 1HG2 VAL 5 -2.921 -4.816 1.614 39 HG23 VAL 5 2HG2 VAL 5 -4.453 -3.938 1.660 40 H ILE 6 H ILE 6 -0.458 -1.101 -1.273 41 HA ILE 6 HA ILE 6 0.600 -0.064 1.276 42 HB ILE 6 HB ILE 6 1.532 0.622 -1.544 43 HG12 ILE 6 2HG1 ILE 6 3.689 -0.719 -0.729 44 HG13 ILE 6 3HG1 ILE 6 2.552 -1.528 0.338 45 HG21 ILE 6 1HG2 ILE 6 3.504 1.621 -0.423 46 HG22 ILE 6 2HG2 ILE 6 2.792 1.247 1.147 47 HG23 ILE 6 3HG2 ILE 6 1.998 2.398 0.072 48 HD11 ILE 6 3HD1 ILE 6 2.961 -2.808 -1.676 49 HD12 ILE 6 1HD1 ILE 6 2.419 -1.459 -2.677 50 HD13 ILE 6 2HD1 ILE 6 1.277 -2.284 -1.612 51 H VAL 7 H VAL 7 -0.833 1.415 2.040 52 HA VAL 7 HA VAL 7 -2.423 3.101 0.281 53 HB VAL 7 HB VAL 7 -2.287 3.128 3.335 54 HG11 VAL 7 1HG1 VAL 7 -4.394 4.259 1.440 55 HG12 VAL 7 2HG1 VAL 7 -3.253 5.200 2.404 56 HG13 VAL 7 3HG1 VAL 7 -4.500 4.245 3.203 57 HG21 VAL 7 3HG2 VAL 7 -4.300 1.718 3.287 58 HG22 VAL 7 1HG2 VAL 7 -2.928 0.908 2.526 59 HG23 VAL 7 2HG2 VAL 7 -4.198 1.620 1.526 60 H VAL 8 H VAL 8 -1.473 4.812 -0.530 61 HA VAL 8 HA VAL 8 0.411 6.428 1.057 62 HB VAL 8 HB VAL 8 0.279 6.332 -1.995 63 HG11 VAL 8 1HG1 VAL 8 2.398 7.465 -0.119 64 HG12 VAL 8 2HG1 VAL 8 1.221 8.411 -1.034 65 HG13 VAL 8 3HG1 VAL 8 2.454 7.482 -1.881 66 HG21 VAL 8 3HG2 VAL 8 2.302 4.924 -1.961 67 HG22 VAL 8 1HG2 VAL 8 0.956 4.104 -1.166 68 HG23 VAL 8 2HG2 VAL 8 2.237 4.840 -0.199 69 H SER 9 H SER 9 0.170 8.615 1.039 70 HA SER 9 HA SER 9 -1.751 9.978 -0.635 71 HB2 SER 9 2HB SER 9 -2.946 11.029 1.301 72 HB3 SER 9 3HB SER 9 -3.224 9.291 1.212 73 HG SER 9 HG SER 9 -1.546 9.073 2.795 74 H ASN 10 H ASN 10 -1.546 12.313 -0.427 75 HA ASN 10 HA ASN 10 1.189 13.162 -0.183 76 HB2 ASN 10 2HB ASN 10 -0.335 14.054 -1.936 77 HB3 ASN 10 3HB ASN 10 -1.361 14.771 -0.703 78 HD21 ASN 10 1HD2 ASN 10 -0.646 16.645 0.362 79 HD22 ASN 10 2HD2 ASN 10 0.648 17.613 -0.243 80 H ASP 11 H ASP 11 -1.539 13.094 1.931 81 HA ASP 11 HA ASP 11 -0.389 15.088 3.804 82 HB2 ASP 11 2HB ASP 11 -2.654 15.567 2.734 83 HB3 ASP 11 3HB ASP 11 -3.282 14.161 3.573 84 H GLU 12 H GLU 12 -0.215 14.526 5.976 85 HA GLU 12 HA GLU 12 0.368 11.767 6.512 86 HB2 GLU 12 2HB GLU 12 1.649 13.812 7.367 87 HB3 GLU 12 3HB GLU 12 0.331 14.084 8.495 88 HG2 GLU 12 2HG GLU 12 2.075 12.968 9.686 89 HG3 GLU 12 3HG GLU 12 0.781 11.794 9.451 90 H ARG 13 H ARG 13 -2.165 14.028 7.411 91 HA ARG 13 HA ARG 13 -3.337 12.521 9.545 92 HB2 ARG 13 2HB ARG 13 -4.448 14.813 7.881 93 HB3 ARG 13 3HB ARG 13 -5.208 14.170 9.339 94 HG2 ARG 13 2HG ARG 13 -3.432 14.944 10.735 95 HG3 ARG 13 3HG ARG 13 -2.390 15.288 9.350 96 HD2 ARG 13 2HD ARG 13 -4.994 16.749 9.924 97 HD3 ARG 13 3HD ARG 13 -3.394 17.337 10.390 98 HE ARG 13 HE ARG 13 -4.008 16.778 7.547 99 HH11 ARG 13 1HH1 ARG 13 -3.118 19.131 10.026 100 HH12 ARG 13 2HH1 ARG 13 -2.739 20.370 8.869 101 HH21 ARG 13 1HH2 ARG 13 -3.475 18.398 6.058 102 HH22 ARG 13 2HH2 ARG 13 -2.944 19.955 6.623 103 H ILE 14 H ILE 14 -3.743 12.600 6.078 104 HA ILE 14 HA ILE 14 -6.219 11.217 5.902 105 HB ILE 14 HB ILE 14 -3.920 11.419 3.901 106 HG12 ILE 14 2HG1 ILE 14 -4.861 13.602 4.308 107 HG13 ILE 14 3HG1 ILE 14 -5.508 13.065 2.764 108 HG21 ILE 14 1HG2 ILE 14 -5.526 10.686 2.160 109 HG22 ILE 14 2HG2 ILE 14 -6.731 10.364 3.411 110 HG23 ILE 14 3HG2 ILE 14 -5.239 9.422 3.360 111 HD11 ILE 14 3HD1 ILE 14 -7.220 14.168 4.017 112 HD12 ILE 14 1HD1 ILE 14 -6.959 13.127 5.414 113 HD13 ILE 14 2HD1 ILE 14 -7.625 12.456 3.923 114 H LEU 15 H LEU 15 -2.835 10.121 6.075 115 HA LEU 15 HA LEU 15 -3.272 7.350 5.823 116 HB2 LEU 15 2HB LEU 15 -1.157 8.870 7.390 117 HB3 LEU 15 3HB LEU 15 -1.124 7.125 7.163 118 HG LEU 15 HG LEU 15 -1.012 9.156 4.896 119 HD11 LEU 15 1HD1 LEU 15 1.236 7.520 6.111 120 HD12 LEU 15 2HD1 LEU 15 1.002 9.261 6.295 121 HD13 LEU 15 3HD1 LEU 15 1.353 8.585 4.706 122 HD21 LEU 15 3HD2 LEU 15 -0.655 6.128 4.866 123 HD22 LEU 15 1HD2 LEU 15 -0.413 7.207 3.487 124 HD23 LEU 15 2HD2 LEU 15 -2.018 7.023 4.191 125 H GLU 16 H GLU 16 -3.516 9.519 8.625 126 HA GLU 16 HA GLU 16 -3.823 7.451 10.572 127 HB2 GLU 16 2HB GLU 16 -2.950 9.825 10.991 128 HB3 GLU 16 3HB GLU 16 -4.619 10.380 10.890 129 HG2 GLU 16 2HG GLU 16 -4.064 10.108 13.214 130 HG3 GLU 16 3HG GLU 16 -5.182 8.817 12.775 131 H GLU 17 H GLU 17 -6.058 9.688 8.971 132 HA GLU 17 HA GLU 17 -8.504 8.972 10.082 133 HB2 GLU 17 2HB GLU 17 -8.171 10.944 8.633 134 HB3 GLU 17 3HB GLU 17 -7.823 9.910 7.255 135 HG2 GLU 17 2HG GLU 17 -10.062 10.842 7.061 136 HG3 GLU 17 3HG GLU 17 -10.151 9.095 7.273 137 H LEU 18 H LEU 18 -6.857 7.687 7.232 138 HA LEU 18 HA LEU 18 -8.865 5.788 6.509 139 HB2 LEU 18 2HB LEU 18 -6.131 6.556 5.511 140 HB3 LEU 18 3HB LEU 18 -6.774 5.010 5.006 141 HG LEU 18 HG LEU 18 -8.697 6.095 3.924 142 HD11 LEU 18 1HD1 LEU 18 -7.562 8.770 4.784 143 HD12 LEU 18 2HD1 LEU 18 -9.044 8.026 5.385 144 HD13 LEU 18 3HD1 LEU 18 -8.930 8.517 3.696 145 HD21 LEU 18 3HD2 LEU 18 -7.518 7.208 2.078 146 HD22 LEU 18 1HD2 LEU 18 -6.658 5.762 2.609 147 HD23 LEU 18 2HD2 LEU 18 -6.071 7.360 3.081 148 H LEU 19 H LEU 19 -5.985 5.686 8.518 149 HA LEU 19 HA LEU 19 -5.380 2.946 8.564 150 HB2 LEU 19 2HB LEU 19 -3.922 4.660 9.570 151 HB3 LEU 19 3HB LEU 19 -5.131 4.985 10.797 152 HG LEU 19 HG LEU 19 -4.788 2.410 11.411 153 HD11 LEU 19 1HD1 LEU 19 -2.147 3.004 10.068 154 HD12 LEU 19 2HD1 LEU 19 -3.353 1.822 9.547 155 HD13 LEU 19 3HD1 LEU 19 -2.510 1.599 11.077 156 HD21 LEU 19 3HD2 LEU 19 -4.329 4.253 12.935 157 HD22 LEU 19 1HD2 LEU 19 -2.747 4.503 12.189 158 HD23 LEU 19 2HD2 LEU 19 -3.092 3.005 13.062 159 H GLU 20 H GLU 20 -7.409 4.879 10.682 160 HA GLU 20 HA GLU 20 -8.054 2.889 12.557 161 HB2 GLU 20 2HB GLU 20 -9.576 5.439 11.895 162 HB3 GLU 20 3HB GLU 20 -9.669 4.529 13.405 163 HG2 GLU 20 2HG GLU 20 -7.307 5.034 13.888 164 HG3 GLU 20 3HG GLU 20 -7.154 5.876 12.344 165 H VAL 21 H VAL 21 -9.515 3.821 9.528 166 HA VAL 21 HA VAL 21 -11.979 2.406 9.758 167 HB VAL 21 HB VAL 21 -10.478 3.233 7.230 168 HG11 VAL 21 1HG1 VAL 21 -13.433 2.597 7.618 169 HG12 VAL 21 2HG1 VAL 21 -12.266 1.620 6.724 170 HG13 VAL 21 3HG1 VAL 21 -12.707 3.225 6.134 171 HG21 VAL 21 3HG2 VAL 21 -12.538 4.779 8.849 172 HG22 VAL 21 1HG2 VAL 21 -11.844 5.291 7.311 173 HG23 VAL 21 2HG2 VAL 21 -10.817 5.148 8.734 174 H VAL 22 H VAL 22 -8.782 1.586 8.451 175 HA VAL 22 HA VAL 22 -9.386 -1.044 7.521 176 HB VAL 22 HB VAL 22 -6.714 0.201 8.354 177 HG11 VAL 22 1HG1 VAL 22 -5.614 -1.550 7.014 178 HG12 VAL 22 2HG1 VAL 22 -7.179 -2.299 6.694 179 HG13 VAL 22 3HG1 VAL 22 -6.546 -2.259 8.338 180 HG21 VAL 22 3HG2 VAL 22 -6.367 0.610 5.946 181 HG22 VAL 22 1HG2 VAL 22 -7.826 1.420 6.520 182 HG23 VAL 22 2HG2 VAL 22 -7.956 -0.076 5.592 183 H LEU 23 H LEU 23 -8.312 0.319 10.594 184 HA LEU 23 HA LEU 23 -7.663 -2.076 11.963 185 HB2 LEU 23 2HB LEU 23 -8.455 0.668 13.020 186 HB3 LEU 23 3HB LEU 23 -7.884 -0.637 14.036 187 HG LEU 23 HG LEU 23 -6.269 0.776 11.883 188 HD11 LEU 23 1HD1 LEU 23 -6.580 2.156 13.870 189 HD12 LEU 23 2HD1 LEU 23 -4.907 1.614 13.759 190 HD13 LEU 23 3HD1 LEU 23 -6.006 0.846 14.908 191 HD21 LEU 23 3HD2 LEU 23 -5.409 -1.483 13.727 192 HD22 LEU 23 1HD2 LEU 23 -4.345 -0.559 12.662 193 HD23 LEU 23 2HD2 LEU 23 -5.607 -1.575 11.974 194 H LYS 24 H LYS 24 -10.637 -0.094 11.894 195 HA LYS 24 HA LYS 24 -12.030 -1.679 13.846 196 HB2 LYS 24 2HB LYS 24 -13.979 -0.235 13.380 197 HB3 LYS 24 3HB LYS 24 -12.525 0.708 13.645 198 HG2 LYS 24 2HG LYS 24 -13.423 1.866 11.867 199 HG3 LYS 24 3HG LYS 24 -12.396 0.725 11.010 200 HD2 LYS 24 2HD LYS 24 -14.413 0.712 9.785 201 HD3 LYS 24 3HD LYS 24 -14.517 -0.746 10.770 202 HE2 LYS 24 2HE LYS 24 -15.861 1.902 11.417 203 HE3 LYS 24 3HE LYS 24 -16.653 0.526 10.662 204 HZ1 LYS 24 3HZ LYS 24 -15.546 0.638 13.412 205 HZ2 LYS 24 1HZ LYS 24 -16.184 -0.755 12.692 206 HZ3 LYS 24 2HZ LYS 24 -17.167 0.583 12.968 207 H SER 25 H SER 25 -11.804 -1.660 10.349 208 HA SER 25 HA SER 25 -13.977 -3.349 9.701 209 HB2 SER 25 2HB SER 25 -12.785 -2.033 7.989 210 HB3 SER 25 3HB SER 25 -11.308 -2.954 8.277 211 HG SER 25 HG SER 25 -12.251 -4.737 7.368 212 H ASP 26 H ASP 26 -10.532 -4.012 10.317 213 HA ASP 26 HA ASP 26 -11.066 -6.719 11.185 214 HB2 ASP 26 2HB ASP 26 -10.994 -6.929 8.681 215 HB3 ASP 26 3HB ASP 26 -9.372 -6.245 8.685 216 HA PRO 27 HA PRO 27 -7.453 -5.224 13.436 217 HB2 PRO 27 2HB PRO 27 -7.787 -6.631 15.655 218 HB3 PRO 27 3HB PRO 27 -9.098 -5.554 15.114 219 HG2 PRO 27 2HG PRO 27 -8.891 -8.541 14.848 220 HG3 PRO 27 3HG PRO 27 -10.304 -7.552 15.285 221 HD2 PRO 27 2HD PRO 27 -9.693 -8.514 12.685 222 HD3 PRO 27 3HD PRO 27 -10.883 -7.251 13.077 223 H ASN 28 H ASN 28 -7.418 -8.164 11.773 224 HA ASN 28 HA ASN 28 -4.805 -8.935 12.940 225 HB2 ASN 28 2HB ASN 28 -5.310 -11.256 13.017 226 HB3 ASN 28 3HB ASN 28 -6.653 -10.432 13.785 227 HD21 ASN 28 1HD2 ASN 28 -8.001 -9.725 11.271 228 HD22 ASN 28 2HD2 ASN 28 -8.623 -11.199 10.635 229 H VAL 29 H VAL 29 -6.261 -7.905 10.171 230 HA VAL 29 HA VAL 29 -4.260 -9.017 8.369 231 HB VAL 29 HB VAL 29 -6.221 -6.685 8.096 232 HG11 VAL 29 1HG1 VAL 29 -5.438 -6.320 5.763 233 HG12 VAL 29 2HG1 VAL 29 -4.110 -7.451 6.033 234 HG13 VAL 29 3HG1 VAL 29 -4.177 -5.938 6.938 235 HG21 VAL 29 3HG2 VAL 29 -5.941 -9.278 6.528 236 HG22 VAL 29 1HG2 VAL 29 -7.180 -8.045 6.266 237 HG23 VAL 29 2HG2 VAL 29 -7.144 -8.954 7.779 238 H LYS 30 H LYS 30 -2.287 -8.010 7.848 239 HA LYS 30 HA LYS 30 -1.037 -6.868 10.145 240 HB2 LYS 30 2HB LYS 30 0.163 -7.270 7.375 241 HB3 LYS 30 3HB LYS 30 1.053 -7.059 8.878 242 HG2 LYS 30 2HG LYS 30 -0.687 -9.432 8.139 243 HG3 LYS 30 3HG LYS 30 1.073 -9.400 8.160 244 HD2 LYS 30 2HD LYS 30 -0.627 -8.940 10.645 245 HD3 LYS 30 3HD LYS 30 -0.049 -10.529 10.150 246 HE2 LYS 30 2HE LYS 30 1.443 -9.690 11.845 247 HE3 LYS 30 3HE LYS 30 2.304 -9.667 10.313 248 HZ1 LYS 30 3HZ LYS 30 2.637 -7.675 11.715 249 HZ2 LYS 30 1HZ LYS 30 1.008 -7.281 11.517 250 HZ3 LYS 30 2HZ LYS 30 2.043 -7.315 10.180 251 H THR 31 H THR 31 -1.895 -4.807 10.510 252 HA THR 31 HA THR 31 -1.716 -2.706 8.467 253 HB THR 31 HB THR 31 -2.815 -1.279 10.230 254 HG1 THR 31 HG1 THR 31 -1.954 -2.539 12.053 255 HG21 THR 31 3HG2 THR 31 -4.223 -2.539 8.637 256 HG22 THR 31 1HG2 THR 31 -5.001 -2.426 10.219 257 HG23 THR 31 2HG2 THR 31 -4.221 -3.931 9.724 258 H VAL 32 H VAL 32 0.222 -1.718 8.230 259 HA VAL 32 HA VAL 32 1.988 -1.224 10.559 260 HB VAL 32 HB VAL 32 2.908 -2.399 7.872 261 HG11 VAL 32 1HG1 VAL 32 4.602 -0.921 8.864 262 HG12 VAL 32 2HG1 VAL 32 5.131 -2.602 8.919 263 HG13 VAL 32 3HG1 VAL 32 4.525 -1.823 10.381 264 HG21 VAL 32 3HG2 VAL 32 3.478 -4.468 9.098 265 HG22 VAL 32 1HG2 VAL 32 1.745 -4.127 9.190 266 HG23 VAL 32 2HG2 VAL 32 2.787 -3.794 10.575 267 H ARG 33 H ARG 33 2.158 1.017 10.589 268 HA ARG 33 HA ARG 33 2.625 2.469 8.042 269 HB2 ARG 33 2HB ARG 33 0.841 3.435 9.476 270 HB3 ARG 33 3HB ARG 33 1.980 3.594 10.812 271 HG2 ARG 33 2HG ARG 33 3.336 5.186 9.412 272 HG3 ARG 33 3HG ARG 33 2.116 5.059 8.145 273 HD2 ARG 33 2HD ARG 33 1.706 6.169 10.935 274 HD3 ARG 33 3HD ARG 33 1.794 7.100 9.436 275 HE ARG 33 HE ARG 33 -0.263 5.740 8.768 276 HH11 ARG 33 1HH1 ARG 33 0.379 6.673 12.101 277 HH12 ARG 33 2HH1 ARG 33 -1.306 6.681 12.541 278 HH21 ARG 33 1HH2 ARG 33 -2.447 5.758 9.399 279 HH22 ARG 33 2HH2 ARG 33 -2.869 6.171 11.036 280 H THR 34 H THR 34 4.767 2.222 7.597 281 HA THR 34 HA THR 34 6.709 3.738 8.986 282 HB THR 34 HB THR 34 6.608 1.724 10.541 283 HG1 THR 34 HG1 THR 34 8.553 3.054 10.170 284 HG21 THR 34 3HG2 THR 34 6.228 -0.048 8.826 285 HG22 THR 34 1HG2 THR 34 7.618 -0.402 9.854 286 HG23 THR 34 2HG2 THR 34 7.864 0.209 8.218 287 H ASP 35 H ASP 35 8.730 3.808 7.831 288 HA ASP 35 HA ASP 35 9.226 1.852 5.736 289 HB2 ASP 35 2HB ASP 35 8.140 3.597 4.427 290 HB3 ASP 35 3HB ASP 35 9.181 4.830 5.122 291 H ASP 36 H ASP 36 11.215 1.231 5.736 292 HA ASP 36 HA ASP 36 13.480 2.967 6.336 293 HB2 ASP 36 2HB ASP 36 12.726 1.831 8.538 294 HB3 ASP 36 3HB ASP 36 13.193 0.305 7.810 295 H LYS 37 H LYS 37 12.148 1.586 4.092 296 HA LYS 37 HA LYS 37 12.573 0.582 2.149 297 HB2 LYS 37 2HB LYS 37 15.525 0.557 2.921 298 HB3 LYS 37 3HB LYS 37 14.859 0.442 1.296 299 HG2 LYS 37 2HG LYS 37 13.957 2.785 1.586 300 HG3 LYS 37 3HG LYS 37 14.805 2.863 3.124 301 HD2 LYS 37 2HD LYS 37 16.151 3.971 1.445 302 HD3 LYS 37 3HD LYS 37 16.958 2.476 1.913 303 HE2 LYS 37 2HE LYS 37 16.047 1.392 -0.154 304 HE3 LYS 37 3HE LYS 37 15.351 2.946 -0.624 305 HZ1 LYS 37 3HZ LYS 37 18.248 2.479 -0.150 306 HZ2 LYS 37 1HZ LYS 37 17.539 3.894 -0.738 307 HZ3 LYS 37 2HZ LYS 37 17.520 2.487 -1.676 308 H GLU 38 H GLU 38 15.149 -1.013 3.979 309 HA GLU 38 HA GLU 38 14.610 -3.620 3.033 310 HB2 GLU 38 2HB GLU 38 16.284 -4.270 4.901 311 HB3 GLU 38 3HB GLU 38 16.847 -3.179 3.646 312 HG2 GLU 38 2HG GLU 38 17.673 -1.968 5.385 313 HG3 GLU 38 3HG GLU 38 16.033 -1.343 5.490 314 H LYS 39 H LYS 39 13.664 -1.927 5.958 315 HA LYS 39 HA LYS 39 12.619 -4.026 7.479 316 HB2 LYS 39 2HB LYS 39 13.052 -1.749 8.308 317 HB3 LYS 39 3HB LYS 39 11.747 -1.115 7.310 318 HG2 LYS 39 2HG LYS 39 10.117 -2.481 8.640 319 HG3 LYS 39 3HG LYS 39 11.452 -3.010 9.671 320 HD2 LYS 39 2HD LYS 39 11.875 -0.644 10.320 321 HD3 LYS 39 3HD LYS 39 10.533 -0.129 9.294 322 HE2 LYS 39 2HE LYS 39 8.960 -1.421 10.707 323 HE3 LYS 39 3HE LYS 39 10.307 -1.926 11.735 324 HZ1 LYS 39 3HZ LYS 39 10.697 0.395 12.296 325 HZ2 LYS 39 1HZ LYS 39 9.118 -0.062 12.691 326 HZ3 LYS 39 2HZ LYS 39 9.408 0.880 11.318 327 H VAL 40 H VAL 40 11.095 -2.049 4.948 328 HA VAL 40 HA VAL 40 8.432 -3.043 5.298 329 HB VAL 40 HB VAL 40 9.599 -1.680 2.830 330 HG11 VAL 40 1HG1 VAL 40 6.693 -1.918 3.741 331 HG12 VAL 40 2HG1 VAL 40 7.420 -2.757 2.369 332 HG13 VAL 40 3HG1 VAL 40 7.259 -1.001 2.341 333 HG21 VAL 40 3HG2 VAL 40 8.269 -0.430 5.264 334 HG22 VAL 40 1HG2 VAL 40 8.758 0.436 3.804 335 HG23 VAL 40 2HG2 VAL 40 9.979 -0.314 4.835 336 H LYS 41 H LYS 41 11.191 -3.969 3.311 337 HA LYS 41 HA LYS 41 9.945 -6.004 1.771 338 HB2 LYS 41 2HB LYS 41 12.838 -5.692 2.681 339 HB3 LYS 41 3HB LYS 41 12.296 -6.900 1.514 340 HG2 LYS 41 2HG LYS 41 11.528 -5.114 0.005 341 HG3 LYS 41 3HG LYS 41 12.067 -3.893 1.162 342 HD2 LYS 41 2HD LYS 41 14.394 -4.557 0.861 343 HD3 LYS 41 3HD LYS 41 13.918 -5.933 -0.145 344 HE2 LYS 41 2HE LYS 41 13.079 -4.413 -1.873 345 HE3 LYS 41 3HE LYS 41 13.443 -3.017 -0.859 346 HZ1 LYS 41 3HZ LYS 41 15.800 -3.639 -0.983 347 HZ2 LYS 41 1HZ LYS 41 15.134 -3.288 -2.495 348 HZ3 LYS 41 2HZ LYS 41 15.406 -4.893 -2.054 349 H GLU 42 H GLU 42 11.438 -5.991 4.998 350 HA GLU 42 HA GLU 42 11.073 -8.771 5.550 351 HB2 GLU 42 2HB GLU 42 11.417 -6.407 7.442 352 HB3 GLU 42 3HB GLU 42 11.383 -8.092 7.961 353 HG2 GLU 42 2HG GLU 42 13.370 -8.552 6.528 354 HG3 GLU 42 3HG GLU 42 13.430 -6.843 6.095 355 H GLU 43 H GLU 43 8.998 -5.928 5.885 356 HA GLU 43 HA GLU 43 6.899 -7.135 7.341 357 HB2 GLU 43 2HB GLU 43 6.759 -4.838 5.336 358 HB3 GLU 43 3HB GLU 43 5.481 -5.280 6.452 359 HG2 GLU 43 2HG GLU 43 8.164 -4.066 7.093 360 HG3 GLU 43 3HG GLU 43 6.566 -3.379 7.363 361 H ILE 44 H ILE 44 7.581 -6.903 3.857 362 HA ILE 44 HA ILE 44 5.344 -8.255 2.819 363 HB ILE 44 HB ILE 44 8.217 -8.089 1.796 364 HG12 ILE 44 2HG1 ILE 44 5.696 -6.601 0.920 365 HG13 ILE 44 3HG1 ILE 44 7.026 -5.916 1.849 366 HG21 ILE 44 1HG2 ILE 44 7.435 -8.884 -0.404 367 HG22 ILE 44 2HG2 ILE 44 5.824 -9.156 0.260 368 HG23 ILE 44 3HG2 ILE 44 7.186 -10.114 0.840 369 HD11 ILE 44 3HD1 ILE 44 7.179 -6.927 -0.989 370 HD12 ILE 44 1HD1 ILE 44 8.526 -6.266 -0.055 371 HD13 ILE 44 2HD1 ILE 44 7.152 -5.241 -0.466 372 H GLU 45 H GLU 45 8.464 -9.468 4.052 373 HA GLU 45 HA GLU 45 8.140 -12.206 3.444 374 HB2 GLU 45 2HB GLU 45 10.338 -11.215 3.996 375 HB3 GLU 45 3HB GLU 45 9.808 -10.915 5.650 376 HG2 GLU 45 2HG GLU 45 9.569 -13.358 6.005 377 HG3 GLU 45 3HG GLU 45 10.117 -13.646 4.356 378 H LYS 46 H LYS 46 7.301 -10.304 6.318 379 HA LYS 46 HA LYS 46 6.403 -12.418 7.993 380 HB2 LYS 46 2HB LYS 46 5.719 -9.438 7.995 381 HB3 LYS 46 3HB LYS 46 5.278 -10.551 9.287 382 HG2 LYS 46 2HG LYS 46 7.583 -10.932 9.867 383 HG3 LYS 46 3HG LYS 46 8.147 -10.066 8.436 384 HD2 LYS 46 2HD LYS 46 7.138 -7.963 9.374 385 HD3 LYS 46 3HD LYS 46 6.712 -8.861 10.836 386 HE2 LYS 46 2HE LYS 46 9.127 -9.344 11.212 387 HE3 LYS 46 3HE LYS 46 9.523 -8.386 9.779 388 HZ1 LYS 46 3HZ LYS 46 8.517 -6.462 10.868 389 HZ2 LYS 46 1HZ LYS 46 9.796 -7.094 11.772 390 HZ3 LYS 46 2HZ LYS 46 8.198 -7.389 12.242 391 H ALA 47 H ALA 47 4.799 -10.330 5.639 392 HA ALA 47 HA ALA 47 2.110 -11.017 6.143 393 HB1 ALA 47 3HB ALA 47 2.785 -9.020 4.883 394 HB2 ALA 47 1HB ALA 47 1.646 -10.002 3.963 395 HB3 ALA 47 2HB ALA 47 3.369 -10.035 3.562 396 H ARG 48 H ARG 48 4.412 -12.247 3.692 397 HA ARG 48 HA ARG 48 2.564 -14.143 2.583 398 HB2 ARG 48 2HB ARG 48 4.407 -14.890 1.168 399 HB3 ARG 48 3HB ARG 48 4.358 -13.133 1.214 400 HG2 ARG 48 2HG ARG 48 6.211 -13.165 2.887 401 HG3 ARG 48 3HG ARG 48 6.306 -14.918 2.700 402 HD2 ARG 48 2HD ARG 48 6.801 -12.840 0.545 403 HD3 ARG 48 3HD ARG 48 8.024 -13.812 1.355 404 HE ARG 48 HE ARG 48 6.267 -14.625 -0.805 405 HH11 ARG 48 1HH1 ARG 48 8.401 -15.791 1.736 406 HH12 ARG 48 2HH1 ARG 48 8.666 -17.321 0.968 407 HH21 ARG 48 1HH2 ARG 48 6.625 -16.648 -1.790 408 HH22 ARG 48 2HH2 ARG 48 7.666 -17.807 -1.020 409 H LYS 49 H LYS 49 4.947 -14.260 5.165 410 HA LYS 49 HA LYS 49 5.044 -17.109 5.434 411 HB2 LYS 49 2HB LYS 49 6.746 -15.520 6.413 412 HB3 LYS 49 3HB LYS 49 5.554 -15.036 7.617 413 HG2 LYS 49 2HG LYS 49 5.533 -17.262 8.583 414 HG3 LYS 49 3HG LYS 49 6.517 -17.896 7.261 415 HD2 LYS 49 2HD LYS 49 8.395 -16.389 8.021 416 HD3 LYS 49 3HD LYS 49 7.407 -15.932 9.411 417 HE2 LYS 49 2HE LYS 49 7.367 -18.298 10.152 418 HE3 LYS 49 3HE LYS 49 8.357 -18.748 8.760 419 HZ1 LYS 49 3HZ LYS 49 10.109 -17.287 9.627 420 HZ2 LYS 49 1HZ LYS 49 9.712 -18.519 10.711 421 HZ3 LYS 49 2HZ LYS 49 9.158 -16.952 10.984 422 H GLN 50 H GLN 50 2.961 -14.565 6.767 423 HA GLN 50 HA GLN 50 1.208 -16.369 8.206 424 HB2 GLN 50 2HB GLN 50 0.837 -13.468 7.339 425 HB3 GLN 50 3HB GLN 50 -0.326 -14.355 8.319 426 HG2 GLN 50 2HG GLN 50 2.510 -13.632 9.103 427 HG3 GLN 50 3HG GLN 50 1.028 -12.907 9.725 428 HE21 GLN 50 1HE2 GLN 50 3.144 -14.181 11.227 429 HE22 GLN 50 2HE2 GLN 50 2.434 -15.510 12.073 430 H GLY 51 H GLY 51 1.566 -15.309 4.937 431 HA2 GLY 51 2HA GLY 51 0.511 -15.876 2.989 432 HA3 GLY 51 3HA GLY 51 -0.464 -17.025 3.892 433 H ARG 52 H ARG 52 -0.302 -13.587 4.610 434 HA ARG 52 HA ARG 52 -3.097 -13.187 3.731 435 HB2 ARG 52 2HB ARG 52 -1.897 -12.551 6.468 436 HB3 ARG 52 3HB ARG 52 -3.441 -11.901 5.917 437 HG2 ARG 52 2HG ARG 52 -4.306 -14.224 5.689 438 HG3 ARG 52 3HG ARG 52 -2.779 -14.837 6.324 439 HD2 ARG 52 2HD ARG 52 -3.195 -13.703 8.454 440 HD3 ARG 52 3HD ARG 52 -4.690 -13.006 7.810 441 HE ARG 52 HE ARG 52 -4.587 -15.890 7.666 442 HH11 ARG 52 1HH1 ARG 52 -5.441 -13.192 9.744 443 HH12 ARG 52 2HH1 ARG 52 -6.540 -14.131 10.706 444 HH21 ARG 52 1HH2 ARG 52 -6.014 -17.106 8.933 445 HH22 ARG 52 2HH2 ARG 52 -6.863 -16.350 10.250 446 HA PRO 53 HA PRO 53 -1.692 -9.253 2.076 447 HB2 PRO 53 2HB PRO 53 -3.865 -7.602 2.580 448 HB3 PRO 53 3HB PRO 53 -3.844 -8.820 1.290 449 HG2 PRO 53 2HG PRO 53 -5.019 -9.038 4.052 450 HG3 PRO 53 3HG PRO 53 -5.732 -9.507 2.489 451 HD2 PRO 53 2HD PRO 53 -4.622 -11.364 4.073 452 HD3 PRO 53 3HD PRO 53 -4.415 -11.443 2.308 453 H ILE 54 H ILE 54 -0.795 -7.273 2.681 454 HA ILE 54 HA ILE 54 -0.901 -6.487 5.532 455 HB ILE 54 HB ILE 54 1.235 -7.614 5.189 456 HG12 ILE 54 2HG1 ILE 54 1.836 -4.626 5.251 457 HG13 ILE 54 3HG1 ILE 54 1.079 -5.467 6.596 458 HG21 ILE 54 1HG2 ILE 54 1.805 -5.653 2.938 459 HG22 ILE 54 2HG2 ILE 54 1.480 -7.376 2.750 460 HG23 ILE 54 3HG2 ILE 54 2.943 -6.841 3.582 461 HD11 ILE 54 3HD1 ILE 54 3.425 -5.195 6.968 462 HD12 ILE 54 1HD1 ILE 54 3.798 -6.034 5.462 463 HD13 ILE 54 2HD1 ILE 54 3.030 -6.904 6.794 464 H VAL 55 H VAL 55 -1.366 -4.402 5.842 465 HA VAL 55 HA VAL 55 -1.584 -2.619 3.525 466 HB VAL 55 HB VAL 55 -2.736 -1.988 6.272 467 HG11 VAL 55 1HG1 VAL 55 -4.377 -0.712 4.935 468 HG12 VAL 55 2HG1 VAL 55 -3.593 -1.250 3.445 469 HG13 VAL 55 3HG1 VAL 55 -2.723 -0.204 4.570 470 HG21 VAL 55 3HG2 VAL 55 -4.100 -3.730 4.176 471 HG22 VAL 55 1HG2 VAL 55 -4.864 -3.090 5.634 472 HG23 VAL 55 2HG2 VAL 55 -3.549 -4.258 5.765 473 H ILE 56 H ILE 56 0.287 -1.516 3.228 474 HA ILE 56 HA ILE 56 1.877 -0.531 5.498 475 HB ILE 56 HB ILE 56 2.492 -0.582 2.501 476 HG12 ILE 56 2HG1 ILE 56 2.521 -2.835 3.603 477 HG13 ILE 56 3HG1 ILE 56 4.108 -2.358 3.012 478 HG21 ILE 56 1HG2 ILE 56 4.301 0.326 4.781 479 HG22 ILE 56 2HG2 ILE 56 3.632 1.345 3.505 480 HG23 ILE 56 3HG2 ILE 56 4.812 0.096 3.106 481 HD11 ILE 56 3HD1 ILE 56 4.270 -3.448 5.169 482 HD12 ILE 56 1HD1 ILE 56 3.181 -2.262 5.885 483 HD13 ILE 56 2HD1 ILE 56 4.774 -1.765 5.306 484 H PHE 57 H PHE 57 1.203 1.414 6.252 485 HA PHE 57 HA PHE 57 0.113 3.469 4.454 486 HB2 PHE 57 2HB PHE 57 0.291 3.225 7.484 487 HB3 PHE 57 3HB PHE 57 -0.121 4.753 6.715 488 HD1 PHE 57 HD2 PHE 57 -1.249 1.230 7.200 489 HD2 PHE 57 HD1 PHE 57 -2.309 5.156 5.861 490 HE1 PHE 57 HE2 PHE 57 -3.617 0.566 7.069 491 HE2 PHE 57 HE1 PHE 57 -4.663 4.479 5.746 492 HZ PHE 57 HZ PHE 57 -5.303 2.192 6.317 493 H ILE 58 H ILE 58 1.581 4.659 3.439 494 HA ILE 58 HA ILE 58 3.677 6.034 4.982 495 HB ILE 58 HB ILE 58 5.242 5.874 2.977 496 HG12 ILE 58 2HG1 ILE 58 3.414 3.583 2.127 497 HG13 ILE 58 3HG1 ILE 58 3.592 5.125 1.291 498 HG21 ILE 58 1HG2 ILE 58 4.703 3.247 4.411 499 HG22 ILE 58 2HG2 ILE 58 5.675 4.582 5.029 500 HG23 ILE 58 3HG2 ILE 58 6.205 3.699 3.597 501 HD11 ILE 58 3HD1 ILE 58 5.968 4.603 0.902 502 HD12 ILE 58 1HD1 ILE 58 4.860 3.447 0.169 503 HD13 ILE 58 2HD1 ILE 58 5.713 3.021 1.649 504 H ARG 59 H ARG 59 4.332 7.990 4.050 505 HA ARG 59 HA ARG 59 2.264 9.390 2.550 506 HB2 ARG 59 2HB ARG 59 3.532 10.152 4.724 507 HB3 ARG 59 3HB ARG 59 4.841 10.581 3.631 508 HG2 ARG 59 2HG ARG 59 3.365 12.175 2.466 509 HG3 ARG 59 3HG ARG 59 2.018 11.699 3.509 510 HD2 ARG 59 2HD ARG 59 3.210 12.517 5.485 511 HD3 ARG 59 3HD ARG 59 4.615 12.930 4.497 512 HE ARG 59 HE ARG 59 2.665 14.395 3.351 513 HH11 ARG 59 1HH1 ARG 59 3.728 14.077 6.697 514 HH12 ARG 59 2HH1 ARG 59 3.273 15.699 7.124 515 HH21 ARG 59 1HH2 ARG 59 2.078 16.499 3.915 516 HH22 ARG 59 2HH2 ARG 59 2.330 17.076 5.533 517 H GLY 60 H GLY 60 3.102 11.007 0.844 518 HA2 GLY 60 2HA GLY 60 3.899 9.667 -1.432 519 HA3 GLY 60 3HA GLY 60 3.966 11.409 -1.244 520 H ALA 61 H ALA 61 5.998 11.251 0.903 521 HA ALA 61 HA ALA 61 8.384 11.433 -0.580 522 HB1 ALA 61 3HB ALA 61 9.507 11.615 1.607 523 HB2 ALA 61 1HB ALA 61 8.034 11.028 2.410 524 HB3 ALA 61 2HB ALA 61 8.029 12.574 1.570 525 H TYR 62 H TYR 62 7.222 8.884 1.617 526 HA TYR 62 HA TYR 62 9.516 7.196 1.330 527 HB2 TYR 62 2HB TYR 62 6.773 6.374 2.361 528 HB3 TYR 62 3HB TYR 62 8.310 5.586 2.684 529 HD1 TYR 62 HD2 TYR 62 10.129 7.184 3.879 530 HD2 TYR 62 HD1 TYR 62 5.896 7.754 4.015 531 HE1 TYR 62 HE2 TYR 62 10.365 8.493 5.945 532 HE2 TYR 62 HE1 TYR 62 6.136 9.058 6.079 533 HH TYR 62 HH TYR 62 7.703 9.297 7.916 534 H GLU 63 H GLU 63 6.463 7.507 -0.323 535 HA GLU 63 HA GLU 63 6.078 5.004 -1.447 536 HB2 GLU 63 2HB GLU 63 4.439 6.837 -1.465 537 HB3 GLU 63 3HB GLU 63 5.400 7.702 -2.669 538 HG2 GLU 63 2HG GLU 63 5.103 5.643 -4.176 539 HG3 GLU 63 3HG GLU 63 3.925 5.074 -2.994 540 H GLU 64 H GLU 64 8.273 7.567 -2.482 541 HA GLU 64 HA GLU 64 9.105 6.724 -4.998 542 HB2 GLU 64 2HB GLU 64 9.891 8.828 -4.034 543 HB3 GLU 64 3HB GLU 64 10.706 7.982 -2.724 544 HG2 GLU 64 2HG GLU 64 12.267 6.976 -4.372 545 HG3 GLU 64 3HG GLU 64 11.466 7.871 -5.659 546 H VAL 65 H VAL 65 9.993 5.540 -1.828 547 HA VAL 65 HA VAL 65 12.114 3.803 -2.560 548 HB VAL 65 HB VAL 65 10.363 3.784 -0.055 549 HG11 VAL 65 1HG1 VAL 65 13.092 2.529 -0.480 550 HG12 VAL 65 2HG1 VAL 65 11.566 1.657 -0.350 551 HG13 VAL 65 3HG1 VAL 65 12.184 2.560 1.033 552 HG21 VAL 65 3HG2 VAL 65 13.053 5.127 -0.508 553 HG22 VAL 65 1HG2 VAL 65 12.150 5.103 1.010 554 HG23 VAL 65 2HG2 VAL 65 11.499 5.954 -0.394 555 H VAL 66 H VAL 66 8.587 3.384 -2.418 556 HA VAL 66 HA VAL 66 8.328 0.627 -2.181 557 HB VAL 66 HB VAL 66 6.580 2.511 -3.844 558 HG11 VAL 66 1HG1 VAL 66 5.947 -0.355 -2.996 559 HG12 VAL 66 2HG1 VAL 66 6.192 0.212 -4.648 560 HG13 VAL 66 3HG1 VAL 66 4.794 0.766 -3.728 561 HG21 VAL 66 3HG2 VAL 66 6.660 3.051 -1.456 562 HG22 VAL 66 1HG2 VAL 66 6.218 1.392 -1.045 563 HG23 VAL 66 2HG2 VAL 66 5.064 2.430 -1.891 564 H ARG 67 H ARG 67 9.142 2.534 -5.033 565 HA ARG 67 HA ARG 67 8.952 0.698 -7.105 566 HB2 ARG 67 2HB ARG 67 9.443 3.059 -7.458 567 HB3 ARG 67 3HB ARG 67 10.971 2.925 -6.597 568 HG2 ARG 67 2HG ARG 67 11.844 1.473 -8.429 569 HG3 ARG 67 3HG ARG 67 10.319 1.688 -9.296 570 HD2 ARG 67 2HD ARG 67 12.059 3.206 -10.155 571 HD3 ARG 67 3HD ARG 67 10.717 4.107 -9.444 572 HE ARG 67 HE ARG 67 13.195 3.599 -7.895 573 HH11 ARG 67 1HH1 ARG 67 10.939 5.922 -9.281 574 HH12 ARG 67 2HH1 ARG 67 11.658 7.280 -8.480 575 HH21 ARG 67 1HH2 ARG 67 14.120 5.401 -6.845 576 HH22 ARG 67 2HH2 ARG 67 13.462 6.984 -7.098 577 H ASP 68 H ASP 68 11.634 1.177 -4.830 578 HA ASP 68 HA ASP 68 13.411 -0.833 -5.861 579 HB2 ASP 68 2HB ASP 68 14.218 1.132 -4.580 580 HB3 ASP 68 3HB ASP 68 13.318 0.608 -3.164 581 H ILE 69 H ILE 69 11.022 -0.686 -3.273 582 HA ILE 69 HA ILE 69 11.465 -3.226 -2.084 583 HB ILE 69 HB ILE 69 8.980 -1.448 -1.999 584 HG12 ILE 69 2HG1 ILE 69 11.315 -1.585 -0.020 585 HG13 ILE 69 3HG1 ILE 69 11.117 -0.328 -1.238 586 HG21 ILE 69 1HG2 ILE 69 9.800 -3.672 -0.089 587 HG22 ILE 69 2HG2 ILE 69 8.455 -3.732 -1.229 588 HG23 ILE 69 3HG2 ILE 69 8.417 -2.596 0.118 589 HD11 ILE 69 3HD1 ILE 69 9.210 -0.874 1.027 590 HD12 ILE 69 1HD1 ILE 69 9.063 0.405 -0.179 591 HD13 ILE 69 2HD1 ILE 69 10.409 0.417 0.962 592 H VAL 70 H VAL 70 9.582 -2.175 -4.826 593 HA VAL 70 HA VAL 70 7.729 -4.227 -5.194 594 HB VAL 70 HB VAL 70 9.083 -2.301 -7.133 595 HG11 VAL 70 1HG1 VAL 70 8.672 -4.329 -8.465 596 HG12 VAL 70 2HG1 VAL 70 7.567 -3.042 -8.944 597 HG13 VAL 70 3HG1 VAL 70 6.994 -4.362 -7.923 598 HG21 VAL 70 3HG2 VAL 70 6.844 -1.288 -7.285 599 HG22 VAL 70 1HG2 VAL 70 7.347 -1.409 -5.599 600 HG23 VAL 70 2HG2 VAL 70 6.187 -2.557 -6.252 601 H GLU 71 H GLU 71 11.111 -3.935 -6.329 602 HA GLU 71 HA GLU 71 11.229 -6.163 -7.996 603 HB2 GLU 71 2HB GLU 71 13.030 -4.492 -7.960 604 HB3 GLU 71 3HB GLU 71 13.483 -4.961 -6.323 605 HG2 GLU 71 2HG GLU 71 14.005 -7.274 -7.230 606 HG3 GLU 71 3HG GLU 71 13.731 -6.637 -8.849 607 H TYR 72 H TYR 72 11.899 -5.913 -4.505 608 HA TYR 72 HA TYR 72 12.657 -8.541 -3.941 609 HB2 TYR 72 2HB TYR 72 12.907 -6.756 -2.288 610 HB3 TYR 72 3HB TYR 72 11.167 -6.523 -2.203 611 HD1 TYR 72 HD1 TYR 72 13.961 -8.785 -1.249 612 HD2 TYR 72 HD2 TYR 72 9.778 -8.001 -0.812 613 HE1 TYR 72 HE1 TYR 72 13.841 -10.401 0.598 614 HE2 TYR 72 HE2 TYR 72 9.671 -9.618 1.028 615 HH TYR 72 HH TYR 72 10.960 -11.623 1.799 616 H ALA 73 H ALA 73 9.406 -7.055 -3.835 617 HA ALA 73 HA ALA 73 8.001 -9.372 -3.010 618 HB1 ALA 73 3HB ALA 73 7.093 -7.118 -2.726 619 HB2 ALA 73 1HB ALA 73 5.970 -8.130 -3.632 620 HB3 ALA 73 2HB ALA 73 6.956 -6.931 -4.474 621 H GLN 74 H GLN 74 8.882 -8.142 -6.212 622 HA GLN 74 HA GLN 74 7.377 -9.963 -7.789 623 HB2 GLN 74 2HB GLN 74 9.928 -8.405 -8.378 624 HB3 GLN 74 3HB GLN 74 9.175 -9.456 -9.570 625 HG2 GLN 74 2HG GLN 74 7.082 -8.039 -9.387 626 HG3 GLN 74 3HG GLN 74 8.001 -6.944 -8.355 627 HE21 GLN 74 1HE2 GLN 74 7.505 -5.345 -10.038 628 HE22 GLN 74 2HE2 GLN 74 8.499 -5.254 -11.444 629 H LYS 75 H LYS 75 10.598 -10.118 -6.278 630 HA LYS 75 HA LYS 75 11.429 -12.591 -7.442 631 HB2 LYS 75 2HB LYS 75 12.370 -11.355 -4.813 632 HB3 LYS 75 3HB LYS 75 13.176 -12.655 -5.685 633 HG2 LYS 75 2HG LYS 75 12.881 -9.778 -6.559 634 HG3 LYS 75 3HG LYS 75 14.361 -10.584 -6.051 635 HD2 LYS 75 2HD LYS 75 14.232 -12.041 -8.075 636 HD3 LYS 75 3HD LYS 75 12.762 -11.198 -8.574 637 HE2 LYS 75 2HE LYS 75 14.058 -9.070 -8.697 638 HE3 LYS 75 3HE LYS 75 15.526 -9.959 -8.278 639 HZ1 LYS 75 3HZ LYS 75 15.336 -9.624 -10.656 640 HZ2 LYS 75 1HZ LYS 75 13.845 -10.413 -10.682 641 HZ3 LYS 75 2HZ LYS 75 15.243 -11.270 -10.296 642 H GLU 76 H GLU 76 9.736 -11.724 -4.453 643 HA GLU 76 HA GLU 76 9.469 -14.337 -3.353 644 HB2 GLU 76 2HB GLU 76 7.704 -11.874 -2.934 645 HB3 GLU 76 3HB GLU 76 7.731 -13.304 -1.903 646 HG2 GLU 76 2HG GLU 76 10.046 -11.394 -2.317 647 HG3 GLU 76 3HG GLU 76 8.948 -11.373 -0.945 648 H GLY 77 H GLY 77 7.798 -12.580 -5.837 649 HA2 GLY 77 2HA GLY 77 6.355 -13.338 -7.468 650 HA3 GLY 77 3HA GLY 77 6.252 -14.894 -6.650 651 H LEU 78 H LEU 78 5.571 -11.593 -5.580 652 HA LEU 78 HA LEU 78 2.838 -12.367 -4.729 653 HB2 LEU 78 2HB LEU 78 4.759 -10.354 -3.481 654 HB3 LEU 78 3HB LEU 78 3.110 -10.638 -2.941 655 HG LEU 78 HG LEU 78 5.421 -12.610 -2.779 656 HD11 LEU 78 1HD1 LEU 78 3.940 -11.105 -0.607 657 HD12 LEU 78 2HD1 LEU 78 5.592 -10.814 -1.159 658 HD13 LEU 78 3HD1 LEU 78 5.191 -12.326 -0.357 659 HD21 LEU 78 3HD2 LEU 78 3.877 -14.088 -1.542 660 HD22 LEU 78 1HD2 LEU 78 3.346 -13.832 -3.204 661 HD23 LEU 78 2HD2 LEU 78 2.543 -12.983 -1.882 662 H ARG 79 H ARG 79 1.275 -10.630 -4.738 663 HA ARG 79 HA ARG 79 1.484 -8.747 -6.912 664 HB2 ARG 79 2HB ARG 79 -0.677 -9.519 -4.947 665 HB3 ARG 79 3HB ARG 79 -0.816 -7.953 -5.735 666 HG2 ARG 79 2HG ARG 79 -0.612 -10.614 -7.175 667 HG3 ARG 79 3HG ARG 79 -2.098 -9.703 -6.899 668 HD2 ARG 79 2HD ARG 79 -1.199 -7.820 -8.241 669 HD3 ARG 79 3HD ARG 79 0.290 -8.731 -8.505 670 HE ARG 79 HE ARG 79 -1.015 -10.367 -9.753 671 HH11 ARG 79 1HH1 ARG 79 -2.503 -7.223 -9.287 672 HH12 ARG 79 2HH1 ARG 79 -3.552 -7.377 -10.653 673 HH21 ARG 79 1HH2 ARG 79 -2.366 -10.561 -11.550 674 HH22 ARG 79 2HH2 ARG 79 -3.473 -9.285 -11.947 675 H VAL 80 H VAL 80 2.081 -6.685 -6.797 676 HA VAL 80 HA VAL 80 2.268 -5.308 -4.186 677 HB VAL 80 HB VAL 80 3.518 -4.279 -6.781 678 HG11 VAL 80 1HG1 VAL 80 4.966 -2.988 -5.243 679 HG12 VAL 80 2HG1 VAL 80 4.157 -3.716 -3.856 680 HG13 VAL 80 3HG1 VAL 80 3.259 -2.656 -4.943 681 HG21 VAL 80 3HG2 VAL 80 4.903 -6.097 -4.776 682 HG22 VAL 80 1HG2 VAL 80 5.692 -5.260 -6.117 683 HG23 VAL 80 2HG2 VAL 80 4.486 -6.510 -6.439 684 H LEU 81 H LEU 81 0.652 -3.891 -3.863 685 HA LEU 81 HA LEU 81 -0.859 -2.740 -6.124 686 HB2 LEU 81 2HB LEU 81 -2.061 -4.764 -5.295 687 HB3 LEU 81 3HB LEU 81 -2.040 -4.116 -3.664 688 HG LEU 81 HG LEU 81 -3.582 -2.325 -4.302 689 HD11 LEU 81 1HD1 LEU 81 -2.821 -1.895 -6.547 690 HD12 LEU 81 2HD1 LEU 81 -4.551 -2.206 -6.552 691 HD13 LEU 81 3HD1 LEU 81 -3.432 -3.457 -7.087 692 HD21 LEU 81 3HD2 LEU 81 -4.600 -4.462 -3.616 693 HD22 LEU 81 1HD2 LEU 81 -4.592 -5.018 -5.291 694 HD23 LEU 81 2HD2 LEU 81 -5.601 -3.649 -4.816 695 H VAL 82 H VAL 82 -0.368 -0.603 -5.832 696 HA VAL 82 HA VAL 82 -0.292 0.483 -3.090 697 HB VAL 82 HB VAL 82 0.645 2.568 -4.102 698 HG11 VAL 82 1HG1 VAL 82 2.887 1.654 -4.632 699 HG12 VAL 82 2HG1 VAL 82 2.190 0.039 -4.807 700 HG13 VAL 82 3HG1 VAL 82 2.164 0.846 -3.239 701 HG21 VAL 82 3HG2 VAL 82 1.440 2.595 -6.440 702 HG22 VAL 82 1HG2 VAL 82 -0.315 2.437 -6.363 703 HG23 VAL 82 2HG2 VAL 82 0.679 1.026 -6.727 704 H ILE 83 H ILE 83 -2.008 1.408 -2.294 705 HA ILE 83 HA ILE 83 -4.260 2.251 -3.980 706 HB ILE 83 HB ILE 83 -4.102 1.988 -0.929 707 HG12 ILE 83 2HG1 ILE 83 -5.288 -0.019 -2.911 708 HG13 ILE 83 3HG1 ILE 83 -3.719 -0.203 -2.139 709 HG21 ILE 83 1HG2 ILE 83 -6.535 2.258 -2.753 710 HG22 ILE 83 2HG2 ILE 83 -5.904 3.508 -1.680 711 HG23 ILE 83 3HG2 ILE 83 -6.582 2.029 -1.003 712 HD11 ILE 83 3HD1 ILE 83 -6.377 -0.126 -0.729 713 HD12 ILE 83 1HD1 ILE 83 -4.798 -0.308 0.043 714 HD13 ILE 83 2HD1 ILE 83 -5.394 -1.551 -1.055 715 H LYS 84 H LYS 84 -4.095 4.356 -4.567 716 HA LYS 84 HA LYS 84 -2.537 6.273 -2.924 717 HB2 LYS 84 2HB LYS 84 -2.965 6.107 -5.942 718 HB3 LYS 84 3HB LYS 84 -2.153 7.448 -5.139 719 HG2 LYS 84 2HG LYS 84 -0.325 6.034 -4.442 720 HG3 LYS 84 3HG LYS 84 -1.183 4.577 -4.957 721 HD2 LYS 84 2HD LYS 84 0.602 5.228 -6.558 722 HD3 LYS 84 3HD LYS 84 -0.997 5.233 -7.297 723 HE2 LYS 84 2HE LYS 84 0.259 7.162 -8.065 724 HE3 LYS 84 3HE LYS 84 -1.081 7.702 -7.052 725 HZ1 LYS 84 3HZ LYS 84 1.700 7.360 -6.063 726 HZ2 LYS 84 1HZ LYS 84 0.409 8.081 -5.249 727 HZ3 LYS 84 2HZ LYS 84 1.077 8.833 -6.610 728 H VAL 85 H VAL 85 -3.504 8.098 -2.270 729 HA VAL 85 HA VAL 85 -6.129 8.900 -3.227 730 HB VAL 85 HB VAL 85 -4.194 10.316 -1.318 731 HG11 VAL 85 1HG1 VAL 85 -5.711 11.946 -2.362 732 HG12 VAL 85 2HG1 VAL 85 -6.127 11.739 -0.660 733 HG13 VAL 85 3HG1 VAL 85 -7.110 10.969 -1.908 734 HG21 VAL 85 3HG2 VAL 85 -6.657 8.642 -0.679 735 HG22 VAL 85 1HG2 VAL 85 -5.680 9.519 0.502 736 HG23 VAL 85 2HG2 VAL 85 -4.981 8.171 -0.396 737 H ALA 86 H ALA 86 -6.003 9.515 -5.325 738 HA ALA 86 HA ALA 86 -3.880 11.218 -6.366 739 HB1 ALA 86 3HB ALA 86 -6.369 10.110 -7.718 740 HB2 ALA 86 1HB ALA 86 -4.753 9.405 -7.783 741 HB3 ALA 86 2HB ALA 86 -5.059 10.973 -8.529 742 H GLN 87 H GLN 87 -4.230 13.332 -7.122 743 HA GLN 87 HA GLN 87 -6.812 14.669 -6.772 744 HB2 GLN 87 2HB GLN 87 -4.283 15.464 -5.242 745 HB3 GLN 87 3HB GLN 87 -5.580 16.616 -5.553 746 HG2 GLN 87 2HG GLN 87 -7.158 15.199 -4.292 747 HG3 GLN 87 3HG GLN 87 -5.881 14.020 -4.007 748 HE21 GLN 87 1HE2 GLN 87 -7.035 17.227 -3.244 749 HE22 GLN 87 2HE2 GLN 87 -6.089 17.442 -1.818 750 H ASP 88 H ASP 88 -6.036 13.971 -9.070 751 HA ASP 88 HA ASP 88 -5.023 14.173 -11.064 752 HB2 ASP 88 2HB ASP 88 -4.778 17.147 -10.399 753 HB3 ASP 88 3HB ASP 88 -4.523 16.436 -11.989 754 H GLN 89 H GLN 89 -3.094 16.800 -9.678 755 HA GLN 89 HA GLN 89 -0.910 17.135 -9.282 756 HB2 GLN 89 2HB GLN 89 -1.106 14.362 -8.042 757 HB3 GLN 89 3HB GLN 89 0.206 15.499 -7.757 758 HG2 GLN 89 2HG GLN 89 -2.691 15.803 -6.924 759 HG3 GLN 89 3HG GLN 89 -1.298 15.550 -5.878 760 HE21 GLN 89 1HE2 GLN 89 -3.107 17.870 -7.733 761 HE22 GLN 89 2HE2 GLN 89 -2.277 19.280 -7.174 762 H GLU 90 H GLU 90 0.254 17.314 -11.102 763 HA GLU 90 HA GLU 90 0.839 15.425 -13.059 764 HB2 GLU 90 2HB GLU 90 1.092 17.895 -13.265 765 HB3 GLU 90 3HB GLU 90 2.497 17.837 -12.206 766 HG2 GLU 90 2HG GLU 90 3.677 16.427 -13.893 767 HG3 GLU 90 3HG GLU 90 2.274 16.561 -14.953 768 H LEU 91 H LEU 91 2.595 16.210 -10.091 769 HA LEU 91 HA LEU 91 4.926 14.649 -10.451 770 HB2 LEU 91 2HB LEU 91 3.502 15.668 -7.972 771 HB3 LEU 91 3HB LEU 91 4.935 14.666 -7.839 772 HG LEU 91 HG LEU 91 6.272 16.383 -9.030 773 HD11 LEU 91 1HD1 LEU 91 3.786 18.111 -9.015 774 HD12 LEU 91 2HD1 LEU 91 4.556 17.409 -10.437 775 HD13 LEU 91 3HD1 LEU 91 5.410 18.622 -9.487 776 HD21 LEU 91 3HD2 LEU 91 6.175 16.414 -6.580 777 HD22 LEU 91 1HD2 LEU 91 4.771 17.484 -6.632 778 HD23 LEU 91 2HD2 LEU 91 6.339 18.049 -7.218 779 H LEU 92 H LEU 92 1.761 13.910 -9.089 780 HA LEU 92 HA LEU 92 2.374 11.286 -8.161 781 HB2 LEU 92 2HB LEU 92 0.653 12.683 -7.151 782 HB3 LEU 92 3HB LEU 92 -0.261 12.720 -8.639 783 HG LEU 92 HG LEU 92 0.189 10.034 -7.303 784 HD11 LEU 92 1HD1 LEU 92 -1.761 10.322 -5.850 785 HD12 LEU 92 2HD1 LEU 92 -1.909 12.009 -6.348 786 HD13 LEU 92 3HD1 LEU 92 -0.492 11.476 -5.440 787 HD21 LEU 92 3HD2 LEU 92 -2.196 11.168 -8.832 788 HD22 LEU 92 1HD2 LEU 92 -2.061 9.521 -8.203 789 HD23 LEU 92 2HD2 LEU 92 -0.979 10.068 -9.482 790 H GLU 93 H GLU 93 0.899 12.631 -11.102 791 HA GLU 93 HA GLU 93 -0.094 10.262 -12.267 792 HB2 GLU 93 2HB GLU 93 0.797 12.868 -13.573 793 HB3 GLU 93 3HB GLU 93 -0.053 11.578 -14.422 794 HG2 GLU 93 2HG GLU 93 -1.999 11.874 -12.918 795 HG3 GLU 93 3HG GLU 93 -1.144 13.177 -12.090 796 H ARG 94 H ARG 94 3.038 11.901 -12.548 797 HA ARG 94 HA ARG 94 4.099 10.331 -14.640 798 HB2 ARG 94 2HB ARG 94 5.037 12.545 -13.933 799 HB3 ARG 94 3HB ARG 94 5.622 11.811 -12.443 800 HG2 ARG 94 2HG ARG 94 7.447 12.052 -14.078 801 HG3 ARG 94 3HG ARG 94 7.134 10.348 -13.743 802 HD2 ARG 94 2HD ARG 94 5.807 10.198 -15.845 803 HD3 ARG 94 3HD ARG 94 6.177 11.892 -16.183 804 HE ARG 94 HE ARG 94 8.583 10.445 -15.830 805 HH11 ARG 94 1HH1 ARG 94 5.957 10.759 -18.144 806 HH12 ARG 94 2HH1 ARG 94 6.936 10.310 -19.504 807 HH21 ARG 94 1HH2 ARG 94 9.869 9.881 -17.637 808 HH22 ARG 94 2HH2 ARG 94 9.150 9.814 -19.217 809 H PHE 95 H PHE 95 4.558 10.117 -11.085 810 HA PHE 95 HA PHE 95 6.224 7.826 -11.119 811 HB2 PHE 95 2HB PHE 95 6.076 9.441 -9.216 812 HB3 PHE 95 3HB PHE 95 4.462 8.843 -8.842 813 HD1 PHE 95 HD2 PHE 95 8.057 7.804 -9.068 814 HD2 PHE 95 HD1 PHE 95 4.200 6.909 -7.435 815 HE1 PHE 95 HE2 PHE 95 9.055 6.052 -7.652 816 HE2 PHE 95 HE1 PHE 95 5.213 5.160 -6.032 817 HZ PHE 95 HZ PHE 95 7.635 4.735 -6.136 818 H TYR 96 H TYR 96 2.745 8.249 -10.758 819 HA TYR 96 HA TYR 96 1.767 5.724 -10.189 820 HB2 TYR 96 2HB TYR 96 0.263 7.600 -10.215 821 HB3 TYR 96 3HB TYR 96 0.708 8.046 -11.850 822 HD1 TYR 96 HD1 TYR 96 -1.243 5.602 -9.843 823 HD2 TYR 96 HD2 TYR 96 -0.507 7.150 -13.751 824 HE1 TYR 96 HE1 TYR 96 -3.215 4.431 -10.680 825 HE2 TYR 96 HE2 TYR 96 -2.497 5.974 -14.592 826 HH TYR 96 HH TYR 96 -4.872 4.749 -12.675 827 H GLU 97 H GLU 97 2.725 7.117 -13.262 828 HA GLU 97 HA GLU 97 1.706 5.097 -14.985 829 HB2 GLU 97 2HB GLU 97 2.045 7.450 -15.678 830 HB3 GLU 97 3HB GLU 97 3.784 7.277 -15.474 831 HG2 GLU 97 2HG GLU 97 3.764 5.549 -17.288 832 HG3 GLU 97 3HG GLU 97 2.046 5.869 -17.528 833 H GLN 98 H GLN 98 4.908 5.815 -13.600 834 HA GLN 98 HA GLN 98 6.484 4.050 -15.081 835 HB2 GLN 98 2HB GLN 98 6.799 5.388 -12.404 836 HB3 GLN 98 3HB GLN 98 7.895 4.060 -12.768 837 HG2 GLN 98 2HG GLN 98 9.061 5.992 -13.416 838 HG3 GLN 98 3HG GLN 98 8.473 5.300 -14.926 839 HE21 GLN 98 1HE2 GLN 98 6.721 6.357 -16.006 840 HE22 GLN 98 2HE2 GLN 98 6.360 8.016 -15.688 841 H LEU 99 H LEU 99 4.736 3.471 -12.039 842 HA LEU 99 HA LEU 99 5.715 0.909 -11.434 843 HB2 LEU 99 2HB LEU 99 3.214 2.417 -10.648 844 HB3 LEU 99 3HB LEU 99 3.378 0.731 -10.182 845 HG LEU 99 HG LEU 99 5.460 1.259 -8.929 846 HD11 LEU 99 1HD1 LEU 99 6.136 3.582 -8.526 847 HD12 LEU 99 2HD1 LEU 99 4.911 4.135 -9.676 848 HD13 LEU 99 3HD1 LEU 99 6.264 3.150 -10.231 849 HD21 LEU 99 3HD2 LEU 99 3.093 2.982 -8.140 850 HD22 LEU 99 1HD2 LEU 99 4.417 2.503 -7.074 851 HD23 LEU 99 2HD2 LEU 99 3.333 1.281 -7.734 852 H LYS 100 H LYS 100 3.231 1.921 -13.640 853 HA LYS 100 HA LYS 100 1.897 -0.553 -14.019 854 HB2 LYS 100 2HB LYS 100 2.115 1.798 -15.945 855 HB3 LYS 100 3HB LYS 100 0.883 0.544 -15.976 856 HG2 LYS 100 2HG LYS 100 1.152 2.223 -13.479 857 HG3 LYS 100 3HG LYS 100 0.420 2.949 -14.907 858 HD2 LYS 100 2HD LYS 100 -1.364 2.116 -13.528 859 HD3 LYS 100 3HD LYS 100 -1.265 1.071 -14.941 860 HE2 LYS 100 2HE LYS 100 -0.023 -0.597 -13.551 861 HE3 LYS 100 3HE LYS 100 -0.245 0.449 -12.150 862 HZ1 LYS 100 3HZ LYS 100 -2.407 -0.833 -13.733 863 HZ2 LYS 100 1HZ LYS 100 -2.647 0.200 -12.415 864 HZ3 LYS 100 2HZ LYS 100 -1.888 -1.297 -12.194 865 H LYS 101 H LYS 101 4.836 0.816 -15.425 866 HA LYS 101 HA LYS 101 5.161 -1.128 -17.534 867 HB2 LYS 101 2HB LYS 101 7.141 0.830 -16.282 868 HB3 LYS 101 3HB LYS 101 7.596 -0.291 -17.558 869 HG2 LYS 101 2HG LYS 101 7.222 1.776 -18.640 870 HG3 LYS 101 3HG LYS 101 5.798 0.799 -19.006 871 HD2 LYS 101 2HD LYS 101 4.509 2.003 -17.289 872 HD3 LYS 101 3HD LYS 101 5.941 2.928 -16.833 873 HE2 LYS 101 2HE LYS 101 4.605 3.035 -19.560 874 HE3 LYS 101 3HE LYS 101 4.364 4.212 -18.271 875 HZ1 LYS 101 3HZ LYS 101 6.907 3.648 -19.690 876 HZ2 LYS 101 1HZ LYS 101 6.755 4.710 -18.383 877 HZ3 LYS 101 2HZ LYS 101 5.953 5.031 -19.832 878 H ASP 102 H ASP 102 6.277 -0.829 -14.171 879 HA ASP 102 HA ASP 102 7.948 -3.157 -14.139 880 HB2 ASP 102 2HB ASP 102 6.615 -1.665 -11.828 881 HB3 ASP 102 3HB ASP 102 7.848 -2.914 -11.633 882 H GLY 103 H GLY 103 4.563 -2.792 -14.185 883 HA2 GLY 103 2HA GLY 103 2.980 -4.526 -14.372 884 HA3 GLY 103 3HA GLY 103 4.117 -5.642 -13.627 885 H VAL 104 H VAL 104 4.050 -2.795 -11.873 886 HA VAL 104 HA VAL 104 2.711 -3.920 -9.623 887 HB VAL 104 HB VAL 104 3.394 -0.975 -10.050 888 HG11 VAL 104 1HG1 VAL 104 3.043 -2.560 -7.478 889 HG12 VAL 104 2HG1 VAL 104 1.892 -1.392 -8.133 890 HG13 VAL 104 3HG1 VAL 104 3.481 -0.851 -7.590 891 HG21 VAL 104 3HG2 VAL 104 5.546 -1.412 -8.966 892 HG22 VAL 104 1HG2 VAL 104 5.387 -2.350 -10.454 893 HG23 VAL 104 2HG2 VAL 104 5.171 -3.137 -8.887 894 H ASP 105 H ASP 105 0.619 -3.756 -9.056 895 HA ASP 105 HA ASP 105 -1.293 -2.463 -10.824 896 HB2 ASP 105 2HB ASP 105 -1.563 -4.806 -9.824 897 HB3 ASP 105 3HB ASP 105 -1.827 -4.041 -8.267 898 H VAL 106 H VAL 106 -2.667 -0.762 -10.153 899 HA VAL 106 HA VAL 106 -2.081 0.598 -7.597 900 HB VAL 106 HB VAL 106 -2.432 2.132 -10.227 901 HG11 VAL 106 1HG1 VAL 106 -1.726 4.098 -8.885 902 HG12 VAL 106 2HG1 VAL 106 -1.646 3.084 -7.445 903 HG13 VAL 106 3HG1 VAL 106 -3.195 3.355 -8.246 904 HG21 VAL 106 3HG2 VAL 106 -0.251 0.989 -10.315 905 HG22 VAL 106 1HG2 VAL 106 0.193 1.686 -8.754 906 HG23 VAL 106 2HG2 VAL 106 -0.052 2.735 -10.155 907 H ARG 107 H ARG 107 -3.961 1.197 -6.563 908 HA ARG 107 HA ARG 107 -6.424 1.555 -8.186 909 HB2 ARG 107 2HB ARG 107 -6.271 0.970 -5.188 910 HB3 ARG 107 3HB ARG 107 -7.737 1.091 -6.160 911 HG2 ARG 107 2HG ARG 107 -5.620 -1.066 -6.308 912 HG3 ARG 107 3HG ARG 107 -7.263 -1.240 -5.700 913 HD2 ARG 107 2HD ARG 107 -8.189 -1.030 -7.904 914 HD3 ARG 107 3HD ARG 107 -6.652 -0.478 -8.574 915 HE ARG 107 HE ARG 107 -5.870 -2.843 -7.844 916 HH11 ARG 107 1HH1 ARG 107 -8.972 -2.055 -9.255 917 HH12 ARG 107 2HH1 ARG 107 -9.175 -3.608 -9.986 918 HH21 ARG 107 1HH2 ARG 107 -6.110 -4.863 -8.855 919 HH22 ARG 107 2HH2 ARG 107 -7.552 -5.207 -9.759 920 H VAL 108 H VAL 108 -6.385 3.708 -8.660 921 HA VAL 108 HA VAL 108 -6.059 5.660 -6.469 922 HB VAL 108 HB VAL 108 -6.183 7.430 -8.262 923 HG11 VAL 108 1HG1 VAL 108 -3.950 5.399 -8.654 924 HG12 VAL 108 2HG1 VAL 108 -4.003 6.654 -7.415 925 HG13 VAL 108 3HG1 VAL 108 -3.894 7.103 -9.116 926 HG21 VAL 108 3HG2 VAL 108 -5.902 6.805 -10.649 927 HG22 VAL 108 1HG2 VAL 108 -7.427 6.196 -9.997 928 HG23 VAL 108 2HG2 VAL 108 -6.066 5.098 -10.224 929 H THR 109 H THR 109 -7.724 6.756 -5.692 930 HA THR 109 HA THR 109 -10.464 6.138 -6.637 931 HB THR 109 HB THR 109 -11.109 6.823 -4.299 932 HG1 THR 109 HG1 THR 109 -9.536 7.367 -2.860 933 HG21 THR 109 3HG2 THR 109 -8.986 4.644 -4.422 934 HG22 THR 109 1HG2 THR 109 -10.698 4.427 -4.796 935 HG23 THR 109 2HG2 THR 109 -10.198 4.831 -3.154 936 H ASP 110 H ASP 110 -8.092 8.556 -6.482 937 HA ASP 110 HA ASP 110 -7.908 10.741 -6.837 938 HB2 ASP 110 2HB ASP 110 -9.257 10.074 -8.926 939 HB3 ASP 110 3HB ASP 110 -10.676 10.718 -8.108 940 H ASN 111 H ASN 111 -9.405 9.697 -4.382 941 HA ASN 111 HA ASN 111 -9.930 12.201 -3.112 942 HB2 ASN 111 2HB ASN 111 -12.076 11.638 -4.549 943 HB3 ASN 111 3HB ASN 111 -12.403 10.429 -3.322 944 HD21 ASN 111 1HD2 ASN 111 -11.351 12.263 -1.133 945 HD22 ASN 111 2HD2 ASN 111 -12.610 13.414 -0.924 946 H GLU 112 H GLU 112 -9.379 11.856 -1.060 947 HA GLU 112 HA GLU 112 -8.619 9.369 0.006 948 HB2 GLU 112 2HB GLU 112 -8.438 10.574 2.216 949 HB3 GLU 112 3HB GLU 112 -7.545 11.302 0.891 950 HG2 GLU 112 2HG GLU 112 -10.297 12.327 1.504 951 HG3 GLU 112 3HG GLU 112 -8.969 12.788 2.564 952 H ASP 113 H ASP 113 -11.739 11.009 0.099 953 HA ASP 113 HA ASP 113 -12.963 9.575 2.207 954 HB2 ASP 113 2HB ASP 113 -13.887 11.671 1.136 955 HB3 ASP 113 3HB ASP 113 -14.332 10.721 -0.283 956 H GLU 114 H GLU 114 -13.044 9.074 -1.316 957 HA GLU 114 HA GLU 114 -14.337 6.564 -1.283 958 HB2 GLU 114 2HB GLU 114 -12.795 8.110 -3.369 959 HB3 GLU 114 3HB GLU 114 -13.182 6.425 -3.687 960 HG2 GLU 114 2HG GLU 114 -14.806 7.995 -4.678 961 HG3 GLU 114 3HG GLU 114 -15.545 6.859 -3.552 962 H ALA 115 H ALA 115 -10.931 7.457 -0.949 963 HA ALA 115 HA ALA 115 -9.797 4.874 -1.359 964 HB1 ALA 115 3HB ALA 115 -8.425 6.912 -1.410 965 HB2 ALA 115 1HB ALA 115 -7.802 5.772 -0.216 966 HB3 ALA 115 2HB ALA 115 -8.728 7.184 0.308 967 H LYS 116 H LYS 116 -10.755 6.665 1.507 968 HA LYS 116 HA LYS 116 -10.333 4.919 3.599 969 HB2 LYS 116 2HB LYS 116 -10.904 7.228 3.910 970 HB3 LYS 116 3HB LYS 116 -12.418 7.058 3.043 971 HG2 LYS 116 2HG LYS 116 -13.356 5.768 4.907 972 HG3 LYS 116 3HG LYS 116 -11.814 5.885 5.768 973 HD2 LYS 116 2HD LYS 116 -12.008 8.329 5.877 974 HD3 LYS 116 3HD LYS 116 -13.480 8.289 4.901 975 HE2 LYS 116 2HE LYS 116 -13.168 7.113 7.683 976 HE3 LYS 116 3HE LYS 116 -13.979 8.629 7.282 977 HZ1 LYS 116 3HZ LYS 116 -15.571 6.873 7.556 978 HZ2 LYS 116 1HZ LYS 116 -14.797 5.921 6.395 979 HZ3 LYS 116 2HZ LYS 116 -15.554 7.358 5.943 980 H LYS 117 H LYS 117 -13.150 5.128 1.447 981 HA LYS 117 HA LYS 117 -14.710 3.070 2.687 982 HB2 LYS 117 2HB LYS 117 -14.863 4.181 -0.148 983 HB3 LYS 117 3HB LYS 117 -16.115 3.234 0.652 984 HG2 LYS 117 2HG LYS 117 -16.561 5.031 2.221 985 HG3 LYS 117 3HG LYS 117 -15.176 5.947 1.626 986 HD2 LYS 117 2HD LYS 117 -17.135 6.942 0.651 987 HD3 LYS 117 3HD LYS 117 -16.309 6.063 -0.634 988 HE2 LYS 117 2HE LYS 117 -18.676 5.656 -0.850 989 HE3 LYS 117 3HE LYS 117 -17.936 4.163 -0.274 990 HZ1 LYS 117 3HZ LYS 117 -19.990 4.680 0.901 991 HZ2 LYS 117 1HZ LYS 117 -19.353 6.157 1.416 992 HZ3 LYS 117 2HZ LYS 117 -18.676 4.708 1.963 993 H ARG 118 H ARG 118 -12.534 3.183 -0.141 994 HA ARG 118 HA ARG 118 -13.126 0.553 -1.089 995 HB2 ARG 118 2HB ARG 118 -12.402 2.362 -2.604 996 HB3 ARG 118 3HB ARG 118 -10.822 2.409 -1.833 997 HG2 ARG 118 2HG ARG 118 -10.218 0.257 -2.730 998 HG3 ARG 118 3HG ARG 118 -11.877 -0.078 -3.227 999 HD2 ARG 118 2HD ARG 118 -10.113 2.102 -4.403 1000 HD3 ARG 118 3HD ARG 118 -10.411 0.523 -5.144 1001 HE ARG 118 HE ARG 118 -12.912 1.531 -4.750 1002 HH11 ARG 118 1HH1 ARG 118 -10.116 2.807 -6.489 1003 HH12 ARG 118 2HH1 ARG 118 -11.091 3.705 -7.604 1004 HH21 ARG 118 1HH2 ARG 118 -14.140 2.746 -6.180 1005 HH22 ARG 118 2HH2 ARG 118 -13.361 3.669 -7.429 1006 H LEU 119 H LEU 119 -10.795 1.831 1.181 1007 HA LEU 119 HA LEU 119 -8.939 -0.266 1.331 1008 HB2 LEU 119 2HB LEU 119 -9.992 1.621 3.474 1009 HB3 LEU 119 3HB LEU 119 -8.715 0.458 3.797 1010 HG LEU 119 HG LEU 119 -8.570 2.765 1.823 1011 HD11 LEU 119 1HD1 LEU 119 -8.417 3.460 4.166 1012 HD12 LEU 119 2HD1 LEU 119 -6.894 3.689 3.314 1013 HD13 LEU 119 3HD1 LEU 119 -7.087 2.328 4.423 1014 HD21 LEU 119 3HD2 LEU 119 -6.231 2.110 1.485 1015 HD22 LEU 119 1HD2 LEU 119 -7.344 0.854 0.948 1016 HD23 LEU 119 2HD2 LEU 119 -6.484 0.674 2.482 1017 H LYS 120 H LYS 120 -11.919 0.273 3.188 1018 HA LYS 120 HA LYS 120 -11.910 -2.151 4.611 1019 HB2 LYS 120 2HB LYS 120 -13.236 -0.093 5.223 1020 HB3 LYS 120 3HB LYS 120 -14.330 -0.429 3.878 1021 HG2 LYS 120 2HG LYS 120 -14.936 -2.579 4.909 1022 HG3 LYS 120 3HG LYS 120 -13.809 -2.266 6.225 1023 HD2 LYS 120 2HD LYS 120 -15.180 -0.268 6.869 1024 HD3 LYS 120 3HD LYS 120 -16.343 -0.710 5.610 1025 HE2 LYS 120 2HE LYS 120 -15.584 -2.364 8.044 1026 HE3 LYS 120 3HE LYS 120 -17.130 -1.570 7.743 1027 HZ1 LYS 120 3HZ LYS 120 -17.417 -3.028 5.804 1028 HZ2 LYS 120 1HZ LYS 120 -17.293 -3.897 7.251 1029 HZ3 LYS 120 2HZ LYS 120 -15.978 -3.824 6.194 1030 H GLU 121 H GLU 121 -13.288 -1.217 1.509 1031 HA GLU 121 HA GLU 121 -14.843 -3.444 0.843 1032 HB2 GLU 121 2HB GLU 121 -14.744 -1.219 -0.361 1033 HB3 GLU 121 3HB GLU 121 -13.199 -1.698 -1.041 1034 HG2 GLU 121 2HG GLU 121 -14.842 -2.044 -2.734 1035 HG3 GLU 121 3HG GLU 121 -14.372 -3.638 -2.147 1036 H LEU 122 H LEU 122 -11.383 -2.796 0.320 1037 HA LEU 122 HA LEU 122 -10.864 -5.234 -1.119 1038 HB2 LEU 122 2HB LEU 122 -8.971 -3.131 0.009 1039 HB3 LEU 122 3HB LEU 122 -8.442 -4.516 -0.935 1040 HG LEU 122 HG LEU 122 -10.231 -2.259 -1.934 1041 HD11 LEU 122 1HD1 LEU 122 -7.370 -2.936 -2.680 1042 HD12 LEU 122 2HD1 LEU 122 -7.896 -1.572 -1.690 1043 HD13 LEU 122 3HD1 LEU 122 -8.359 -1.651 -3.387 1044 HD21 LEU 122 3HD2 LEU 122 -10.079 -3.305 -4.158 1045 HD22 LEU 122 1HD2 LEU 122 -10.889 -4.361 -2.999 1046 HD23 LEU 122 2HD2 LEU 122 -9.216 -4.679 -3.462 1047 H LEU 123 H LEU 123 -10.632 -4.206 2.269 1048 HA LEU 123 HA LEU 123 -9.104 -6.390 3.259 1049 HB2 LEU 123 2HB LEU 123 -10.857 -4.301 4.470 1050 HB3 LEU 123 3HB LEU 123 -10.783 -5.788 5.395 1051 HG LEU 123 HG LEU 123 -8.276 -5.585 5.455 1052 HD11 LEU 123 1HD1 LEU 123 -8.719 -2.838 4.255 1053 HD12 LEU 123 2HD1 LEU 123 -7.892 -4.191 3.483 1054 HD13 LEU 123 3HD1 LEU 123 -7.199 -3.445 4.920 1055 HD21 LEU 123 3HD2 LEU 123 -8.239 -3.860 7.187 1056 HD22 LEU 123 1HD2 LEU 123 -9.667 -4.881 7.338 1057 HD23 LEU 123 2HD2 LEU 123 -9.808 -3.262 6.648 1058 H GLU 124 H GLU 124 -12.559 -5.928 2.830 1059 HA GLU 124 HA GLU 124 -13.430 -8.472 3.782 1060 HB2 GLU 124 2HB GLU 124 -14.796 -6.407 1.998 1061 HB3 GLU 124 3HB GLU 124 -15.609 -7.798 2.717 1062 HG2 GLU 124 2HG GLU 124 -15.209 -6.947 4.963 1063 HG3 GLU 124 3HG GLU 124 -14.226 -5.630 4.335 1064 H LYS 125 H LYS 125 -12.143 -7.374 0.739 1065 HA LYS 125 HA LYS 125 -12.776 -9.949 -0.583 1066 HB2 LYS 125 2HB LYS 125 -12.171 -7.191 -1.739 1067 HB3 LYS 125 3HB LYS 125 -12.262 -8.654 -2.721 1068 HG2 LYS 125 2HG LYS 125 -14.586 -8.989 -2.165 1069 HG3 LYS 125 3HG LYS 125 -14.540 -7.701 -0.959 1070 HD2 LYS 125 2HD LYS 125 -14.260 -6.014 -2.711 1071 HD3 LYS 125 3HD LYS 125 -14.162 -7.272 -3.951 1072 HE2 LYS 125 2HE LYS 125 -16.472 -7.878 -3.638 1073 HE3 LYS 125 3HE LYS 125 -16.602 -6.902 -2.175 1074 HZ1 LYS 125 3HZ LYS 125 -17.602 -5.919 -4.212 1075 HZ2 LYS 125 1HZ LYS 125 -16.044 -5.742 -4.845 1076 HZ3 LYS 125 2HZ LYS 125 -16.474 -4.930 -3.427 1077 H VAL 126 H VAL 126 -10.443 -9.012 1.282 1078 HA VAL 126 HA VAL 126 -8.375 -9.789 1.750 1079 HB VAL 126 HB VAL 126 -8.584 -11.602 -0.694 1080 HG11 VAL 126 1HG1 VAL 126 -6.979 -11.960 1.863 1081 HG12 VAL 126 2HG1 VAL 126 -6.328 -11.590 0.266 1082 HG13 VAL 126 3HG1 VAL 126 -7.107 -13.144 0.559 1083 HG21 VAL 126 3HG2 VAL 126 -9.586 -13.321 0.782 1084 HG22 VAL 126 1HG2 VAL 126 -10.605 -11.881 0.693 1085 HG23 VAL 126 2HG2 VAL 126 -9.607 -12.169 2.120 1086 H GLY 127 H GLY 127 -8.928 -7.909 -0.887 1087 HA2 GLY 127 2HA GLY 127 -7.352 -6.150 -1.369 1088 HA3 GLY 127 3HA GLY 127 -6.048 -7.331 -1.279 1089 H SER 128 H SER 128 -9.166 -7.040 -3.056 1090 HA SER 128 HA SER 128 -7.835 -7.416 -5.628 1091 HB2 SER 128 2HB SER 128 -8.144 -9.731 -4.737 1092 HB3 SER 128 3HB SER 128 -9.875 -9.434 -4.583 1093 HG SER 128 HG SER 128 -10.094 -9.504 -6.730 1094 H LEU 129 H LEU 129 -8.970 -6.547 -7.297 1095 HA LEU 129 HA LEU 129 -11.811 -6.030 -7.279 1096 HB2 LEU 129 2HB LEU 129 -10.867 -4.099 -5.950 1097 HB3 LEU 129 3HB LEU 129 -9.881 -3.670 -7.333 1098 HG LEU 129 HG LEU 129 -11.951 -3.167 -8.642 1099 HD11 LEU 129 1HD1 LEU 129 -13.445 -3.704 -6.056 1100 HD12 LEU 129 2HD1 LEU 129 -13.541 -4.654 -7.543 1101 HD13 LEU 129 3HD1 LEU 129 -14.133 -2.995 -7.520 1102 HD21 LEU 129 3HD2 LEU 129 -12.518 -1.063 -7.508 1103 HD22 LEU 129 1HD2 LEU 129 -10.778 -1.353 -7.479 1104 HD23 LEU 129 2HD2 LEU 129 -11.744 -1.635 -6.027 1105 H GLU 130 H GLU 130 -12.520 -5.212 -9.379 1106 HA GLU 130 HA GLU 130 -11.104 -6.268 -11.617 1107 HB2 GLU 130 2HB GLU 130 -12.999 -5.498 -12.918 1108 HB3 GLU 130 3HB GLU 130 -13.607 -6.116 -11.387 1109 HG2 GLU 130 2HG GLU 130 -13.830 -3.811 -10.530 1110 HG3 GLU 130 3HG GLU 130 -13.223 -3.185 -12.064 1111 H HIS 131 H HIS 131 -10.152 -5.142 -13.371 1112 HA HIS 131 HA HIS 131 -9.259 -2.372 -12.904 1113 HB2 HIS 131 2HB HIS 131 -8.577 -4.364 -15.118 1114 HB3 HIS 131 3HB HIS 131 -7.957 -2.716 -15.050 1115 HD1 HIS 131 HD1 HIS 131 -7.144 -6.074 -14.024 1116 HD2 HIS 131 HD2 HIS 131 -6.377 -2.257 -12.575 1117 HE1 HIS 131 HE1 HIS 131 -5.173 -6.308 -12.492 1118 HE2 HIS 131 HE2 HIS 131 -4.833 -4.024 -11.537 1119 H HIS 132 H HIS 132 -11.498 -1.551 -13.018 1120 HA HIS 132 HA HIS 132 -12.615 -1.395 -15.735 1121 HB2 HIS 132 2HB HIS 132 -14.145 -1.878 -13.765 1122 HB3 HIS 132 3HB HIS 132 -13.823 -0.247 -13.176 1123 HD1 HIS 132 HD1 HIS 132 -14.861 1.728 -14.533 1124 HD2 HIS 132 HD2 HIS 132 -15.831 -2.037 -16.008 1125 HE1 HIS 132 HE1 HIS 132 -16.627 2.116 -16.277 1126 HE2 HIS 132 HE2 HIS 132 -16.983 -0.139 -17.320 1127 H HIS 133 H HIS 133 -11.244 -0.008 -16.801 1128 HA HIS 133 HA HIS 133 -11.101 2.796 -15.838 1129 HB2 HIS 133 2HB HIS 133 -8.888 1.575 -15.598 1130 HB3 HIS 133 3HB HIS 133 -8.863 1.367 -17.345 1131 HD1 HIS 133 HD1 HIS 133 -9.043 4.199 -14.819 1132 HD2 HIS 133 HD2 HIS 133 -7.666 3.459 -18.670 1133 HE1 HIS 133 HE1 HIS 133 -7.946 6.327 -15.569 1134 HE2 HIS 133 HE2 HIS 133 -7.381 5.926 -17.977 1135 H HIS 134 H HIS 134 -11.808 0.611 -18.436 1136 HA HIS 134 HA HIS 134 -11.869 2.505 -20.584 1137 HB2 HIS 134 2HB HIS 134 -13.450 -0.080 -20.213 1138 HB3 HIS 134 3HB HIS 134 -13.412 0.854 -21.700 1139 HD1 HIS 134 HD1 HIS 134 -11.156 0.838 -23.049 1140 HD2 HIS 134 HD2 HIS 134 -11.273 -1.796 -19.837 1141 HE1 HIS 134 HE1 HIS 134 -9.232 -0.739 -23.390 1142 HE2 HIS 134 HE2 HIS 134 -9.266 -2.249 -21.395 1143 H HIS 135 H HIS 135 -12.849 4.376 -19.889 1144 HA HIS 135 HA HIS 135 -15.709 4.316 -19.087 1145 HB2 HIS 135 2HB HIS 135 -14.332 4.938 -17.133 1146 HB3 HIS 135 3HB HIS 135 -13.506 6.176 -18.068 1147 HD1 HIS 135 HD1 HIS 135 -15.009 8.299 -18.778 1148 HD2 HIS 135 HD2 HIS 135 -16.722 5.749 -15.976 1149 HE1 HIS 135 HE1 HIS 135 -16.939 9.569 -17.793 1150 HE2 HIS 135 HE2 HIS 135 -17.883 8.050 -16.035 1151 H HIS 136 H HIS 136 -16.899 5.232 -20.638 1152 HA HIS 136 HA HIS 136 -15.814 7.134 -22.551 1153 HB2 HIS 136 2HB HIS 136 -17.422 5.313 -23.242 1154 HB3 HIS 136 3HB HIS 136 -18.684 6.094 -22.293 1155 HD1 HIS 136 HD1 HIS 136 -19.243 8.649 -23.123 1156 HD2 HIS 136 HD2 HIS 136 -17.220 6.225 -25.824 1157 HE1 HIS 136 HE1 HIS 136 -19.513 9.754 -25.359 1158 HE2 HIS 136 HE2 HIS 136 -18.392 8.210 -26.988 Start of MODEL 19 1 H1 MET 1 1H MET 1 -1.741 -15.798 -1.849 2 H2 MET 1 2H MET 1 -2.051 -14.460 -2.837 3 H3 MET 1 3H MET 1 -3.321 -15.470 -2.363 4 HA MET 1 HA MET 1 -3.299 -13.387 -1.135 5 HB2 MET 1 2HB MET 1 -2.683 -15.896 0.482 6 HB3 MET 1 3HB MET 1 -3.323 -14.416 1.179 7 HG2 MET 1 2HG MET 1 -5.345 -14.639 -0.217 8 HG3 MET 1 3HG MET 1 -4.706 -16.147 -0.878 9 HE1 MET 1 3HE MET 1 -6.920 -17.490 -0.168 10 HE2 MET 1 1HE MET 1 -7.617 -15.995 0.462 11 HE3 MET 1 2HE MET 1 -7.594 -17.449 1.460 12 H GLY 2 H GLY 2 -2.119 -12.918 1.323 13 HA2 GLY 2 2HA GLY 2 -0.353 -11.761 2.222 14 HA3 GLY 2 3HA GLY 2 0.717 -12.720 1.207 15 H THR 3 H THR 3 -1.902 -10.658 0.084 16 HA THR 3 HA THR 3 -0.374 -9.465 -1.975 17 HB THR 3 HB THR 3 -2.426 -8.018 -2.320 18 HG1 THR 3 HG1 THR 3 -3.015 -8.025 -0.016 19 HG21 THR 3 3HG2 THR 3 -3.013 -10.973 -1.935 20 HG22 THR 3 1HG2 THR 3 -2.321 -10.239 -3.384 21 HG23 THR 3 2HG2 THR 3 -3.972 -9.848 -2.901 22 H VAL 4 H VAL 4 0.671 -7.521 -2.092 23 HA VAL 4 HA VAL 4 1.131 -6.116 0.459 24 HB VAL 4 HB VAL 4 2.593 -5.676 -2.204 25 HG11 VAL 4 1HG1 VAL 4 2.892 -3.903 -0.507 26 HG12 VAL 4 2HG1 VAL 4 4.400 -4.767 -0.796 27 HG13 VAL 4 3HG1 VAL 4 3.458 -5.100 0.660 28 HG21 VAL 4 3HG2 VAL 4 2.783 -8.064 -1.613 29 HG22 VAL 4 1HG2 VAL 4 3.375 -7.637 -0.006 30 HG23 VAL 4 2HG2 VAL 4 4.338 -7.253 -1.436 31 H VAL 5 H VAL 5 -0.283 -4.492 0.806 32 HA VAL 5 HA VAL 5 -1.181 -2.812 -1.465 33 HB VAL 5 HB VAL 5 -3.272 -2.322 -0.061 34 HG11 VAL 5 1HG1 VAL 5 -2.935 -5.181 -1.047 35 HG12 VAL 5 2HG1 VAL 5 -3.349 -3.784 -2.039 36 HG13 VAL 5 3HG1 VAL 5 -4.473 -4.343 -0.802 37 HG21 VAL 5 3HG2 VAL 5 -2.405 -4.801 1.493 38 HG22 VAL 5 1HG2 VAL 5 -3.965 -3.987 1.639 39 HG23 VAL 5 2HG2 VAL 5 -2.488 -3.159 2.131 40 H ILE 6 H ILE 6 -0.265 -0.896 -1.396 41 HA ILE 6 HA ILE 6 0.828 0.122 1.161 42 HB ILE 6 HB ILE 6 1.624 0.942 -1.676 43 HG12 ILE 6 2HG1 ILE 6 3.875 -0.233 -0.998 44 HG13 ILE 6 3HG1 ILE 6 2.921 -1.065 0.220 45 HG21 ILE 6 1HG2 ILE 6 3.524 2.094 -0.585 46 HG22 ILE 6 2HG2 ILE 6 2.895 1.636 0.999 47 HG23 ILE 6 3HG2 ILE 6 1.973 2.731 -0.033 48 HD11 ILE 6 3HD1 ILE 6 2.475 -1.199 -2.761 49 HD12 ILE 6 1HD1 ILE 6 1.557 -2.075 -1.536 50 HD13 ILE 6 2HD1 ILE 6 3.270 -2.420 -1.771 51 H VAL 7 H VAL 7 -0.512 1.565 2.068 52 HA VAL 7 HA VAL 7 -2.329 3.231 0.495 53 HB VAL 7 HB VAL 7 -1.922 3.047 3.524 54 HG11 VAL 7 1HG1 VAL 7 -4.046 4.300 3.723 55 HG12 VAL 7 2HG1 VAL 7 -4.109 4.486 1.969 56 HG13 VAL 7 3HG1 VAL 7 -2.813 5.251 2.891 57 HG21 VAL 7 3HG2 VAL 7 -4.032 1.779 3.547 58 HG22 VAL 7 1HG2 VAL 7 -2.811 0.963 2.572 59 HG23 VAL 7 2HG2 VAL 7 -4.113 1.856 1.784 60 H VAL 8 H VAL 8 -1.825 5.240 -0.086 61 HA VAL 8 HA VAL 8 0.414 6.698 1.178 62 HB VAL 8 HB VAL 8 -0.027 6.781 -1.840 63 HG11 VAL 8 1HG1 VAL 8 2.275 7.627 -1.897 64 HG12 VAL 8 2HG1 VAL 8 2.412 7.442 -0.149 65 HG13 VAL 8 3HG1 VAL 8 1.274 8.609 -0.826 66 HG21 VAL 8 3HG2 VAL 8 0.403 4.420 -1.369 67 HG22 VAL 8 1HG2 VAL 8 1.853 4.837 -0.454 68 HG23 VAL 8 2HG2 VAL 8 1.785 5.146 -2.191 69 H SER 9 H SER 9 0.194 8.916 1.134 70 HA SER 9 HA SER 9 -1.726 10.344 -0.442 71 HB2 SER 9 2HB SER 9 -2.957 11.330 1.560 72 HB3 SER 9 3HB SER 9 -3.327 9.631 1.252 73 HG SER 9 HG SER 9 -1.583 9.226 2.857 74 H ASN 10 H ASN 10 -1.621 12.729 0.131 75 HA ASN 10 HA ASN 10 1.174 13.469 0.579 76 HB2 ASN 10 2HB ASN 10 -1.201 15.191 -0.265 77 HB3 ASN 10 3HB ASN 10 0.484 15.706 -0.250 78 HD21 ASN 10 1HD2 ASN 10 -1.420 15.590 -2.477 79 HD22 ASN 10 2HD2 ASN 10 -0.688 14.580 -3.670 80 H ASP 11 H ASP 11 -0.708 12.629 2.812 81 HA ASP 11 HA ASP 11 -0.202 14.712 4.736 82 HB2 ASP 11 2HB ASP 11 -2.253 15.538 3.627 83 HB3 ASP 11 3HB ASP 11 -3.046 13.998 3.910 84 H GLU 12 H GLU 12 -0.386 13.940 6.870 85 HA GLU 12 HA GLU 12 0.027 11.090 7.138 86 HB2 GLU 12 2HB GLU 12 -0.041 13.229 9.311 87 HB3 GLU 12 3HB GLU 12 0.661 11.618 9.444 88 HG2 GLU 12 2HG GLU 12 2.379 12.204 7.792 89 HG3 GLU 12 3HG GLU 12 1.659 13.798 7.583 90 H ARG 13 H ARG 13 -2.483 13.403 7.974 91 HA ARG 13 HA ARG 13 -3.899 11.701 9.805 92 HB2 ARG 13 2HB ARG 13 -4.917 14.198 8.413 93 HB3 ARG 13 3HB ARG 13 -5.602 13.430 9.845 94 HG2 ARG 13 2HG ARG 13 -3.579 14.000 11.141 95 HG3 ARG 13 3HG ARG 13 -2.858 14.729 9.702 96 HD2 ARG 13 2HD ARG 13 -5.332 15.677 11.179 97 HD3 ARG 13 3HD ARG 13 -3.763 16.486 11.093 98 HE ARG 13 HE ARG 13 -4.832 16.099 8.488 99 HH11 ARG 13 1HH1 ARG 13 -5.237 18.179 11.321 100 HH12 ARG 13 2HH1 ARG 13 -5.879 19.497 10.393 101 HH21 ARG 13 1HH2 ARG 13 -5.729 17.789 7.319 102 HH22 ARG 13 2HH2 ARG 13 -6.164 19.272 8.114 103 H ILE 14 H ILE 14 -4.070 12.282 6.335 104 HA ILE 14 HA ILE 14 -6.511 10.900 5.842 105 HB ILE 14 HB ILE 14 -4.076 11.126 4.005 106 HG12 ILE 14 2HG1 ILE 14 -6.590 12.861 4.152 107 HG13 ILE 14 3HG1 ILE 14 -4.969 13.351 4.634 108 HG21 ILE 14 1HG2 ILE 14 -5.576 9.290 3.308 109 HG22 ILE 14 2HG2 ILE 14 -5.642 10.619 2.153 110 HG23 ILE 14 3HG2 ILE 14 -6.954 10.394 3.312 111 HD11 ILE 14 3HD1 ILE 14 -5.562 14.277 2.483 112 HD12 ILE 14 1HD1 ILE 14 -5.848 12.664 1.832 113 HD13 ILE 14 2HD1 ILE 14 -4.220 13.147 2.314 114 H LEU 15 H LEU 15 -3.102 9.832 6.062 115 HA LEU 15 HA LEU 15 -3.452 7.071 5.658 116 HB2 LEU 15 2HB LEU 15 -1.462 8.512 7.452 117 HB3 LEU 15 3HB LEU 15 -1.370 6.799 7.068 118 HG LEU 15 HG LEU 15 -1.205 9.010 4.991 119 HD11 LEU 15 1HD1 LEU 15 1.199 8.597 4.941 120 HD12 LEU 15 2HD1 LEU 15 1.051 7.404 6.235 121 HD13 LEU 15 3HD1 LEU 15 0.696 9.103 6.554 122 HD21 LEU 15 3HD2 LEU 15 -2.041 6.914 4.052 123 HD22 LEU 15 1HD2 LEU 15 -0.721 6.006 4.796 124 HD23 LEU 15 2HD2 LEU 15 -0.385 7.175 3.513 125 H GLU 16 H GLU 16 -3.729 9.031 8.584 126 HA GLU 16 HA GLU 16 -4.120 6.858 10.414 127 HB2 GLU 16 2HB GLU 16 -4.572 9.858 10.697 128 HB3 GLU 16 3HB GLU 16 -4.666 8.711 12.032 129 HG2 GLU 16 2HG GLU 16 -2.312 8.156 11.813 130 HG3 GLU 16 3HG GLU 16 -2.177 9.123 10.346 131 H GLU 17 H GLU 17 -6.284 9.009 8.635 132 HA GLU 17 HA GLU 17 -8.778 8.227 9.742 133 HB2 GLU 17 2HB GLU 17 -8.568 10.215 8.311 134 HB3 GLU 17 3HB GLU 17 -7.993 9.237 6.966 135 HG2 GLU 17 2HG GLU 17 -10.242 9.841 6.482 136 HG3 GLU 17 3HG GLU 17 -10.247 8.131 6.888 137 H LEU 18 H LEU 18 -7.005 7.156 6.879 138 HA LEU 18 HA LEU 18 -8.732 5.061 6.063 139 HB2 LEU 18 2HB LEU 18 -5.979 6.037 5.320 140 HB3 LEU 18 3HB LEU 18 -6.458 4.447 4.762 141 HG LEU 18 HG LEU 18 -8.302 5.370 3.458 142 HD11 LEU 18 1HD1 LEU 18 -7.589 8.135 4.476 143 HD12 LEU 18 2HD1 LEU 18 -9.019 7.209 4.938 144 HD13 LEU 18 3HD1 LEU 18 -8.816 7.738 3.269 145 HD21 LEU 18 3HD2 LEU 18 -5.741 6.929 2.990 146 HD22 LEU 18 1HD2 LEU 18 -7.046 6.728 1.819 147 HD23 LEU 18 2HD2 LEU 18 -6.130 5.326 2.362 148 H LEU 19 H LEU 19 -6.069 5.229 8.279 149 HA LEU 19 HA LEU 19 -5.250 2.561 8.526 150 HB2 LEU 19 2HB LEU 19 -4.030 4.469 9.506 151 HB3 LEU 19 3HB LEU 19 -5.364 4.779 10.602 152 HG LEU 19 HG LEU 19 -4.910 2.413 11.554 153 HD11 LEU 19 1HD1 LEU 19 -2.646 1.538 11.319 154 HD12 LEU 19 2HD1 LEU 19 -2.262 2.785 10.132 155 HD13 LEU 19 3HD1 LEU 19 -3.482 1.561 9.770 156 HD21 LEU 19 3HD2 LEU 19 -3.204 3.260 13.089 157 HD22 LEU 19 1HD2 LEU 19 -4.459 4.459 12.783 158 HD23 LEU 19 2HD2 LEU 19 -2.881 4.614 12.005 159 H GLU 20 H GLU 20 -7.630 4.428 10.326 160 HA GLU 20 HA GLU 20 -8.399 2.416 12.156 161 HB2 GLU 20 2HB GLU 20 -9.915 4.904 11.277 162 HB3 GLU 20 3HB GLU 20 -10.235 3.960 12.732 163 HG2 GLU 20 2HG GLU 20 -7.984 4.521 13.591 164 HG3 GLU 20 3HG GLU 20 -7.674 5.477 12.139 165 H VAL 21 H VAL 21 -9.504 3.270 8.941 166 HA VAL 21 HA VAL 21 -11.898 1.745 8.896 167 HB VAL 21 HB VAL 21 -10.086 2.337 6.513 168 HG11 VAL 21 1HG1 VAL 21 -11.817 0.693 6.031 169 HG12 VAL 21 2HG1 VAL 21 -12.204 2.208 5.226 170 HG13 VAL 21 3HG1 VAL 21 -13.061 1.752 6.695 171 HG21 VAL 21 3HG2 VAL 21 -12.304 4.097 7.630 172 HG22 VAL 21 1HG2 VAL 21 -11.385 4.389 6.150 173 HG23 VAL 21 2HG2 VAL 21 -10.573 4.436 7.714 174 H VAL 22 H VAL 22 -8.511 0.989 8.158 175 HA VAL 22 HA VAL 22 -8.924 -1.690 7.258 176 HB VAL 22 HB VAL 22 -6.391 -0.426 8.421 177 HG11 VAL 22 1HG1 VAL 22 -6.257 -2.886 8.432 178 HG12 VAL 22 2HG1 VAL 22 -5.142 -2.199 7.251 179 HG13 VAL 22 3HG1 VAL 22 -6.655 -2.929 6.713 180 HG21 VAL 22 3HG2 VAL 22 -5.695 -0.026 6.092 181 HG22 VAL 22 1HG2 VAL 22 -7.201 0.816 6.454 182 HG23 VAL 22 2HG2 VAL 22 -7.232 -0.672 5.509 183 H LEU 23 H LEU 23 -8.119 -0.193 10.384 184 HA LEU 23 HA LEU 23 -7.751 -2.620 11.819 185 HB2 LEU 23 2HB LEU 23 -8.239 0.229 12.738 186 HB3 LEU 23 3HB LEU 23 -7.850 -1.090 13.827 187 HG LEU 23 HG LEU 23 -6.047 -0.098 11.586 188 HD11 LEU 23 1HD1 LEU 23 -5.764 0.294 14.581 189 HD12 LEU 23 2HD1 LEU 23 -6.189 1.536 13.401 190 HD13 LEU 23 3HD1 LEU 23 -4.596 0.787 13.350 191 HD21 LEU 23 3HD2 LEU 23 -5.737 -2.500 11.972 192 HD22 LEU 23 1HD2 LEU 23 -5.517 -2.220 13.701 193 HD23 LEU 23 2HD2 LEU 23 -4.336 -1.602 12.544 194 H LYS 24 H LYS 24 -10.658 -0.696 11.200 195 HA LYS 24 HA LYS 24 -12.210 -2.096 13.241 196 HB2 LYS 24 2HB LYS 24 -14.098 -0.744 12.580 197 HB3 LYS 24 3HB LYS 24 -12.688 0.297 12.677 198 HG2 LYS 24 2HG LYS 24 -12.486 0.117 10.166 199 HG3 LYS 24 3HG LYS 24 -14.032 -0.731 10.163 200 HD2 LYS 24 2HD LYS 24 -13.539 2.115 11.120 201 HD3 LYS 24 3HD LYS 24 -14.340 1.642 9.623 202 HE2 LYS 24 2HE LYS 24 -16.121 0.523 11.011 203 HE3 LYS 24 3HE LYS 24 -15.348 1.194 12.450 204 HZ1 LYS 24 3HZ LYS 24 -16.483 2.751 10.191 205 HZ2 LYS 24 1HZ LYS 24 -15.697 3.416 11.531 206 HZ3 LYS 24 2HZ LYS 24 -17.158 2.593 11.733 207 H SER 25 H SER 25 -11.663 -2.279 9.773 208 HA SER 25 HA SER 25 -13.786 -4.084 9.129 209 HB2 SER 25 2HB SER 25 -12.669 -2.651 7.429 210 HB3 SER 25 3HB SER 25 -11.177 -3.562 7.641 211 HG SER 25 HG SER 25 -12.369 -4.303 5.842 212 H ASP 26 H ASP 26 -10.269 -4.536 9.419 213 HA ASP 26 HA ASP 26 -10.579 -7.049 10.829 214 HB2 ASP 26 2HB ASP 26 -10.556 -7.582 8.297 215 HB3 ASP 26 3HB ASP 26 -8.888 -7.027 8.285 216 HA PRO 27 HA PRO 27 -7.110 -4.515 12.505 217 HB2 PRO 27 2HB PRO 27 -7.155 -5.527 15.038 218 HB3 PRO 27 3HB PRO 27 -8.375 -4.367 14.474 219 HG2 PRO 27 2HG PRO 27 -8.583 -7.368 14.631 220 HG3 PRO 27 3HG PRO 27 -9.738 -6.137 15.200 221 HD2 PRO 27 2HD PRO 27 -10.063 -7.404 12.829 222 HD3 PRO 27 3HD PRO 27 -10.538 -5.703 13.051 223 H ASN 28 H ASN 28 -7.479 -7.921 12.190 224 HA ASN 28 HA ASN 28 -4.975 -8.730 13.354 225 HB2 ASN 28 2HB ASN 28 -7.122 -10.072 13.386 226 HB3 ASN 28 3HB ASN 28 -6.940 -10.319 11.651 227 HD21 ASN 28 1HD2 ASN 28 -6.901 -12.539 11.989 228 HD22 ASN 28 2HD2 ASN 28 -5.508 -13.349 12.607 229 H VAL 29 H VAL 29 -6.038 -7.657 10.227 230 HA VAL 29 HA VAL 29 -3.774 -8.481 8.687 231 HB VAL 29 HB VAL 29 -5.606 -6.041 8.386 232 HG11 VAL 29 1HG1 VAL 29 -3.625 -7.145 6.360 233 HG12 VAL 29 2HG1 VAL 29 -3.452 -5.629 7.244 234 HG13 VAL 29 3HG1 VAL 29 -4.764 -5.825 6.083 235 HG21 VAL 29 3HG2 VAL 29 -6.691 -7.330 6.592 236 HG22 VAL 29 1HG2 VAL 29 -6.770 -8.203 8.124 237 HG23 VAL 29 2HG2 VAL 29 -5.603 -8.688 6.891 238 H LYS 30 H LYS 30 -1.713 -7.548 8.530 239 HA LYS 30 HA LYS 30 -0.833 -5.991 10.794 240 HB2 LYS 30 2HB LYS 30 0.548 -7.841 9.992 241 HB3 LYS 30 3HB LYS 30 0.686 -7.105 8.402 242 HG2 LYS 30 2HG LYS 30 2.759 -6.772 9.593 243 HG3 LYS 30 3HG LYS 30 1.955 -5.214 9.416 244 HD2 LYS 30 2HD LYS 30 1.093 -5.507 11.795 245 HD3 LYS 30 3HD LYS 30 2.137 -6.927 11.925 246 HE2 LYS 30 2HE LYS 30 2.990 -4.046 11.485 247 HE3 LYS 30 3HE LYS 30 3.296 -5.042 12.904 248 HZ1 LYS 30 3HZ LYS 30 4.685 -6.488 11.481 249 HZ2 LYS 30 1HZ LYS 30 5.273 -4.903 11.586 250 HZ3 LYS 30 2HZ LYS 30 4.463 -5.411 10.194 251 H THR 31 H THR 31 -1.324 -3.879 10.774 252 HA THR 31 HA THR 31 -0.852 -2.191 8.413 253 HB THR 31 HB THR 31 -1.847 -0.382 9.848 254 HG1 THR 31 HG1 THR 31 -2.959 -1.280 11.801 255 HG21 THR 31 3HG2 THR 31 -3.318 -1.690 8.371 256 HG22 THR 31 1HG2 THR 31 -4.149 -1.233 9.860 257 HG23 THR 31 2HG2 THR 31 -3.558 -2.883 9.653 258 H VAL 32 H VAL 32 0.946 -0.946 8.233 259 HA VAL 32 HA VAL 32 2.706 -0.543 10.591 260 HB VAL 32 HB VAL 32 3.839 -1.053 7.800 261 HG11 VAL 32 1HG1 VAL 32 5.096 -1.215 10.567 262 HG12 VAL 32 2HG1 VAL 32 5.307 0.094 9.402 263 HG13 VAL 32 3HG1 VAL 32 5.923 -1.519 9.038 264 HG21 VAL 32 3HG2 VAL 32 4.305 -3.384 8.408 265 HG22 VAL 32 1HG2 VAL 32 2.568 -3.071 8.394 266 HG23 VAL 32 2HG2 VAL 32 3.433 -3.182 9.926 267 H ARG 33 H ARG 33 3.113 1.584 10.870 268 HA ARG 33 HA ARG 33 2.740 3.479 8.623 269 HB2 ARG 33 2HB ARG 33 3.184 4.233 11.556 270 HB3 ARG 33 3HB ARG 33 2.577 5.256 10.266 271 HG2 ARG 33 2HG ARG 33 0.733 4.786 11.707 272 HG3 ARG 33 3HG ARG 33 0.467 3.832 10.248 273 HD2 ARG 33 2HD ARG 33 1.039 1.799 11.346 274 HD3 ARG 33 3HD ARG 33 1.799 2.639 12.698 275 HE ARG 33 HE ARG 33 -0.723 3.450 12.956 276 HH11 ARG 33 1HH1 ARG 33 0.499 0.187 12.392 277 HH12 ARG 33 2HH1 ARG 33 -0.803 -0.571 13.251 278 HH21 ARG 33 1HH2 ARG 33 -2.342 2.433 14.179 279 HH22 ARG 33 2HH2 ARG 33 -2.404 0.700 14.263 280 H THR 34 H THR 34 4.683 3.356 7.518 281 HA THR 34 HA THR 34 7.210 3.856 8.931 282 HB THR 34 HB THR 34 6.888 1.355 8.940 283 HG1 THR 34 HG1 THR 34 8.982 0.981 7.661 284 HG21 THR 34 3HG2 THR 34 7.085 1.552 5.907 285 HG22 THR 34 1HG2 THR 34 5.640 1.083 6.814 286 HG23 THR 34 2HG2 THR 34 7.079 0.064 6.854 287 H ASP 35 H ASP 35 9.017 3.713 7.135 288 HA ASP 35 HA ASP 35 8.185 4.237 4.406 289 HB2 ASP 35 2HB ASP 35 9.419 6.326 4.152 290 HB3 ASP 35 3HB ASP 35 8.258 6.523 5.455 291 H ASP 36 H ASP 36 10.318 3.087 6.752 292 HA ASP 36 HA ASP 36 12.819 3.028 5.413 293 HB2 ASP 36 2HB ASP 36 12.453 2.945 7.912 294 HB3 ASP 36 3HB ASP 36 11.812 1.315 7.739 295 H LYS 37 H LYS 37 13.188 1.844 3.637 296 HA LYS 37 HA LYS 37 11.334 0.106 2.496 297 HB2 LYS 37 2HB LYS 37 12.895 -0.212 0.681 298 HB3 LYS 37 3HB LYS 37 12.961 1.454 1.217 299 HG2 LYS 37 2HG LYS 37 15.064 0.864 2.498 300 HG3 LYS 37 3HG LYS 37 15.024 -0.700 1.681 301 HD2 LYS 37 2HD LYS 37 16.504 0.622 0.374 302 HD3 LYS 37 3HD LYS 37 14.987 0.625 -0.531 303 HE2 LYS 37 2HE LYS 37 16.031 2.860 -0.478 304 HE3 LYS 37 3HE LYS 37 14.460 2.861 0.323 305 HZ1 LYS 37 3HZ LYS 37 16.091 4.109 1.578 306 HZ2 LYS 37 1HZ LYS 37 17.100 2.753 1.689 307 HZ3 LYS 37 2HZ LYS 37 15.591 2.755 2.454 308 H GLU 38 H GLU 38 14.394 -0.635 4.125 309 HA GLU 38 HA GLU 38 14.373 -3.421 3.586 310 HB2 GLU 38 2HB GLU 38 16.169 -3.527 5.350 311 HB3 GLU 38 3HB GLU 38 16.477 -2.370 4.063 312 HG2 GLU 38 2HG GLU 38 15.805 -0.527 5.506 313 HG3 GLU 38 3HG GLU 38 15.390 -1.656 6.791 314 H LYS 39 H LYS 39 13.100 -1.452 6.258 315 HA LYS 39 HA LYS 39 12.321 -3.491 8.017 316 HB2 LYS 39 2HB LYS 39 12.206 -1.156 8.706 317 HB3 LYS 39 3HB LYS 39 10.985 -0.805 7.485 318 HG2 LYS 39 2HG LYS 39 9.370 -2.245 8.632 319 HG3 LYS 39 3HG LYS 39 10.595 -2.722 9.808 320 HD2 LYS 39 2HD LYS 39 10.698 -0.387 10.638 321 HD3 LYS 39 3HD LYS 39 9.462 0.076 9.461 322 HE2 LYS 39 2HE LYS 39 7.806 -1.323 10.542 323 HE3 LYS 39 3HE LYS 39 9.026 -2.042 11.597 324 HZ1 LYS 39 3HZ LYS 39 7.833 -0.439 12.839 325 HZ2 LYS 39 1HZ LYS 39 8.034 0.753 11.655 326 HZ3 LYS 39 2HZ LYS 39 9.365 0.212 12.544 327 H VAL 40 H VAL 40 10.535 -1.974 5.340 328 HA VAL 40 HA VAL 40 8.144 -3.425 5.538 329 HB VAL 40 HB VAL 40 9.372 -2.276 2.990 330 HG11 VAL 40 1HG1 VAL 40 6.486 -3.022 3.621 331 HG12 VAL 40 2HG1 VAL 40 7.551 -3.831 2.470 332 HG13 VAL 40 3HG1 VAL 40 7.020 -2.177 2.165 333 HG21 VAL 40 3HG2 VAL 40 7.469 -0.958 4.965 334 HG22 VAL 40 1HG2 VAL 40 8.022 -0.260 3.440 335 HG23 VAL 40 2HG2 VAL 40 9.173 -0.556 4.744 336 H LYS 41 H LYS 41 11.042 -4.043 3.591 337 HA LYS 41 HA LYS 41 10.124 -6.331 2.225 338 HB2 LYS 41 2HB LYS 41 12.956 -5.398 2.857 339 HB3 LYS 41 3HB LYS 41 12.570 -6.685 1.715 340 HG2 LYS 41 2HG LYS 41 11.519 -5.181 0.193 341 HG3 LYS 41 3HG LYS 41 11.407 -3.907 1.405 342 HD2 LYS 41 2HD LYS 41 13.125 -3.222 -0.089 343 HD3 LYS 41 3HD LYS 41 13.952 -3.779 1.360 344 HE2 LYS 41 2HE LYS 41 13.593 -5.498 -1.113 345 HE3 LYS 41 3HE LYS 41 14.987 -4.458 -0.852 346 HZ1 LYS 41 3HZ LYS 41 15.496 -6.690 -0.206 347 HZ2 LYS 41 1HZ LYS 41 14.176 -6.755 0.848 348 HZ3 LYS 41 2HZ LYS 41 15.470 -5.719 1.178 349 H GLU 42 H GLU 42 11.565 -5.972 5.413 350 HA GLU 42 HA GLU 42 12.066 -8.774 5.879 351 HB2 GLU 42 2HB GLU 42 11.923 -6.385 7.754 352 HB3 GLU 42 3HB GLU 42 12.289 -8.017 8.307 353 HG2 GLU 42 2HG GLU 42 14.308 -8.080 6.960 354 HG3 GLU 42 3HG GLU 42 13.929 -6.511 6.254 355 H GLU 43 H GLU 43 9.411 -6.517 6.715 356 HA GLU 43 HA GLU 43 7.971 -8.579 8.136 357 HB2 GLU 43 2HB GLU 43 6.177 -6.937 8.432 358 HB3 GLU 43 3HB GLU 43 7.749 -6.370 8.962 359 HG2 GLU 43 2HG GLU 43 7.819 -5.214 6.602 360 HG3 GLU 43 3HG GLU 43 6.068 -5.416 6.666 361 H ILE 44 H ILE 44 8.069 -7.525 4.860 362 HA ILE 44 HA ILE 44 5.766 -8.730 3.809 363 HB ILE 44 HB ILE 44 8.535 -8.242 2.656 364 HG12 ILE 44 2HG1 ILE 44 5.783 -7.117 1.932 365 HG13 ILE 44 3HG1 ILE 44 7.014 -6.296 2.884 366 HG21 ILE 44 1HG2 ILE 44 7.795 -8.992 0.410 367 HG22 ILE 44 2HG2 ILE 44 6.305 -9.613 1.115 368 HG23 ILE 44 3HG2 ILE 44 7.851 -10.328 1.564 369 HD11 ILE 44 3HD1 ILE 44 8.489 -6.278 0.906 370 HD12 ILE 44 1HD1 ILE 44 6.971 -5.419 0.649 371 HD13 ILE 44 2HD1 ILE 44 7.196 -7.028 -0.037 372 H GLU 45 H GLU 45 8.930 -10.238 4.692 373 HA GLU 45 HA GLU 45 8.285 -12.825 3.690 374 HB2 GLU 45 2HB GLU 45 10.293 -13.611 4.584 375 HB3 GLU 45 3HB GLU 45 10.640 -11.899 4.411 376 HG2 GLU 45 2HG GLU 45 10.156 -11.587 6.841 377 HG3 GLU 45 3HG GLU 45 9.858 -13.310 6.977 378 H LYS 46 H LYS 46 7.559 -11.204 6.691 379 HA LYS 46 HA LYS 46 6.557 -13.493 8.119 380 HB2 LYS 46 2HB LYS 46 5.783 -10.592 8.654 381 HB3 LYS 46 3HB LYS 46 5.784 -11.934 9.791 382 HG2 LYS 46 2HG LYS 46 8.195 -10.529 8.617 383 HG3 LYS 46 3HG LYS 46 7.632 -10.451 10.286 384 HD2 LYS 46 2HD LYS 46 8.201 -12.846 10.592 385 HD3 LYS 46 3HD LYS 46 8.723 -12.939 8.907 386 HE2 LYS 46 2HE LYS 46 10.460 -11.185 9.417 387 HE3 LYS 46 3HE LYS 46 10.001 -11.292 11.118 388 HZ1 LYS 46 3HZ LYS 46 10.611 -13.661 11.054 389 HZ2 LYS 46 1HZ LYS 46 11.915 -12.653 10.681 390 HZ3 LYS 46 2HZ LYS 46 11.116 -13.484 9.449 391 H ALA 47 H ALA 47 5.169 -10.948 6.081 392 HA ALA 47 HA ALA 47 2.422 -11.411 6.619 393 HB1 ALA 47 3HB ALA 47 3.288 -9.271 5.778 394 HB2 ALA 47 1HB ALA 47 2.012 -9.893 4.731 395 HB3 ALA 47 2HB ALA 47 3.705 -10.027 4.240 396 H ARG 48 H ARG 48 4.510 -12.432 3.906 397 HA ARG 48 HA ARG 48 2.589 -13.870 2.410 398 HB2 ARG 48 2HB ARG 48 4.549 -15.035 1.365 399 HB3 ARG 48 3HB ARG 48 4.721 -13.287 1.398 400 HG2 ARG 48 2HG ARG 48 6.239 -13.431 3.306 401 HG3 ARG 48 3HG ARG 48 6.026 -15.176 3.375 402 HD2 ARG 48 2HD ARG 48 7.174 -13.772 0.943 403 HD3 ARG 48 3HD ARG 48 8.173 -14.324 2.292 404 HE ARG 48 HE ARG 48 6.545 -16.444 1.367 405 HH11 ARG 48 1HH1 ARG 48 9.432 -14.635 0.419 406 HH12 ARG 48 2HH1 ARG 48 10.084 -15.953 -0.505 407 HH21 ARG 48 1HH2 ARG 48 7.384 -18.125 0.126 408 HH22 ARG 48 2HH2 ARG 48 8.916 -17.941 -0.673 409 H LYS 49 H LYS 49 4.535 -14.742 5.204 410 HA LYS 49 HA LYS 49 3.954 -17.545 5.250 411 HB2 LYS 49 2HB LYS 49 5.930 -16.611 6.407 412 HB3 LYS 49 3HB LYS 49 4.890 -15.683 7.483 413 HG2 LYS 49 2HG LYS 49 3.957 -17.865 8.345 414 HG3 LYS 49 3HG LYS 49 5.164 -18.709 7.374 415 HD2 LYS 49 2HD LYS 49 6.971 -17.582 8.656 416 HD3 LYS 49 3HD LYS 49 5.754 -16.733 9.615 417 HE2 LYS 49 2HE LYS 49 4.906 -18.929 10.436 418 HE3 LYS 49 3HE LYS 49 6.177 -19.739 9.519 419 HZ1 LYS 49 3HZ LYS 49 6.557 -17.853 11.775 420 HZ2 LYS 49 1HZ LYS 49 7.815 -18.503 10.847 421 HZ3 LYS 49 2HZ LYS 49 6.843 -19.519 11.786 422 H GLN 50 H GLN 50 2.485 -14.666 6.750 423 HA GLN 50 HA GLN 50 0.565 -16.056 8.372 424 HB2 GLN 50 2HB GLN 50 0.414 -13.177 7.356 425 HB3 GLN 50 3HB GLN 50 -0.523 -13.857 8.680 426 HG2 GLN 50 2HG GLN 50 2.455 -13.329 8.638 427 HG3 GLN 50 3HG GLN 50 1.240 -12.469 9.568 428 HE21 GLN 50 1HE2 GLN 50 3.663 -13.868 10.460 429 HE22 GLN 50 2HE2 GLN 50 3.131 -15.052 11.602 430 H GLY 51 H GLY 51 0.692 -15.043 5.034 431 HA2 GLY 51 2HA GLY 51 -0.729 -15.472 3.259 432 HA3 GLY 51 3HA GLY 51 -1.864 -16.239 4.362 433 H ARG 52 H ARG 52 -1.304 -13.427 5.843 434 HA ARG 52 HA ARG 52 -3.728 -12.178 4.806 435 HB2 ARG 52 2HB ARG 52 -2.044 -11.620 7.289 436 HB3 ARG 52 3HB ARG 52 -3.497 -10.718 6.856 437 HG2 ARG 52 2HG ARG 52 -4.848 -12.768 7.048 438 HG3 ARG 52 3HG ARG 52 -3.401 -13.693 7.461 439 HD2 ARG 52 2HD ARG 52 -3.125 -12.395 9.520 440 HD3 ARG 52 3HD ARG 52 -4.494 -11.371 9.084 441 HE ARG 52 HE ARG 52 -5.964 -13.078 9.628 442 HH11 ARG 52 1HH1 ARG 52 -2.689 -14.270 9.951 443 HH12 ARG 52 2HH1 ARG 52 -3.162 -15.669 10.858 444 HH21 ARG 52 1HH2 ARG 52 -6.569 -14.835 10.893 445 HH22 ARG 52 2HH2 ARG 52 -5.376 -15.992 11.396 446 HA PRO 53 HA PRO 53 -1.591 -9.018 2.435 447 HB2 PRO 53 2HB PRO 53 -3.766 -7.178 3.466 448 HB3 PRO 53 3HB PRO 53 -3.249 -7.494 1.792 449 HG2 PRO 53 2HG PRO 53 -5.496 -8.557 2.671 450 HG3 PRO 53 3HG PRO 53 -4.389 -9.536 1.678 451 HD2 PRO 53 2HD PRO 53 -4.774 -9.578 4.674 452 HD3 PRO 53 3HD PRO 53 -4.623 -10.938 3.534 453 H ILE 54 H ILE 54 -0.148 -7.348 2.729 454 HA ILE 54 HA ILE 54 0.288 -6.360 5.489 455 HB ILE 54 HB ILE 54 2.200 -7.610 4.753 456 HG12 ILE 54 2HG1 ILE 54 4.043 -5.880 4.714 457 HG13 ILE 54 3HG1 ILE 54 2.816 -4.635 4.539 458 HG21 ILE 54 1HG2 ILE 54 2.308 -5.968 2.212 459 HG22 ILE 54 2HG2 ILE 54 1.838 -7.663 2.346 460 HG23 ILE 54 3HG2 ILE 54 3.495 -7.178 2.706 461 HD11 ILE 54 3HD1 ILE 54 3.621 -4.814 6.821 462 HD12 ILE 54 1HD1 ILE 54 3.113 -6.501 6.889 463 HD13 ILE 54 2HD1 ILE 54 1.908 -5.218 6.730 464 H VAL 55 H VAL 55 -0.344 -4.320 5.822 465 HA VAL 55 HA VAL 55 -0.805 -2.544 3.508 466 HB VAL 55 HB VAL 55 -1.973 -2.060 6.275 467 HG11 VAL 55 1HG1 VAL 55 -2.072 -0.200 4.653 468 HG12 VAL 55 2HG1 VAL 55 -3.686 -0.807 5.019 469 HG13 VAL 55 3HG1 VAL 55 -2.908 -1.241 3.492 470 HG21 VAL 55 3HG2 VAL 55 -3.271 -3.741 4.099 471 HG22 VAL 55 1HG2 VAL 55 -4.025 -3.242 5.616 472 HG23 VAL 55 2HG2 VAL 55 -2.648 -4.344 5.634 473 H ILE 56 H ILE 56 0.743 -1.087 3.180 474 HA ILE 56 HA ILE 56 2.426 -0.144 5.431 475 HB ILE 56 HB ILE 56 3.005 -0.187 2.431 476 HG12 ILE 56 2HG1 ILE 56 3.051 -2.448 3.432 477 HG13 ILE 56 3HG1 ILE 56 4.672 -1.941 2.981 478 HG21 ILE 56 1HG2 ILE 56 4.827 0.682 4.711 479 HG22 ILE 56 2HG2 ILE 56 4.150 1.726 3.457 480 HG23 ILE 56 3HG2 ILE 56 5.322 0.479 3.029 481 HD11 ILE 56 3HD1 ILE 56 5.153 -1.417 5.347 482 HD12 ILE 56 1HD1 ILE 56 4.695 -3.105 5.111 483 HD13 ILE 56 2HD1 ILE 56 3.533 -1.966 5.784 484 H PHE 57 H PHE 57 1.847 1.762 6.163 485 HA PHE 57 HA PHE 57 0.489 3.787 4.548 486 HB2 PHE 57 2HB PHE 57 0.971 3.502 7.549 487 HB3 PHE 57 3HB PHE 57 0.246 4.937 6.827 488 HD1 PHE 57 HD2 PHE 57 -0.244 1.279 7.382 489 HD2 PHE 57 HD1 PHE 57 -2.047 4.959 6.148 490 HE1 PHE 57 HE2 PHE 57 -2.468 0.217 7.405 491 HE2 PHE 57 HE1 PHE 57 -4.258 3.887 6.187 492 HZ PHE 57 HZ PHE 57 -4.456 1.528 6.784 493 H ILE 58 H ILE 58 1.726 5.155 3.516 494 HA ILE 58 HA ILE 58 4.114 6.392 4.759 495 HB ILE 58 HB ILE 58 5.226 6.408 2.496 496 HG12 ILE 58 2HG1 ILE 58 3.030 4.442 1.704 497 HG13 ILE 58 3HG1 ILE 58 3.104 6.124 1.187 498 HG21 ILE 58 1HG2 ILE 58 5.935 4.693 4.104 499 HG22 ILE 58 2HG2 ILE 58 5.983 4.049 2.466 500 HG23 ILE 58 3HG2 ILE 58 4.660 3.608 3.549 501 HD11 ILE 58 3HD1 ILE 58 3.905 4.755 -0.545 502 HD12 ILE 58 1HD1 ILE 58 5.035 3.940 0.535 503 HD13 ILE 58 2HD1 ILE 58 5.271 5.642 0.128 504 H ARG 59 H ARG 59 4.593 8.511 3.908 505 HA ARG 59 HA ARG 59 2.312 9.895 2.677 506 HB2 ARG 59 2HB ARG 59 3.628 10.736 4.767 507 HB3 ARG 59 3HB ARG 59 4.885 11.212 3.630 508 HG2 ARG 59 2HG ARG 59 3.348 12.731 2.504 509 HG3 ARG 59 3HG ARG 59 2.005 12.165 3.495 510 HD2 ARG 59 2HD ARG 59 3.100 13.104 5.511 511 HD3 ARG 59 3HD ARG 59 4.445 13.673 4.510 512 HE ARG 59 HE ARG 59 2.344 14.803 3.287 513 HH11 ARG 59 1HH1 ARG 59 3.294 14.839 6.668 514 HH12 ARG 59 2HH1 ARG 59 2.558 16.377 6.976 515 HH21 ARG 59 1HH2 ARG 59 1.331 16.766 3.703 516 HH22 ARG 59 2HH2 ARG 59 1.434 17.485 5.283 517 H GLY 60 H GLY 60 2.815 11.474 0.879 518 HA2 GLY 60 2HA GLY 60 3.454 9.952 -1.363 519 HA3 GLY 60 3HA GLY 60 3.203 11.686 -1.359 520 H ALA 61 H ALA 61 5.605 12.101 0.435 521 HA ALA 61 HA ALA 61 7.669 12.386 -1.510 522 HB1 ALA 61 3HB ALA 61 7.891 12.382 1.521 523 HB2 ALA 61 1HB ALA 61 7.558 13.787 0.511 524 HB3 ALA 61 2HB ALA 61 9.122 12.975 0.397 525 H TYR 62 H TYR 62 7.170 10.124 1.140 526 HA TYR 62 HA TYR 62 9.513 8.585 0.846 527 HB2 TYR 62 2HB TYR 62 6.881 7.827 2.175 528 HB3 TYR 62 3HB TYR 62 8.436 7.037 2.432 529 HD1 TYR 62 HD2 TYR 62 10.419 8.691 3.186 530 HD2 TYR 62 HD1 TYR 62 6.259 9.510 3.738 531 HE1 TYR 62 HE2 TYR 62 10.962 10.288 4.972 532 HE2 TYR 62 HE1 TYR 62 6.813 11.119 5.516 533 HH TYR 62 HH TYR 62 9.941 12.268 6.050 534 H GLU 63 H GLU 63 6.481 8.487 -0.788 535 HA GLU 63 HA GLU 63 6.152 5.836 -1.455 536 HB2 GLU 63 2HB GLU 63 4.470 7.612 -1.770 537 HB3 GLU 63 3HB GLU 63 5.380 8.228 -3.151 538 HG2 GLU 63 2HG GLU 63 5.077 5.908 -4.207 539 HG3 GLU 63 3HG GLU 63 3.949 5.564 -2.902 540 H GLU 64 H GLU 64 8.410 8.085 -2.964 541 HA GLU 64 HA GLU 64 8.914 6.872 -5.418 542 HB2 GLU 64 2HB GLU 64 11.252 7.802 -5.204 543 HB3 GLU 64 3HB GLU 64 9.988 8.971 -4.834 544 HG2 GLU 64 2HG GLU 64 10.380 8.745 -2.448 545 HG3 GLU 64 3HG GLU 64 11.504 7.418 -2.721 546 H VAL 65 H VAL 65 9.868 5.855 -2.238 547 HA VAL 65 HA VAL 65 11.906 3.990 -2.866 548 HB VAL 65 HB VAL 65 10.164 4.262 -0.384 549 HG11 VAL 65 1HG1 VAL 65 11.936 3.110 0.829 550 HG12 VAL 65 2HG1 VAL 65 12.813 2.853 -0.680 551 HG13 VAL 65 3HG1 VAL 65 11.244 2.087 -0.433 552 HG21 VAL 65 3HG2 VAL 65 12.017 5.585 0.562 553 HG22 VAL 65 1HG2 VAL 65 11.352 6.345 -0.883 554 HG23 VAL 65 2HG2 VAL 65 12.885 5.476 -0.971 555 H VAL 66 H VAL 66 8.405 3.741 -2.744 556 HA VAL 66 HA VAL 66 7.989 1.071 -2.107 557 HB VAL 66 HB VAL 66 6.336 2.840 -3.967 558 HG11 VAL 66 1HG1 VAL 66 5.692 0.499 -4.353 559 HG12 VAL 66 2HG1 VAL 66 4.417 1.338 -3.474 560 HG13 VAL 66 3HG1 VAL 66 5.502 0.237 -2.620 561 HG21 VAL 66 3HG2 VAL 66 4.963 3.225 -1.969 562 HG22 VAL 66 1HG2 VAL 66 6.631 3.732 -1.708 563 HG23 VAL 66 2HG2 VAL 66 6.053 2.212 -1.017 564 H ARG 67 H ARG 67 8.949 2.441 -5.211 565 HA ARG 67 HA ARG 67 8.485 0.302 -6.949 566 HB2 ARG 67 2HB ARG 67 9.213 2.559 -7.633 567 HB3 ARG 67 3HB ARG 67 10.801 2.276 -6.931 568 HG2 ARG 67 2HG ARG 67 11.156 0.444 -8.612 569 HG3 ARG 67 3HG ARG 67 9.612 0.881 -9.358 570 HD2 ARG 67 2HD ARG 67 11.545 1.917 -10.527 571 HD3 ARG 67 3HD ARG 67 10.451 3.133 -9.852 572 HE ARG 67 HE ARG 67 12.384 2.668 -7.923 573 HH11 ARG 67 1HH1 ARG 67 12.407 3.933 -11.221 574 HH12 ARG 67 2HH1 ARG 67 13.798 4.932 -10.939 575 HH21 ARG 67 1HH2 ARG 67 14.190 3.975 -7.588 576 HH22 ARG 67 2HH2 ARG 67 14.806 4.955 -8.883 577 H ASP 68 H ASP 68 11.195 0.796 -4.707 578 HA ASP 68 HA ASP 68 12.804 -1.457 -5.418 579 HB2 ASP 68 2HB ASP 68 13.713 0.452 -4.143 580 HB3 ASP 68 3HB ASP 68 12.611 0.127 -2.812 581 H ILE 69 H ILE 69 10.300 -0.907 -3.031 582 HA ILE 69 HA ILE 69 10.288 -3.432 -1.726 583 HB ILE 69 HB ILE 69 8.132 -1.282 -1.958 584 HG12 ILE 69 2HG1 ILE 69 10.143 -1.733 0.304 585 HG13 ILE 69 3HG1 ILE 69 10.320 -0.513 -0.953 586 HG21 ILE 69 1HG2 ILE 69 8.285 -3.558 0.047 587 HG22 ILE 69 2HG2 ILE 69 7.114 -3.409 -1.263 588 HG23 ILE 69 3HG2 ILE 69 7.102 -2.247 0.064 589 HD11 ILE 69 3HD1 ILE 69 9.506 0.489 1.075 590 HD12 ILE 69 1HD1 ILE 69 8.144 -0.629 1.128 591 HD13 ILE 69 2HD1 ILE 69 8.254 0.567 -0.164 592 H VAL 70 H VAL 70 8.655 -2.152 -4.562 593 HA VAL 70 HA VAL 70 6.725 -4.239 -4.934 594 HB VAL 70 HB VAL 70 7.736 -1.998 -6.761 595 HG11 VAL 70 1HG1 VAL 70 5.900 -2.550 -8.322 596 HG12 VAL 70 2HG1 VAL 70 5.519 -3.988 -7.372 597 HG13 VAL 70 3HG1 VAL 70 7.070 -3.866 -8.207 598 HG21 VAL 70 3HG2 VAL 70 6.333 -1.280 -4.862 599 HG22 VAL 70 1HG2 VAL 70 5.060 -2.389 -5.367 600 HG23 VAL 70 2HG2 VAL 70 5.502 -1.023 -6.393 601 H GLU 71 H GLU 71 9.884 -3.391 -6.333 602 HA GLU 71 HA GLU 71 10.203 -5.445 -8.191 603 HB2 GLU 71 2HB GLU 71 11.717 -3.449 -7.941 604 HB3 GLU 71 3HB GLU 71 12.387 -4.167 -6.481 605 HG2 GLU 71 2HG GLU 71 12.975 -6.193 -8.036 606 HG3 GLU 71 3HG GLU 71 12.719 -5.048 -9.354 607 H TYR 72 H TYR 72 11.081 -5.286 -4.768 608 HA TYR 72 HA TYR 72 12.104 -7.886 -4.428 609 HB2 TYR 72 2HB TYR 72 12.544 -6.186 -2.757 610 HB3 TYR 72 3HB TYR 72 10.825 -5.960 -2.446 611 HD1 TYR 72 HD1 TYR 72 13.569 -8.523 -2.166 612 HD2 TYR 72 HD2 TYR 72 9.767 -7.220 -0.713 613 HE1 TYR 72 HE1 TYR 72 13.654 -10.227 -0.393 614 HE2 TYR 72 HE2 TYR 72 9.866 -8.915 1.053 615 HH TYR 72 HH TYR 72 10.957 -11.086 1.469 616 H ALA 73 H ALA 73 8.807 -6.599 -4.035 617 HA ALA 73 HA ALA 73 7.604 -8.977 -3.076 618 HB1 ALA 73 3HB ALA 73 5.466 -7.886 -3.602 619 HB2 ALA 73 1HB ALA 73 6.320 -6.650 -4.533 620 HB3 ALA 73 2HB ALA 73 6.570 -6.776 -2.790 621 H GLN 74 H GLN 74 8.310 -7.814 -6.323 622 HA GLN 74 HA GLN 74 6.842 -9.801 -7.766 623 HB2 GLN 74 2HB GLN 74 9.220 -8.069 -8.573 624 HB3 GLN 74 3HB GLN 74 8.405 -9.161 -9.686 625 HG2 GLN 74 2HG GLN 74 6.308 -7.871 -9.420 626 HG3 GLN 74 3HG GLN 74 7.134 -6.780 -8.303 627 HE21 GLN 74 1HE2 GLN 74 6.737 -4.981 -9.668 628 HE22 GLN 74 2HE2 GLN 74 7.607 -4.736 -11.133 629 H LYS 75 H LYS 75 10.148 -9.637 -6.431 630 HA LYS 75 HA LYS 75 11.152 -12.094 -7.462 631 HB2 LYS 75 2HB LYS 75 11.862 -10.983 -4.705 632 HB3 LYS 75 3HB LYS 75 12.851 -12.017 -5.724 633 HG2 LYS 75 2HG LYS 75 12.142 -9.136 -6.297 634 HG3 LYS 75 3HG LYS 75 13.669 -9.694 -5.625 635 HD2 LYS 75 2HD LYS 75 14.161 -10.905 -7.718 636 HD3 LYS 75 3HD LYS 75 12.602 -10.407 -8.387 637 HE2 LYS 75 2HE LYS 75 13.294 -8.050 -8.297 638 HE3 LYS 75 3HE LYS 75 14.834 -8.510 -7.566 639 HZ1 LYS 75 3HZ LYS 75 15.442 -9.655 -9.562 640 HZ2 LYS 75 1HZ LYS 75 14.982 -8.079 -9.960 641 HZ3 LYS 75 2HZ LYS 75 13.930 -9.369 -10.262 642 H GLU 76 H GLU 76 9.349 -11.245 -4.559 643 HA GLU 76 HA GLU 76 9.184 -13.786 -3.320 644 HB2 GLU 76 2HB GLU 76 7.358 -11.354 -3.085 645 HB3 GLU 76 3HB GLU 76 7.331 -12.728 -1.991 646 HG2 GLU 76 2HG GLU 76 9.728 -10.918 -2.380 647 HG3 GLU 76 3HG GLU 76 8.525 -10.706 -1.116 648 H GLY 77 H GLY 77 7.213 -12.169 -5.747 649 HA2 GLY 77 2HA GLY 77 5.693 -13.095 -7.253 650 HA3 GLY 77 3HA GLY 77 5.691 -14.592 -6.333 651 H LEU 78 H LEU 78 5.237 -11.571 -4.684 652 HA LEU 78 HA LEU 78 2.514 -12.264 -3.892 653 HB2 LEU 78 2HB LEU 78 4.358 -9.979 -3.076 654 HB3 LEU 78 3HB LEU 78 2.769 -10.265 -2.381 655 HG LEU 78 HG LEU 78 5.144 -12.163 -2.165 656 HD11 LEU 78 1HD1 LEU 78 5.207 -11.528 0.197 657 HD12 LEU 78 2HD1 LEU 78 3.930 -10.339 -0.079 658 HD13 LEU 78 3HD1 LEU 78 5.502 -10.148 -0.862 659 HD21 LEU 78 3HD2 LEU 78 3.024 -13.387 -2.165 660 HD22 LEU 78 1HD2 LEU 78 2.388 -12.334 -0.899 661 HD23 LEU 78 2HD2 LEU 78 3.743 -13.414 -0.559 662 H ARG 79 H ARG 79 0.682 -11.126 -4.468 663 HA ARG 79 HA ARG 79 0.692 -9.508 -6.833 664 HB2 ARG 79 2HB ARG 79 -1.180 -11.114 -5.741 665 HB3 ARG 79 3HB ARG 79 -1.712 -9.623 -4.986 666 HG2 ARG 79 2HG ARG 79 -1.477 -10.111 -7.974 667 HG3 ARG 79 3HG ARG 79 -2.970 -10.154 -7.044 668 HD2 ARG 79 2HD ARG 79 -2.698 -7.730 -6.537 669 HD3 ARG 79 3HD ARG 79 -1.215 -7.715 -7.503 670 HE ARG 79 HE ARG 79 -3.711 -8.595 -8.758 671 HH11 ARG 79 1HH1 ARG 79 -1.234 -6.085 -8.560 672 HH12 ARG 79 2HH1 ARG 79 -1.751 -5.330 -10.035 673 HH21 ARG 79 1HH2 ARG 79 -4.341 -7.607 -10.652 674 HH22 ARG 79 2HH2 ARG 79 -3.512 -6.189 -11.223 675 H VAL 80 H VAL 80 0.971 -7.309 -6.935 676 HA VAL 80 HA VAL 80 1.161 -5.798 -4.393 677 HB VAL 80 HB VAL 80 2.529 -5.039 -7.021 678 HG11 VAL 80 1HG1 VAL 80 3.944 -3.630 -5.567 679 HG12 VAL 80 2HG1 VAL 80 3.033 -4.159 -4.151 680 HG13 VAL 80 3HG1 VAL 80 2.237 -3.208 -5.408 681 HG21 VAL 80 3HG2 VAL 80 3.762 -6.634 -4.743 682 HG22 VAL 80 1HG2 VAL 80 4.627 -5.996 -6.143 683 HG23 VAL 80 2HG2 VAL 80 3.397 -7.244 -6.358 684 H LEU 81 H LEU 81 -0.152 -4.104 -4.137 685 HA LEU 81 HA LEU 81 -1.442 -2.765 -6.415 686 HB2 LEU 81 2HB LEU 81 -2.825 -4.638 -4.907 687 HB3 LEU 81 3HB LEU 81 -3.142 -3.187 -3.990 688 HG LEU 81 HG LEU 81 -4.028 -2.125 -6.113 689 HD11 LEU 81 1HD1 LEU 81 -3.810 -4.961 -7.169 690 HD12 LEU 81 2HD1 LEU 81 -2.911 -3.552 -7.742 691 HD13 LEU 81 3HD1 LEU 81 -4.658 -3.627 -7.962 692 HD21 LEU 81 3HD2 LEU 81 -5.461 -4.612 -5.129 693 HD22 LEU 81 1HD2 LEU 81 -6.200 -3.259 -5.992 694 HD23 LEU 81 2HD2 LEU 81 -5.530 -3.013 -4.381 695 H VAL 82 H VAL 82 -0.620 -0.693 -6.181 696 HA VAL 82 HA VAL 82 -0.153 0.350 -3.446 697 HB VAL 82 HB VAL 82 0.864 1.458 -6.105 698 HG11 VAL 82 1HG1 VAL 82 1.566 2.302 -3.259 699 HG12 VAL 82 2HG1 VAL 82 0.636 3.246 -4.425 700 HG13 VAL 82 3HG1 VAL 82 2.339 2.904 -4.727 701 HG21 VAL 82 3HG2 VAL 82 3.063 0.556 -5.449 702 HG22 VAL 82 1HG2 VAL 82 1.865 -0.733 -5.565 703 HG23 VAL 82 2HG2 VAL 82 2.360 -0.130 -3.983 704 H ILE 83 H ILE 83 -1.720 1.503 -2.644 705 HA ILE 83 HA ILE 83 -3.768 2.791 -4.336 706 HB ILE 83 HB ILE 83 -3.851 2.078 -1.356 707 HG12 ILE 83 2HG1 ILE 83 -5.147 0.502 -3.635 708 HG13 ILE 83 3HG1 ILE 83 -3.583 0.076 -2.952 709 HG21 ILE 83 1HG2 ILE 83 -5.451 3.857 -1.982 710 HG22 ILE 83 2HG2 ILE 83 -6.307 2.371 -1.580 711 HG23 ILE 83 3HG2 ILE 83 -6.106 2.837 -3.269 712 HD11 ILE 83 3HD1 ILE 83 -4.635 -0.262 -0.777 713 HD12 ILE 83 1HD1 ILE 83 -5.322 -1.288 -2.035 714 HD13 ILE 83 2HD1 ILE 83 -6.202 0.138 -1.488 715 H LYS 84 H LYS 84 -3.452 4.933 -4.584 716 HA LYS 84 HA LYS 84 -2.239 6.537 -2.419 717 HB2 LYS 84 2HB LYS 84 -0.985 7.773 -4.307 718 HB3 LYS 84 3HB LYS 84 -0.394 6.184 -3.848 719 HG2 LYS 84 2HG LYS 84 -1.584 5.202 -5.805 720 HG3 LYS 84 3HG LYS 84 -2.074 6.819 -6.292 721 HD2 LYS 84 2HD LYS 84 0.835 5.992 -5.992 722 HD3 LYS 84 3HD LYS 84 -0.051 5.823 -7.501 723 HE2 LYS 84 2HE LYS 84 1.182 7.840 -7.680 724 HE3 LYS 84 3HE LYS 84 -0.494 8.313 -7.394 725 HZ1 LYS 84 3HZ LYS 84 1.528 8.133 -5.234 726 HZ2 LYS 84 1HZ LYS 84 0.016 8.875 -5.168 727 HZ3 LYS 84 2HZ LYS 84 1.254 9.549 -6.100 728 H VAL 85 H VAL 85 -3.105 8.477 -2.089 729 HA VAL 85 HA VAL 85 -5.567 9.221 -3.444 730 HB VAL 85 HB VAL 85 -4.103 10.488 -1.067 731 HG11 VAL 85 1HG1 VAL 85 -6.212 11.685 -0.575 732 HG12 VAL 85 2HG1 VAL 85 -6.923 11.037 -2.054 733 HG13 VAL 85 3HG1 VAL 85 -5.556 12.145 -2.149 734 HG21 VAL 85 3HG2 VAL 85 -4.865 8.197 -0.573 735 HG22 VAL 85 1HG2 VAL 85 -6.502 8.611 -1.086 736 HG23 VAL 85 2HG2 VAL 85 -5.806 9.368 0.348 737 H ALA 86 H ALA 86 -5.347 10.239 -5.325 738 HA ALA 86 HA ALA 86 -2.931 11.741 -6.003 739 HB1 ALA 86 3HB ALA 86 -3.724 11.537 -8.315 740 HB2 ALA 86 1HB ALA 86 -5.227 10.802 -7.747 741 HB3 ALA 86 2HB ALA 86 -3.691 9.964 -7.516 742 H GLN 87 H GLN 87 -2.964 13.893 -5.648 743 HA GLN 87 HA GLN 87 -5.275 15.428 -6.686 744 HB2 GLN 87 2HB GLN 87 -3.701 15.929 -4.136 745 HB3 GLN 87 3HB GLN 87 -4.676 17.181 -4.893 746 HG2 GLN 87 2HG GLN 87 -5.698 14.539 -3.803 747 HG3 GLN 87 3HG GLN 87 -5.899 16.125 -3.054 748 HE21 GLN 87 1HE2 GLN 87 -7.920 14.187 -3.958 749 HE22 GLN 87 2HE2 GLN 87 -8.921 15.014 -5.099 750 H ASP 88 H ASP 88 -2.047 14.722 -7.028 751 HA ASP 88 HA ASP 88 -1.205 17.357 -8.023 752 HB2 ASP 88 2HB ASP 88 0.468 14.816 -8.082 753 HB3 ASP 88 3HB ASP 88 1.023 16.482 -8.079 754 H GLN 89 H GLN 89 -1.890 14.071 -9.068 755 HA GLN 89 HA GLN 89 -2.377 13.038 -10.979 756 HB2 GLN 89 2HB GLN 89 -2.944 15.831 -12.039 757 HB3 GLN 89 3HB GLN 89 -3.370 14.343 -12.877 758 HG2 GLN 89 2HG GLN 89 -4.854 13.699 -11.030 759 HG3 GLN 89 3HG GLN 89 -4.414 15.159 -10.146 760 HE21 GLN 89 1HE2 GLN 89 -7.058 14.292 -11.011 761 HE22 GLN 89 2HE2 GLN 89 -7.674 15.540 -12.034 762 H GLU 90 H GLU 90 -0.756 15.946 -12.354 763 HA GLU 90 HA GLU 90 0.533 14.448 -14.404 764 HB2 GLU 90 2HB GLU 90 1.087 17.291 -13.458 765 HB3 GLU 90 3HB GLU 90 1.608 16.598 -14.990 766 HG2 GLU 90 2HG GLU 90 -0.735 16.378 -15.709 767 HG3 GLU 90 3HG GLU 90 -1.280 17.022 -14.161 768 H LEU 91 H LEU 91 1.956 16.241 -11.627 769 HA LEU 91 HA LEU 91 4.627 15.314 -11.978 770 HB2 LEU 91 2HB LEU 91 3.876 17.365 -10.710 771 HB3 LEU 91 3HB LEU 91 3.303 16.332 -9.418 772 HG LEU 91 HG LEU 91 6.235 16.325 -10.243 773 HD11 LEU 91 1HD1 LEU 91 5.658 18.662 -9.791 774 HD12 LEU 91 2HD1 LEU 91 6.715 18.021 -8.538 775 HD13 LEU 91 3HD1 LEU 91 4.988 18.214 -8.220 776 HD21 LEU 91 3HD2 LEU 91 6.644 15.608 -7.916 777 HD22 LEU 91 1HD2 LEU 91 5.562 14.490 -8.749 778 HD23 LEU 91 2HD2 LEU 91 4.910 15.645 -7.587 779 H LEU 92 H LEU 92 1.903 14.249 -10.089 780 HA LEU 92 HA LEU 92 3.001 12.132 -8.615 781 HB2 LEU 92 2HB LEU 92 0.915 13.206 -8.114 782 HB3 LEU 92 3HB LEU 92 0.227 12.763 -9.656 783 HG LEU 92 HG LEU 92 0.999 10.430 -7.972 784 HD11 LEU 92 1HD1 LEU 92 0.286 11.931 -6.173 785 HD12 LEU 92 2HD1 LEU 92 -0.871 10.623 -6.397 786 HD13 LEU 92 3HD1 LEU 92 -1.241 12.239 -7.005 787 HD21 LEU 92 3HD2 LEU 92 -1.208 9.586 -8.691 788 HD22 LEU 92 1HD2 LEU 92 -0.275 10.171 -10.069 789 HD23 LEU 92 2HD2 LEU 92 -1.587 11.152 -9.412 790 H GLU 93 H GLU 93 1.861 12.320 -11.928 791 HA GLU 93 HA GLU 93 1.572 9.571 -12.509 792 HB2 GLU 93 2HB GLU 93 0.493 11.375 -13.794 793 HB3 GLU 93 3HB GLU 93 2.057 11.905 -14.400 794 HG2 GLU 93 2HG GLU 93 2.318 9.896 -15.694 795 HG3 GLU 93 3HG GLU 93 0.922 9.143 -14.928 796 H ARG 94 H ARG 94 4.380 11.602 -12.300 797 HA ARG 94 HA ARG 94 6.244 10.318 -13.908 798 HB2 ARG 94 2HB ARG 94 6.688 12.415 -12.699 799 HB3 ARG 94 3HB ARG 94 6.654 11.562 -11.161 800 HG2 ARG 94 2HG ARG 94 8.671 10.266 -11.890 801 HG3 ARG 94 3HG ARG 94 8.716 11.232 -13.366 802 HD2 ARG 94 2HD ARG 94 9.057 13.273 -12.033 803 HD3 ARG 94 3HD ARG 94 8.973 12.329 -10.541 804 HE ARG 94 HE ARG 94 11.037 11.743 -12.559 805 HH11 ARG 94 1HH1 ARG 94 10.293 12.852 -9.297 806 HH12 ARG 94 2HH1 ARG 94 11.943 12.756 -8.767 807 HH21 ARG 94 1HH2 ARG 94 13.178 11.616 -11.853 808 HH22 ARG 94 2HH2 ARG 94 13.587 12.052 -10.225 809 H PHE 95 H PHE 95 5.526 9.595 -10.458 810 HA PHE 95 HA PHE 95 7.038 7.125 -10.481 811 HB2 PHE 95 2HB PHE 95 6.829 8.501 -8.408 812 HB3 PHE 95 3HB PHE 95 5.098 8.167 -8.366 813 HD1 PHE 95 HD2 PHE 95 8.408 6.391 -8.451 814 HD2 PHE 95 HD1 PHE 95 4.344 6.280 -7.109 815 HE1 PHE 95 HE2 PHE 95 8.864 4.319 -7.222 816 HE2 PHE 95 HE1 PHE 95 4.815 4.193 -5.889 817 HZ PHE 95 HZ PHE 95 7.077 3.213 -5.942 818 H TYR 96 H TYR 96 3.636 8.050 -10.565 819 HA TYR 96 HA TYR 96 2.309 5.657 -10.179 820 HB2 TYR 96 2HB TYR 96 1.153 7.753 -10.202 821 HB3 TYR 96 3HB TYR 96 1.684 8.117 -11.829 822 HD1 TYR 96 HD2 TYR 96 0.570 7.002 -13.794 823 HD2 TYR 96 HD1 TYR 96 -0.854 6.461 -9.802 824 HE1 TYR 96 HE2 TYR 96 -1.582 6.222 -14.670 825 HE2 TYR 96 HE1 TYR 96 -3.010 5.713 -10.681 826 HH TYR 96 HH TYR 96 -4.353 5.968 -12.798 827 H GLU 97 H GLU 97 3.829 6.851 -13.132 828 HA GLU 97 HA GLU 97 2.583 5.030 -14.976 829 HB2 GLU 97 2HB GLU 97 3.370 7.216 -15.760 830 HB3 GLU 97 3HB GLU 97 5.016 6.852 -15.250 831 HG2 GLU 97 2HG GLU 97 4.842 4.857 -16.950 832 HG3 GLU 97 3HG GLU 97 3.468 5.743 -17.595 833 H GLN 98 H GLN 98 5.510 5.108 -13.071 834 HA GLN 98 HA GLN 98 7.093 3.235 -14.419 835 HB2 GLN 98 2HB GLN 98 6.990 3.888 -11.448 836 HB3 GLN 98 3HB GLN 98 8.298 3.002 -12.231 837 HG2 GLN 98 2HG GLN 98 7.597 5.927 -12.425 838 HG3 GLN 98 3HG GLN 98 9.138 5.186 -12.004 839 HE21 GLN 98 1HE2 GLN 98 7.079 6.240 -14.575 840 HE22 GLN 98 2HE2 GLN 98 8.186 5.975 -15.873 841 H LEU 99 H LEU 99 4.709 2.831 -11.840 842 HA LEU 99 HA LEU 99 4.966 0.027 -11.443 843 HB2 LEU 99 2HB LEU 99 2.655 1.934 -10.904 844 HB3 LEU 99 3HB LEU 99 2.610 0.234 -10.461 845 HG LEU 99 HG LEU 99 4.539 0.591 -8.920 846 HD11 LEU 99 1HD1 LEU 99 5.621 2.497 -10.005 847 HD12 LEU 99 2HD1 LEU 99 5.265 2.852 -8.318 848 HD13 LEU 99 3HD1 LEU 99 4.250 3.531 -9.597 849 HD21 LEU 99 3HD2 LEU 99 2.259 0.690 -8.071 850 HD22 LEU 99 1HD2 LEU 99 2.171 2.416 -8.434 851 HD23 LEU 99 2HD2 LEU 99 3.289 1.823 -7.201 852 H LYS 100 H LYS 100 2.818 2.028 -13.421 853 HA LYS 100 HA LYS 100 1.204 0.010 -14.518 854 HB2 LYS 100 2HB LYS 100 1.972 2.746 -15.607 855 HB3 LYS 100 3HB LYS 100 0.726 1.737 -16.323 856 HG2 LYS 100 2HG LYS 100 0.555 2.610 -13.429 857 HG3 LYS 100 3HG LYS 100 0.027 3.664 -14.737 858 HD2 LYS 100 2HD LYS 100 -1.942 2.565 -13.976 859 HD3 LYS 100 3HD LYS 100 -1.521 1.776 -15.492 860 HE2 LYS 100 2HE LYS 100 -0.474 -0.075 -14.149 861 HE3 LYS 100 3HE LYS 100 -1.080 0.701 -12.686 862 HZ1 LYS 100 3HZ LYS 100 -3.325 0.439 -13.530 863 HZ2 LYS 100 1HZ LYS 100 -2.547 -1.062 -13.449 864 HZ3 LYS 100 2HZ LYS 100 -2.743 -0.283 -14.940 865 H LYS 101 H LYS 101 4.389 1.165 -15.363 866 HA LYS 101 HA LYS 101 4.529 -0.030 -17.985 867 HB2 LYS 101 2HB LYS 101 5.747 2.055 -17.447 868 HB3 LYS 101 3HB LYS 101 6.694 1.209 -16.230 869 HG2 LYS 101 2HG LYS 101 7.739 -0.174 -17.952 870 HG3 LYS 101 3HG LYS 101 6.746 0.574 -19.202 871 HD2 LYS 101 2HD LYS 101 8.764 2.062 -17.480 872 HD3 LYS 101 3HD LYS 101 9.092 1.453 -19.102 873 HE2 LYS 101 2HE LYS 101 7.199 2.899 -19.936 874 HE3 LYS 101 3HE LYS 101 7.098 3.602 -18.319 875 HZ1 LYS 101 3HZ LYS 101 9.487 3.654 -20.081 876 HZ2 LYS 101 1HZ LYS 101 9.379 4.358 -18.549 877 HZ3 LYS 101 2HZ LYS 101 8.433 4.947 -19.820 878 H ASP 102 H ASP 102 5.788 -0.803 -14.720 879 HA ASP 102 HA ASP 102 7.085 -3.246 -15.254 880 HB2 ASP 102 2HB ASP 102 5.549 -2.247 -12.815 881 HB3 ASP 102 3HB ASP 102 6.263 -3.852 -12.839 882 H GLY 103 H GLY 103 3.702 -2.476 -14.699 883 HA2 GLY 103 2HA GLY 103 1.921 -3.816 -15.730 884 HA3 GLY 103 3HA GLY 103 2.833 -5.258 -15.293 885 H VAL 104 H VAL 104 3.238 -3.061 -12.886 886 HA VAL 104 HA VAL 104 1.522 -4.430 -11.013 887 HB VAL 104 HB VAL 104 3.415 -2.054 -10.675 888 HG11 VAL 104 1HG1 VAL 104 2.093 -3.743 -8.514 889 HG12 VAL 104 2HG1 VAL 104 1.729 -2.056 -8.878 890 HG13 VAL 104 3HG1 VAL 104 3.314 -2.496 -8.241 891 HG21 VAL 104 3HG2 VAL 104 4.520 -4.145 -11.414 892 HG22 VAL 104 1HG2 VAL 104 3.848 -4.992 -10.020 893 HG23 VAL 104 2HG2 VAL 104 5.011 -3.686 -9.788 894 H ASP 105 H ASP 105 -0.328 -3.620 -10.086 895 HA ASP 105 HA ASP 105 -1.613 -1.441 -11.567 896 HB2 ASP 105 2HB ASP 105 -2.673 -3.751 -9.931 897 HB3 ASP 105 3HB ASP 105 -3.724 -2.406 -10.386 898 H VAL 106 H VAL 106 -1.391 0.422 -10.779 899 HA VAL 106 HA VAL 106 -1.468 1.036 -7.924 900 HB VAL 106 HB VAL 106 0.244 2.234 -9.087 901 HG11 VAL 106 1HG1 VAL 106 -1.774 3.128 -11.161 902 HG12 VAL 106 2HG1 VAL 106 -0.499 1.933 -11.398 903 HG13 VAL 106 3HG1 VAL 106 -0.078 3.618 -11.090 904 HG21 VAL 106 3HG2 VAL 106 -2.071 4.144 -8.757 905 HG22 VAL 106 1HG2 VAL 106 -0.361 4.579 -8.800 906 HG23 VAL 106 2HG2 VAL 106 -0.989 3.594 -7.476 907 H ARG 107 H ARG 107 -3.235 1.828 -6.945 908 HA ARG 107 HA ARG 107 -5.679 2.367 -8.515 909 HB2 ARG 107 2HB ARG 107 -5.408 1.597 -5.574 910 HB3 ARG 107 3HB ARG 107 -6.913 1.776 -6.463 911 HG2 ARG 107 2HG ARG 107 -4.815 -0.310 -7.136 912 HG3 ARG 107 3HG ARG 107 -6.158 -0.603 -6.037 913 HD2 ARG 107 2HD ARG 107 -6.621 -1.495 -8.280 914 HD3 ARG 107 3HD ARG 107 -7.762 -0.217 -7.855 915 HE ARG 107 HE ARG 107 -5.402 0.313 -9.563 916 HH11 ARG 107 1HH1 ARG 107 -8.907 0.389 -9.160 917 HH12 ARG 107 2HH1 ARG 107 -9.156 1.320 -10.602 918 HH21 ARG 107 1HH2 ARG 107 -5.763 1.626 -11.369 919 HH22 ARG 107 2HH2 ARG 107 -7.388 2.020 -11.845 920 H VAL 108 H VAL 108 -5.815 4.533 -8.849 921 HA VAL 108 HA VAL 108 -5.336 6.381 -6.593 922 HB VAL 108 HB VAL 108 -5.539 8.225 -8.365 923 HG11 VAL 108 1HG1 VAL 108 -3.383 7.566 -7.403 924 HG12 VAL 108 2HG1 VAL 108 -3.198 7.984 -9.106 925 HG13 VAL 108 3HG1 VAL 108 -3.205 6.288 -8.610 926 HG21 VAL 108 3HG2 VAL 108 -6.631 6.940 -10.161 927 HG22 VAL 108 1HG2 VAL 108 -5.220 5.888 -10.302 928 HG23 VAL 108 2HG2 VAL 108 -5.098 7.596 -10.733 929 H THR 109 H THR 109 -7.031 6.838 -5.453 930 HA THR 109 HA THR 109 -9.764 6.633 -6.486 931 HB THR 109 HB THR 109 -10.341 7.049 -4.062 932 HG1 THR 109 HG1 THR 109 -8.702 8.074 -3.118 933 HG21 THR 109 3HG2 THR 109 -10.112 4.727 -4.889 934 HG22 THR 109 1HG2 THR 109 -9.532 4.862 -3.230 935 HG23 THR 109 2HG2 THR 109 -8.377 4.776 -4.560 936 H ASP 110 H ASP 110 -7.355 8.971 -6.107 937 HA ASP 110 HA ASP 110 -7.130 11.163 -6.348 938 HB2 ASP 110 2HB ASP 110 -8.732 10.982 -8.241 939 HB3 ASP 110 3HB ASP 110 -10.068 11.247 -7.131 940 H ASN 111 H ASN 111 -10.434 10.953 -5.011 941 HA ASN 111 HA ASN 111 -9.925 12.938 -2.973 942 HB2 ASN 111 2HB ASN 111 -12.348 11.128 -3.304 943 HB3 ASN 111 3HB ASN 111 -12.264 12.590 -2.344 944 HD21 ASN 111 1HD2 ASN 111 -10.833 14.121 -4.415 945 HD22 ASN 111 2HD2 ASN 111 -11.995 14.444 -5.642 946 H GLU 112 H GLU 112 -10.700 12.420 -0.693 947 HA GLU 112 HA GLU 112 -8.872 10.475 0.431 948 HB2 GLU 112 2HB GLU 112 -10.819 12.346 1.851 949 HB3 GLU 112 3HB GLU 112 -9.439 11.527 2.579 950 HG2 GLU 112 2HG GLU 112 -7.879 12.892 1.339 951 HG3 GLU 112 3HG GLU 112 -9.175 13.579 0.365 952 H ASP 113 H ASP 113 -12.379 11.091 0.666 953 HA ASP 113 HA ASP 113 -13.110 8.981 2.360 954 HB2 ASP 113 2HB ASP 113 -14.613 10.877 2.035 955 HB3 ASP 113 3HB ASP 113 -14.770 10.528 0.317 956 H GLU 114 H GLU 114 -12.602 9.038 -1.101 957 HA GLU 114 HA GLU 114 -14.039 6.652 -1.718 958 HB2 GLU 114 2HB GLU 114 -11.753 7.719 -3.396 959 HB3 GLU 114 3HB GLU 114 -13.174 6.810 -3.912 960 HG2 GLU 114 2HG GLU 114 -13.174 9.667 -2.904 961 HG3 GLU 114 3HG GLU 114 -13.265 9.174 -4.589 962 H ALA 115 H ALA 115 -10.649 7.355 -0.953 963 HA ALA 115 HA ALA 115 -9.648 4.685 -1.304 964 HB1 ALA 115 3HB ALA 115 -7.625 5.523 -0.163 965 HB2 ALA 115 1HB ALA 115 -8.486 7.002 0.283 966 HB3 ALA 115 2HB ALA 115 -8.164 6.645 -1.412 967 H LYS 116 H LYS 116 -10.971 6.551 1.336 968 HA LYS 116 HA LYS 116 -10.449 4.868 3.523 969 HB2 LYS 116 2HB LYS 116 -11.010 7.080 4.019 970 HB3 LYS 116 3HB LYS 116 -12.356 7.124 2.908 971 HG2 LYS 116 2HG LYS 116 -12.700 5.332 5.266 972 HG3 LYS 116 3HG LYS 116 -12.601 7.057 5.622 973 HD2 LYS 116 2HD LYS 116 -14.421 7.441 3.922 974 HD3 LYS 116 3HD LYS 116 -14.576 5.689 3.762 975 HE2 LYS 116 2HE LYS 116 -15.250 5.496 6.094 976 HE3 LYS 116 3HE LYS 116 -14.951 7.220 6.356 977 HZ1 LYS 116 3HZ LYS 116 -17.010 6.049 4.566 978 HZ2 LYS 116 1HZ LYS 116 -16.686 7.705 4.719 979 HZ3 LYS 116 2HZ LYS 116 -17.280 6.833 6.039 980 H LYS 117 H LYS 117 -13.502 5.119 1.593 981 HA LYS 117 HA LYS 117 -14.770 2.877 2.777 982 HB2 LYS 117 2HB LYS 117 -16.256 2.868 0.715 983 HB3 LYS 117 3HB LYS 117 -16.214 4.374 1.617 984 HG2 LYS 117 2HG LYS 117 -15.099 5.527 -0.066 985 HG3 LYS 117 3HG LYS 117 -14.384 4.068 -0.754 986 HD2 LYS 117 2HD LYS 117 -16.241 3.582 -2.028 987 HD3 LYS 117 3HD LYS 117 -17.378 4.300 -0.885 988 HE2 LYS 117 2HE LYS 117 -15.550 5.854 -2.745 989 HE3 LYS 117 3HE LYS 117 -17.251 5.507 -3.048 990 HZ1 LYS 117 3HZ LYS 117 -16.215 7.078 -0.753 991 HZ2 LYS 117 1HZ LYS 117 -17.841 6.778 -1.095 992 HZ3 LYS 117 2HZ LYS 117 -16.910 7.724 -2.144 993 H ARG 118 H ARG 118 -12.458 3.136 0.176 994 HA ARG 118 HA ARG 118 -12.948 0.715 -1.162 995 HB2 ARG 118 2HB ARG 118 -11.483 2.797 -1.863 996 HB3 ARG 118 3HB ARG 118 -10.182 1.966 -1.032 997 HG2 ARG 118 2HG ARG 118 -9.946 1.389 -3.310 998 HG3 ARG 118 3HG ARG 118 -10.667 -0.032 -2.556 999 HD2 ARG 118 2HD ARG 118 -12.220 2.089 -4.087 1000 HD3 ARG 118 3HD ARG 118 -11.674 0.559 -4.770 1001 HE ARG 118 HE ARG 118 -13.142 -0.560 -3.087 1002 HH11 ARG 118 1HH1 ARG 118 -13.934 2.736 -4.076 1003 HH12 ARG 118 2HH1 ARG 118 -15.612 2.570 -3.682 1004 HH21 ARG 118 1HH2 ARG 118 -15.330 -0.713 -2.520 1005 HH22 ARG 118 2HH2 ARG 118 -16.399 0.623 -2.796 1006 H LEU 119 H LEU 119 -10.623 1.582 1.391 1007 HA LEU 119 HA LEU 119 -9.155 -0.795 1.466 1008 HB2 LEU 119 2HB LEU 119 -9.628 1.308 3.600 1009 HB3 LEU 119 3HB LEU 119 -8.525 -0.041 3.835 1010 HG LEU 119 HG LEU 119 -8.240 2.123 1.712 1011 HD11 LEU 119 1HD1 LEU 119 -6.596 1.602 4.205 1012 HD12 LEU 119 2HD1 LEU 119 -7.744 2.921 3.979 1013 HD13 LEU 119 3HD1 LEU 119 -6.287 2.850 2.995 1014 HD21 LEU 119 3HD2 LEU 119 -7.379 -0.002 0.859 1015 HD22 LEU 119 1HD2 LEU 119 -6.423 -0.236 2.325 1016 HD23 LEU 119 2HD2 LEU 119 -6.043 1.086 1.218 1017 H LYS 120 H LYS 120 -12.126 0.057 3.194 1018 HA LYS 120 HA LYS 120 -12.132 -2.096 5.035 1019 HB2 LYS 120 2HB LYS 120 -13.610 -0.001 5.097 1020 HB3 LYS 120 3HB LYS 120 -14.626 -0.774 3.889 1021 HG2 LYS 120 2HG LYS 120 -15.067 -2.640 5.447 1022 HG3 LYS 120 3HG LYS 120 -14.000 -1.893 6.644 1023 HD2 LYS 120 2HD LYS 120 -16.329 -1.433 7.219 1024 HD3 LYS 120 3HD LYS 120 -15.531 0.072 6.753 1025 HE2 LYS 120 2HE LYS 120 -17.794 -0.074 5.808 1026 HE3 LYS 120 3HE LYS 120 -16.583 -0.055 4.527 1027 HZ1 LYS 120 3HZ LYS 120 -18.361 -1.698 4.170 1028 HZ2 LYS 120 1HZ LYS 120 -17.897 -2.504 5.577 1029 HZ3 LYS 120 2HZ LYS 120 -16.839 -2.424 4.264 1030 H GLU 121 H GLU 121 -13.650 -1.666 1.869 1031 HA GLU 121 HA GLU 121 -14.952 -4.146 1.601 1032 HB2 GLU 121 2HB GLU 121 -15.488 -2.191 0.211 1033 HB3 GLU 121 3HB GLU 121 -13.882 -2.231 -0.511 1034 HG2 GLU 121 2HG GLU 121 -14.483 -4.538 -1.426 1035 HG3 GLU 121 3HG GLU 121 -16.132 -4.224 -0.884 1036 H LEU 122 H LEU 122 -11.655 -3.128 0.827 1037 HA LEU 122 HA LEU 122 -10.814 -5.302 -0.746 1038 HB2 LEU 122 2HB LEU 122 -9.106 -3.675 1.182 1039 HB3 LEU 122 3HB LEU 122 -8.512 -4.664 -0.144 1040 HG LEU 122 HG LEU 122 -10.055 -2.067 -0.339 1041 HD11 LEU 122 1HD1 LEU 122 -7.686 -1.800 0.123 1042 HD12 LEU 122 2HD1 LEU 122 -8.079 -1.237 -1.498 1043 HD13 LEU 122 3HD1 LEU 122 -7.280 -2.797 -1.276 1044 HD21 LEU 122 3HD2 LEU 122 -9.293 -3.906 -2.615 1045 HD22 LEU 122 1HD2 LEU 122 -9.928 -2.267 -2.782 1046 HD23 LEU 122 2HD2 LEU 122 -10.930 -3.527 -2.069 1047 H LEU 123 H LEU 123 -10.513 -4.727 2.741 1048 HA LEU 123 HA LEU 123 -9.281 -7.162 3.472 1049 HB2 LEU 123 2HB LEU 123 -10.799 -5.028 4.962 1050 HB3 LEU 123 3HB LEU 123 -10.413 -6.525 5.796 1051 HG LEU 123 HG LEU 123 -8.007 -6.125 5.482 1052 HD11 LEU 123 1HD1 LEU 123 -7.102 -4.050 4.605 1053 HD12 LEU 123 2HD1 LEU 123 -8.717 -3.478 4.192 1054 HD13 LEU 123 3HD1 LEU 123 -8.035 -4.868 3.351 1055 HD21 LEU 123 3HD2 LEU 123 -9.515 -3.785 6.678 1056 HD22 LEU 123 1HD2 LEU 123 -7.832 -4.217 7.015 1057 HD23 LEU 123 2HD2 LEU 123 -9.122 -5.315 7.474 1058 H GLU 124 H GLU 124 -12.651 -6.307 3.023 1059 HA GLU 124 HA GLU 124 -13.861 -8.563 4.240 1060 HB2 GLU 124 2HB GLU 124 -14.883 -6.783 1.988 1061 HB3 GLU 124 3HB GLU 124 -15.868 -7.966 2.847 1062 HG2 GLU 124 2HG GLU 124 -15.466 -6.730 4.972 1063 HG3 GLU 124 3HG GLU 124 -14.529 -5.541 4.077 1064 H LYS 125 H LYS 125 -12.297 -8.134 1.135 1065 HA LYS 125 HA LYS 125 -12.769 -10.990 0.507 1066 HB2 LYS 125 2HB LYS 125 -11.800 -8.727 -1.300 1067 HB3 LYS 125 3HB LYS 125 -11.884 -10.420 -1.785 1068 HG2 LYS 125 2HG LYS 125 -14.357 -10.366 -1.291 1069 HG3 LYS 125 3HG LYS 125 -14.211 -8.629 -1.029 1070 HD2 LYS 125 2HD LYS 125 -13.491 -10.042 -3.617 1071 HD3 LYS 125 3HD LYS 125 -15.046 -9.273 -3.310 1072 HE2 LYS 125 2HE LYS 125 -13.894 -7.093 -3.038 1073 HE3 LYS 125 3HE LYS 125 -12.351 -7.877 -3.397 1074 HZ1 LYS 125 3HZ LYS 125 -13.183 -8.474 -5.577 1075 HZ2 LYS 125 1HZ LYS 125 -13.338 -6.806 -5.355 1076 HZ3 LYS 125 2HZ LYS 125 -14.692 -7.801 -5.225 1077 H VAL 126 H VAL 126 -9.998 -8.987 -0.476 1078 HA VAL 126 HA VAL 126 -8.119 -10.389 1.300 1079 HB VAL 126 HB VAL 126 -7.701 -10.284 -1.749 1080 HG11 VAL 126 1HG1 VAL 126 -5.613 -11.559 -1.323 1081 HG12 VAL 126 2HG1 VAL 126 -5.894 -11.439 0.414 1082 HG13 VAL 126 3HG1 VAL 126 -5.590 -9.981 -0.529 1083 HG21 VAL 126 3HG2 VAL 126 -8.178 -12.728 0.006 1084 HG22 VAL 126 1HG2 VAL 126 -7.805 -12.756 -1.721 1085 HG23 VAL 126 2HG2 VAL 126 -9.317 -12.050 -1.155 1086 H GLY 127 H GLY 127 -7.940 -8.316 -1.594 1087 HA2 GLY 127 2HA GLY 127 -7.294 -5.876 -0.372 1088 HA3 GLY 127 3HA GLY 127 -5.789 -6.731 -0.707 1089 H SER 128 H SER 128 -6.596 -8.063 -3.050 1090 HA SER 128 HA SER 128 -6.336 -6.012 -5.045 1091 HB2 SER 128 2HB SER 128 -6.722 -9.022 -5.345 1092 HB3 SER 128 3HB SER 128 -6.209 -7.915 -6.621 1093 HG SER 128 HG SER 128 -4.580 -7.531 -4.570 1094 H LEU 129 H LEU 129 -8.221 -4.758 -5.135 1095 HA LEU 129 HA LEU 129 -10.828 -5.964 -5.567 1096 HB2 LEU 129 2HB LEU 129 -10.662 -3.746 -4.451 1097 HB3 LEU 129 3HB LEU 129 -9.971 -3.060 -5.909 1098 HG LEU 129 HG LEU 129 -12.127 -3.646 -7.115 1099 HD11 LEU 129 1HD1 LEU 129 -13.152 -4.259 -4.333 1100 HD12 LEU 129 2HD1 LEU 129 -12.953 -5.405 -5.661 1101 HD13 LEU 129 3HD1 LEU 129 -14.142 -4.112 -5.788 1102 HD21 LEU 129 3HD2 LEU 129 -11.707 -1.358 -6.365 1103 HD22 LEU 129 1HD2 LEU 129 -12.405 -1.725 -4.786 1104 HD23 LEU 129 2HD2 LEU 129 -13.418 -1.755 -6.232 1105 H GLU 130 H GLU 130 -10.499 -7.257 -7.384 1106 HA GLU 130 HA GLU 130 -10.783 -7.804 -9.543 1107 HB2 GLU 130 2HB GLU 130 -11.554 -4.891 -10.007 1108 HB3 GLU 130 3HB GLU 130 -12.033 -6.279 -10.972 1109 HG2 GLU 130 2HG GLU 130 -12.929 -5.633 -8.151 1110 HG3 GLU 130 3HG GLU 130 -13.902 -5.538 -9.612 1111 H HIS 131 H HIS 131 -10.321 -6.757 -11.921 1112 HA HIS 131 HA HIS 131 -8.277 -4.868 -12.267 1113 HB2 HIS 131 2HB HIS 131 -6.767 -6.710 -11.522 1114 HB3 HIS 131 3HB HIS 131 -7.380 -7.740 -12.811 1115 HD1 HIS 131 HD1 HIS 131 -5.217 -7.945 -14.151 1116 HD2 HIS 131 HD2 HIS 131 -6.224 -4.001 -13.343 1117 HE1 HIS 131 HE1 HIS 131 -3.650 -6.555 -15.523 1118 HE2 HIS 131 HE2 HIS 131 -4.104 -4.200 -14.793 1119 H HIS 132 H HIS 132 -10.289 -7.454 -13.424 1120 HA HIS 132 HA HIS 132 -10.015 -7.087 -16.207 1121 HB2 HIS 132 2HB HIS 132 -11.023 -9.120 -15.024 1122 HB3 HIS 132 3HB HIS 132 -12.484 -8.169 -14.773 1123 HD1 HIS 132 HD1 HIS 132 -10.800 -10.306 -17.226 1124 HD2 HIS 132 HD2 HIS 132 -13.791 -7.423 -17.300 1125 HE1 HIS 132 HE1 HIS 132 -11.959 -10.590 -19.435 1126 HE2 HIS 132 HE2 HIS 132 -13.670 -8.758 -19.507 1127 H HIS 133 H HIS 133 -10.091 -4.873 -16.584 1128 HA HIS 133 HA HIS 133 -12.707 -3.513 -16.311 1129 HB2 HIS 133 2HB HIS 133 -10.711 -2.325 -15.364 1130 HB3 HIS 133 3HB HIS 133 -9.948 -2.353 -16.951 1131 HD1 HIS 133 HD1 HIS 133 -10.478 -0.431 -18.467 1132 HD2 HIS 133 HD2 HIS 133 -13.154 -0.707 -15.304 1133 HE1 HIS 133 HE1 HIS 133 -11.958 1.577 -18.664 1134 HE2 HIS 133 HE2 HIS 133 -13.490 1.452 -16.682 1135 H HIS 134 H HIS 134 -13.879 -3.263 -18.150 1136 HA HIS 134 HA HIS 134 -13.000 -4.546 -20.561 1137 HB2 HIS 134 2HB HIS 134 -15.544 -2.929 -20.084 1138 HB3 HIS 134 3HB HIS 134 -15.232 -3.979 -21.466 1139 HD1 HIS 134 HD1 HIS 134 -17.228 -4.072 -18.636 1140 HD2 HIS 134 HD2 HIS 134 -14.438 -6.756 -20.155 1141 HE1 HIS 134 HE1 HIS 134 -17.816 -6.294 -17.639 1142 HE2 HIS 134 HE2 HIS 134 -16.150 -7.913 -18.595 1143 H HIS 135 H HIS 135 -14.606 -1.387 -20.686 1144 HA HIS 135 HA HIS 135 -12.657 0.436 -21.217 1145 HB2 HIS 135 2HB HIS 135 -12.388 0.584 -23.641 1146 HB3 HIS 135 3HB HIS 135 -11.884 -1.019 -23.126 1147 HD1 HIS 135 HD1 HIS 135 -13.430 0.420 -25.843 1148 HD2 HIS 135 HD2 HIS 135 -14.454 -2.829 -23.467 1149 HE1 HIS 135 HE1 HIS 135 -14.951 -0.988 -27.255 1150 HE2 HIS 135 HE2 HIS 135 -15.727 -2.817 -25.715 1151 H HIS 136 H HIS 136 -13.655 2.113 -23.083 1152 HA HIS 136 HA HIS 136 -16.598 2.143 -22.860 1153 HB2 HIS 136 2HB HIS 136 -16.448 4.695 -22.741 1154 HB3 HIS 136 3HB HIS 136 -15.962 3.827 -21.292 1155 HD1 HIS 136 HD1 HIS 136 -14.434 5.725 -24.201 1156 HD2 HIS 136 HD2 HIS 136 -13.433 4.390 -20.398 1157 HE1 HIS 136 HE1 HIS 136 -12.198 6.740 -23.700 1158 HE2 HIS 136 HE2 HIS 136 -11.561 5.826 -21.449 Start of MODEL 20 1 H1 MET 1 1H MET 1 -3.149 -14.930 -2.374 2 H2 MET 1 2H MET 1 -3.872 -13.412 -2.234 3 H3 MET 1 3H MET 1 -4.783 -14.810 -1.979 4 HA MET 1 HA MET 1 -4.249 -13.741 0.086 5 HB2 MET 1 2HB MET 1 -4.533 -16.188 0.041 6 HB3 MET 1 3HB MET 1 -2.844 -16.408 -0.394 7 HG2 MET 1 2HG MET 1 -2.148 -15.550 1.792 8 HG3 MET 1 3HG MET 1 -3.827 -15.243 2.223 9 HE1 MET 1 3HE MET 1 -5.273 -18.813 2.741 10 HE2 MET 1 1HE MET 1 -5.448 -17.772 1.331 11 HE3 MET 1 2HE MET 1 -5.544 -17.082 2.952 12 H GLY 2 H GLY 2 -2.768 -12.715 1.423 13 HA2 GLY 2 2HA GLY 2 -0.786 -11.784 2.154 14 HA3 GLY 2 3HA GLY 2 0.089 -12.791 1.006 15 H THR 3 H THR 3 -2.556 -10.604 0.170 16 HA THR 3 HA THR 3 -1.126 -9.336 -1.917 17 HB THR 3 HB THR 3 -3.672 -8.281 -0.592 18 HG1 THR 3 HG1 THR 3 -3.243 -10.485 -2.264 19 HG21 THR 3 3HG2 THR 3 -2.656 -8.062 -3.461 20 HG22 THR 3 1HG2 THR 3 -2.653 -6.752 -2.272 21 HG23 THR 3 2HG2 THR 3 -4.181 -7.412 -2.858 22 H VAL 4 H VAL 4 0.245 -7.631 -1.807 23 HA VAL 4 HA VAL 4 0.650 -6.238 0.760 24 HB VAL 4 HB VAL 4 2.300 -6.065 -1.828 25 HG11 VAL 4 1HG1 VAL 4 4.072 -5.091 -0.392 26 HG12 VAL 4 2HG1 VAL 4 2.990 -5.161 1.000 27 HG13 VAL 4 3HG1 VAL 4 2.609 -4.102 -0.358 28 HG21 VAL 4 3HG2 VAL 4 2.833 -7.766 0.641 29 HG22 VAL 4 1HG2 VAL 4 3.916 -7.592 -0.745 30 HG23 VAL 4 2HG2 VAL 4 2.343 -8.368 -0.945 31 H VAL 5 H VAL 5 -0.609 -4.483 1.001 32 HA VAL 5 HA VAL 5 -1.372 -2.859 -1.354 33 HB VAL 5 HB VAL 5 -3.438 -2.195 -0.071 34 HG11 VAL 5 1HG1 VAL 5 -3.177 -5.192 -0.560 35 HG12 VAL 5 2HG1 VAL 5 -3.541 -3.971 -1.780 36 HG13 VAL 5 3HG1 VAL 5 -4.694 -4.284 -0.484 37 HG21 VAL 5 3HG2 VAL 5 -2.706 -2.693 2.236 38 HG22 VAL 5 1HG2 VAL 5 -2.665 -4.419 1.865 39 HG23 VAL 5 2HG2 VAL 5 -4.202 -3.548 1.858 40 H ILE 6 H ILE 6 -0.330 -0.987 -1.395 41 HA ILE 6 HA ILE 6 0.830 0.127 1.083 42 HB ILE 6 HB ILE 6 1.538 0.793 -1.821 43 HG12 ILE 6 2HG1 ILE 6 3.788 -0.401 -1.140 44 HG13 ILE 6 3HG1 ILE 6 2.840 -1.152 0.133 45 HG21 ILE 6 1HG2 ILE 6 3.499 1.958 -0.851 46 HG22 ILE 6 2HG2 ILE 6 2.905 1.609 0.772 47 HG23 ILE 6 3HG2 ILE 6 1.979 2.666 -0.297 48 HD11 ILE 6 3HD1 ILE 6 1.402 -2.184 -1.560 49 HD12 ILE 6 1HD1 ILE 6 3.096 -2.614 -1.784 50 HD13 ILE 6 2HD1 ILE 6 2.348 -1.412 -2.835 51 H VAL 7 H VAL 7 -0.642 1.497 1.965 52 HA VAL 7 HA VAL 7 -2.304 3.238 0.303 53 HB VAL 7 HB VAL 7 -2.273 2.872 3.335 54 HG11 VAL 7 1HG1 VAL 7 -4.387 4.178 3.355 55 HG12 VAL 7 2HG1 VAL 7 -4.228 4.480 1.623 56 HG13 VAL 7 3HG1 VAL 7 -3.046 5.156 2.748 57 HG21 VAL 7 3HG2 VAL 7 -4.392 1.663 2.980 58 HG22 VAL 7 1HG2 VAL 7 -3.067 0.892 2.102 59 HG23 VAL 7 2HG2 VAL 7 -4.239 1.889 1.234 60 H VAL 8 H VAL 8 -1.434 5.042 -0.359 61 HA VAL 8 HA VAL 8 0.416 6.583 1.356 62 HB VAL 8 HB VAL 8 0.212 6.854 -1.676 63 HG11 VAL 8 1HG1 VAL 8 2.407 7.665 0.264 64 HG12 VAL 8 2HG1 VAL 8 1.208 8.751 -0.445 65 HG13 VAL 8 3HG1 VAL 8 2.391 7.953 -1.478 66 HG21 VAL 8 3HG2 VAL 8 0.877 4.531 -1.248 67 HG22 VAL 8 1HG2 VAL 8 2.175 5.075 -0.184 68 HG23 VAL 8 2HG2 VAL 8 2.233 5.449 -1.906 69 H SER 9 H SER 9 0.036 8.813 1.526 70 HA SER 9 HA SER 9 -1.843 10.177 -0.175 71 HB2 SER 9 2HB SER 9 -3.230 11.089 1.737 72 HB3 SER 9 3HB SER 9 -3.472 9.361 1.465 73 HG SER 9 HG SER 9 -1.542 9.411 3.131 74 H ASN 10 H ASN 10 -1.693 12.436 0.020 75 HA ASN 10 HA ASN 10 0.923 13.416 0.676 76 HB2 ASN 10 2HB ASN 10 -1.580 14.894 -0.276 77 HB3 ASN 10 3HB ASN 10 0.026 15.612 -0.154 78 HD21 ASN 10 1HD2 ASN 10 -1.969 13.334 -1.927 79 HD22 ASN 10 2HD2 ASN 10 -0.902 13.159 -3.274 80 H ASP 11 H ASP 11 -2.168 13.368 2.253 81 HA ASP 11 HA ASP 11 -1.138 15.003 4.498 82 HB2 ASP 11 2HB ASP 11 -3.307 15.740 3.429 83 HB3 ASP 11 3HB ASP 11 -4.024 14.208 3.892 84 H GLU 12 H GLU 12 -0.516 13.895 6.235 85 HA GLU 12 HA GLU 12 -0.622 11.036 6.294 86 HB2 GLU 12 2HB GLU 12 0.593 13.079 8.191 87 HB3 GLU 12 3HB GLU 12 0.755 11.337 8.410 88 HG2 GLU 12 2HG GLU 12 1.883 11.159 6.217 89 HG3 GLU 12 3HG GLU 12 1.723 12.901 5.993 90 H ARG 13 H ARG 13 -2.700 13.441 7.709 91 HA ARG 13 HA ARG 13 -3.702 11.758 9.835 92 HB2 ARG 13 2HB ARG 13 -4.987 14.199 8.556 93 HB3 ARG 13 3HB ARG 13 -5.591 13.360 9.987 94 HG2 ARG 13 2HG ARG 13 -3.501 13.929 11.194 95 HG3 ARG 13 3HG ARG 13 -2.922 14.799 9.768 96 HD2 ARG 13 2HD ARG 13 -5.404 15.470 11.389 97 HD3 ARG 13 3HD ARG 13 -3.871 16.344 11.440 98 HE ARG 13 HE ARG 13 -4.282 16.895 9.036 99 HH11 ARG 13 1HH1 ARG 13 -7.064 16.128 11.068 100 HH12 ARG 13 2HH1 ARG 13 -8.167 17.047 10.091 101 HH21 ARG 13 1HH2 ARG 13 -5.727 18.105 7.809 102 HH22 ARG 13 2HH2 ARG 13 -7.408 18.165 8.245 103 H ILE 14 H ILE 14 -4.435 12.233 6.426 104 HA ILE 14 HA ILE 14 -6.780 10.689 6.223 105 HB ILE 14 HB ILE 14 -4.502 11.007 4.203 106 HG12 ILE 14 2HG1 ILE 14 -7.187 12.455 4.454 107 HG13 ILE 14 3HG1 ILE 14 -5.599 13.150 4.766 108 HG21 ILE 14 1HG2 ILE 14 -7.293 9.910 3.696 109 HG22 ILE 14 2HG2 ILE 14 -5.800 8.971 3.683 110 HG23 ILE 14 3HG2 ILE 14 -6.062 10.217 2.465 111 HD11 ILE 14 3HD1 ILE 14 -6.667 12.248 2.091 112 HD12 ILE 14 1HD1 ILE 14 -5.036 12.859 2.382 113 HD13 ILE 14 2HD1 ILE 14 -6.430 13.906 2.644 114 H LEU 15 H LEU 15 -3.313 9.751 6.229 115 HA LEU 15 HA LEU 15 -3.590 6.966 5.985 116 HB2 LEU 15 2HB LEU 15 -1.516 8.542 7.556 117 HB3 LEU 15 3HB LEU 15 -1.390 6.822 7.205 118 HG LEU 15 HG LEU 15 -1.459 9.005 5.094 119 HD11 LEU 15 1HD1 LEU 15 0.918 7.423 6.120 120 HD12 LEU 15 2HD1 LEU 15 0.577 9.124 6.468 121 HD13 LEU 15 3HD1 LEU 15 0.923 8.618 4.817 122 HD21 LEU 15 3HD2 LEU 15 -2.362 6.894 4.251 123 HD22 LEU 15 1HD2 LEU 15 -0.954 6.009 4.851 124 HD23 LEU 15 2HD2 LEU 15 -0.774 7.187 3.546 125 H GLU 16 H GLU 16 -3.756 9.050 8.866 126 HA GLU 16 HA GLU 16 -3.775 6.988 10.827 127 HB2 GLU 16 2HB GLU 16 -4.692 9.890 10.987 128 HB3 GLU 16 3HB GLU 16 -4.610 8.808 12.378 129 HG2 GLU 16 2HG GLU 16 -2.167 8.516 11.964 130 HG3 GLU 16 3HG GLU 16 -2.276 9.705 10.662 131 H GLU 17 H GLU 17 -6.420 8.896 9.339 132 HA GLU 17 HA GLU 17 -8.582 7.676 10.703 133 HB2 GLU 17 2HB GLU 17 -8.912 9.760 9.458 134 HB3 GLU 17 3HB GLU 17 -8.473 8.973 7.940 135 HG2 GLU 17 2HG GLU 17 -10.484 7.486 8.188 136 HG3 GLU 17 3HG GLU 17 -10.948 8.397 9.621 137 H LEU 18 H LEU 18 -7.180 7.048 7.511 138 HA LEU 18 HA LEU 18 -8.807 4.880 6.768 139 HB2 LEU 18 2HB LEU 18 -6.253 6.092 5.734 140 HB3 LEU 18 3HB LEU 18 -6.686 4.496 5.150 141 HG LEU 18 HG LEU 18 -8.814 5.352 4.235 142 HD11 LEU 18 1HD1 LEU 18 -9.390 7.725 4.194 143 HD12 LEU 18 2HD1 LEU 18 -7.999 8.095 5.214 144 HD13 LEU 18 3HD1 LEU 18 -9.320 7.114 5.847 145 HD21 LEU 18 3HD2 LEU 18 -7.922 6.734 2.406 146 HD22 LEU 18 1HD2 LEU 18 -6.834 5.397 2.789 147 HD23 LEU 18 2HD2 LEU 18 -6.450 7.031 3.337 148 H LEU 19 H LEU 19 -5.875 5.037 8.676 149 HA LEU 19 HA LEU 19 -5.135 2.342 8.806 150 HB2 LEU 19 2HB LEU 19 -3.722 4.044 9.808 151 HB3 LEU 19 3HB LEU 19 -4.999 4.524 10.912 152 HG LEU 19 HG LEU 19 -4.818 2.275 12.044 153 HD11 LEU 19 1HD1 LEU 19 -2.412 1.886 10.258 154 HD12 LEU 19 2HD1 LEU 19 -3.911 0.949 10.240 155 HD13 LEU 19 3HD1 LEU 19 -2.846 0.874 11.640 156 HD21 LEU 19 3HD2 LEU 19 -2.272 3.907 12.014 157 HD22 LEU 19 1HD2 LEU 19 -2.743 2.735 13.251 158 HD23 LEU 19 2HD2 LEU 19 -3.701 4.193 13.014 159 H GLU 20 H GLU 20 -7.370 4.203 10.830 160 HA GLU 20 HA GLU 20 -8.115 2.091 12.560 161 HB2 GLU 20 2HB GLU 20 -9.609 4.678 11.967 162 HB3 GLU 20 3HB GLU 20 -9.818 3.649 13.388 163 HG2 GLU 20 2HG GLU 20 -7.475 4.110 14.058 164 HG3 GLU 20 3HG GLU 20 -7.284 5.146 12.641 165 H VAL 21 H VAL 21 -9.363 3.226 9.496 166 HA VAL 21 HA VAL 21 -11.803 1.810 9.393 167 HB VAL 21 HB VAL 21 -9.964 2.605 7.082 168 HG11 VAL 21 1HG1 VAL 21 -11.988 2.507 5.649 169 HG12 VAL 21 2HG1 VAL 21 -12.930 1.904 7.015 170 HG13 VAL 21 3HG1 VAL 21 -11.622 0.925 6.349 171 HG21 VAL 21 3HG2 VAL 21 -10.615 4.524 8.503 172 HG22 VAL 21 1HG2 VAL 21 -12.314 4.113 8.291 173 HG23 VAL 21 2HG2 VAL 21 -11.351 4.634 6.907 174 H VAL 22 H VAL 22 -8.466 0.898 8.498 175 HA VAL 22 HA VAL 22 -9.119 -1.713 7.540 176 HB VAL 22 HB VAL 22 -6.422 -0.628 8.500 177 HG11 VAL 22 1HG1 VAL 22 -7.026 -3.141 6.883 178 HG12 VAL 22 2HG1 VAL 22 -6.433 -3.097 8.543 179 HG13 VAL 22 3HG1 VAL 22 -5.414 -2.512 7.227 180 HG21 VAL 22 3HG2 VAL 22 -5.918 -0.302 6.093 181 HG22 VAL 22 1HG2 VAL 22 -7.330 0.642 6.581 182 HG23 VAL 22 2HG2 VAL 22 -7.542 -0.857 5.675 183 H LEU 23 H LEU 23 -7.894 -0.432 10.644 184 HA LEU 23 HA LEU 23 -7.499 -2.802 12.056 185 HB2 LEU 23 2HB LEU 23 -8.337 -0.065 13.085 186 HB3 LEU 23 3HB LEU 23 -7.772 -1.370 14.108 187 HG LEU 23 HG LEU 23 -6.113 0.023 11.974 188 HD11 LEU 23 1HD1 LEU 23 -5.977 0.241 14.999 189 HD12 LEU 23 2HD1 LEU 23 -6.567 1.478 13.884 190 HD13 LEU 23 3HD1 LEU 23 -4.872 1.002 13.850 191 HD21 LEU 23 3HD2 LEU 23 -5.267 -2.114 13.971 192 HD22 LEU 23 1HD2 LEU 23 -4.197 -1.239 12.871 193 HD23 LEU 23 2HD2 LEU 23 -5.423 -2.327 12.224 194 H LYS 24 H LYS 24 -10.487 -0.808 11.900 195 HA LYS 24 HA LYS 24 -11.896 -2.331 13.863 196 HB2 LYS 24 2HB LYS 24 -13.877 -1.026 13.284 197 HB3 LYS 24 3HB LYS 24 -12.479 0.037 13.391 198 HG2 LYS 24 2HG LYS 24 -12.329 0.149 10.946 199 HG3 LYS 24 3HG LYS 24 -13.671 -0.987 10.787 200 HD2 LYS 24 2HD LYS 24 -15.220 0.631 11.776 201 HD3 LYS 24 3HD LYS 24 -13.894 1.743 12.126 202 HE2 LYS 24 2HE LYS 24 -13.486 1.947 9.664 203 HE3 LYS 24 3HE LYS 24 -14.903 0.934 9.379 204 HZ1 LYS 24 3HZ LYS 24 -14.943 3.515 10.839 205 HZ2 LYS 24 1HZ LYS 24 -16.281 2.576 10.419 206 HZ3 LYS 24 2HZ LYS 24 -15.363 3.325 9.219 207 H SER 25 H SER 25 -11.697 -2.427 10.338 208 HA SER 25 HA SER 25 -13.829 -4.275 9.902 209 HB2 SER 25 2HB SER 25 -11.456 -3.547 8.124 210 HB3 SER 25 3HB SER 25 -12.876 -4.455 7.599 211 HG SER 25 HG SER 25 -12.585 -1.861 7.617 212 H ASP 26 H ASP 26 -10.332 -4.552 10.399 213 HA ASP 26 HA ASP 26 -10.504 -7.208 11.400 214 HB2 ASP 26 2HB ASP 26 -10.668 -7.617 8.898 215 HB3 ASP 26 3HB ASP 26 -9.052 -6.941 8.725 216 HA PRO 27 HA PRO 27 -6.808 -5.084 13.090 217 HB2 PRO 27 2HB PRO 27 -6.912 -6.951 15.363 218 HB3 PRO 27 3HB PRO 27 -7.311 -5.227 15.321 219 HG2 PRO 27 2HG PRO 27 -9.197 -7.160 15.710 220 HG3 PRO 27 3HG PRO 27 -9.555 -5.590 14.954 221 HD2 PRO 27 2HD PRO 27 -9.037 -8.251 13.613 222 HD3 PRO 27 3HD PRO 27 -10.307 -7.046 13.279 223 H ASN 28 H ASN 28 -7.070 -8.205 11.867 224 HA ASN 28 HA ASN 28 -4.472 -9.206 12.755 225 HB2 ASN 28 2HB ASN 28 -6.347 -10.490 10.718 226 HB3 ASN 28 3HB ASN 28 -5.031 -11.260 11.597 227 HD21 ASN 28 1HD2 ASN 28 -8.297 -10.156 11.731 228 HD22 ASN 28 2HD2 ASN 28 -8.707 -10.863 13.257 229 H VAL 29 H VAL 29 -5.935 -7.659 9.950 230 HA VAL 29 HA VAL 29 -3.973 -8.132 7.992 231 HB VAL 29 HB VAL 29 -5.522 -5.512 8.330 232 HG11 VAL 29 1HG1 VAL 29 -4.241 -6.770 5.874 233 HG12 VAL 29 2HG1 VAL 29 -3.660 -5.344 6.740 234 HG13 VAL 29 3HG1 VAL 29 -5.198 -5.286 5.878 235 HG21 VAL 29 3HG2 VAL 29 -7.102 -7.409 8.260 236 HG22 VAL 29 1HG2 VAL 29 -6.361 -7.983 6.764 237 HG23 VAL 29 2HG2 VAL 29 -7.216 -6.437 6.791 238 H LYS 30 H LYS 30 -1.891 -7.425 7.800 239 HA LYS 30 HA LYS 30 -0.687 -6.368 10.188 240 HB2 LYS 30 2HB LYS 30 0.200 -8.288 8.702 241 HB3 LYS 30 3HB LYS 30 0.746 -7.040 7.589 242 HG2 LYS 30 2HG LYS 30 2.600 -7.740 8.989 243 HG3 LYS 30 3HG LYS 30 2.164 -6.077 9.408 244 HD2 LYS 30 2HD LYS 30 0.891 -6.900 11.370 245 HD3 LYS 30 3HD LYS 30 1.281 -8.565 10.934 246 HE2 LYS 30 2HE LYS 30 3.663 -8.122 11.346 247 HE3 LYS 30 3HE LYS 30 3.290 -6.437 11.725 248 HZ1 LYS 30 3HZ LYS 30 2.280 -8.794 13.233 249 HZ2 LYS 30 1HZ LYS 30 1.970 -7.174 13.597 250 HZ3 LYS 30 2HZ LYS 30 3.539 -7.783 13.721 251 H THR 31 H THR 31 -1.543 -4.189 10.161 252 HA THR 31 HA THR 31 -0.758 -2.343 8.071 253 HB THR 31 HB THR 31 -1.774 -0.592 9.519 254 HG1 THR 31 HG1 THR 31 -1.493 -2.491 11.447 255 HG21 THR 31 3HG2 THR 31 -3.518 -3.062 9.234 256 HG22 THR 31 1HG2 THR 31 -3.253 -1.829 8.001 257 HG23 THR 31 2HG2 THR 31 -4.096 -1.413 9.493 258 H VAL 32 H VAL 32 1.350 -1.895 7.920 259 HA VAL 32 HA VAL 32 2.945 -1.279 10.350 260 HB VAL 32 HB VAL 32 3.950 -2.158 7.589 261 HG11 VAL 32 1HG1 VAL 32 5.593 -0.774 8.782 262 HG12 VAL 32 2HG1 VAL 32 6.144 -2.447 8.699 263 HG13 VAL 32 3HG1 VAL 32 5.472 -1.818 10.205 264 HG21 VAL 32 3HG2 VAL 32 4.492 -4.346 8.622 265 HG22 VAL 32 1HG2 VAL 32 2.756 -4.019 8.665 266 HG23 VAL 32 2HG2 VAL 32 3.726 -3.828 10.127 267 H ARG 33 H ARG 33 3.129 0.880 10.589 268 HA ARG 33 HA ARG 33 2.953 2.690 8.251 269 HB2 ARG 33 2HB ARG 33 2.639 3.344 11.230 270 HB3 ARG 33 3HB ARG 33 2.509 4.504 9.913 271 HG2 ARG 33 2HG ARG 33 0.287 4.023 10.537 272 HG3 ARG 33 3HG ARG 33 0.546 3.120 9.048 273 HD2 ARG 33 2HD ARG 33 -0.654 1.718 10.574 274 HD3 ARG 33 3HD ARG 33 0.980 1.075 10.450 275 HE ARG 33 HE ARG 33 0.936 2.866 12.588 276 HH11 ARG 33 1HH1 ARG 33 -0.506 -0.260 11.832 277 HH12 ARG 33 2HH1 ARG 33 -0.593 -0.741 13.495 278 HH21 ARG 33 1HH2 ARG 33 0.803 2.221 14.741 279 HH22 ARG 33 2HH2 ARG 33 0.144 0.661 15.139 280 H THR 34 H THR 34 5.009 2.507 7.534 281 HA THR 34 HA THR 34 6.968 4.272 8.403 282 HB THR 34 HB THR 34 7.399 2.640 10.282 283 HG1 THR 34 HG1 THR 34 9.199 3.736 9.903 284 HG21 THR 34 3HG2 THR 34 8.468 0.457 9.851 285 HG22 THR 34 1HG2 THR 34 8.284 0.701 8.102 286 HG23 THR 34 2HG2 THR 34 6.865 0.513 9.125 287 H ASP 35 H ASP 35 8.765 4.286 7.009 288 HA ASP 35 HA ASP 35 9.145 2.101 5.106 289 HB2 ASP 35 2HB ASP 35 7.844 3.671 3.769 290 HB3 ASP 35 3HB ASP 35 8.863 5.011 4.268 291 H ASP 36 H ASP 36 10.960 1.465 5.997 292 HA ASP 36 HA ASP 36 13.247 3.330 6.299 293 HB2 ASP 36 2HB ASP 36 12.528 2.225 8.409 294 HB3 ASP 36 3HB ASP 36 12.665 0.654 7.646 295 H LYS 37 H LYS 37 12.015 1.844 3.929 296 HA LYS 37 HA LYS 37 12.675 1.043 1.958 297 HB2 LYS 37 2HB LYS 37 15.539 1.491 2.883 298 HB3 LYS 37 3HB LYS 37 14.980 1.343 1.217 299 HG2 LYS 37 2HG LYS 37 13.601 3.460 1.607 300 HG3 LYS 37 3HG LYS 37 14.437 3.628 3.155 301 HD2 LYS 37 2HD LYS 37 15.524 5.025 1.458 302 HD3 LYS 37 3HD LYS 37 16.614 3.725 1.953 303 HE2 LYS 37 2HE LYS 37 15.906 2.434 -0.083 304 HE3 LYS 37 3HE LYS 37 14.950 3.830 -0.590 305 HZ1 LYS 37 3HZ LYS 37 17.129 3.710 -1.648 306 HZ2 LYS 37 1HZ LYS 37 17.883 3.862 -0.145 307 HZ3 LYS 37 2HZ LYS 37 16.935 5.124 -0.753 308 H GLU 38 H GLU 38 15.487 -0.248 3.770 309 HA GLU 38 HA GLU 38 15.319 -2.850 2.700 310 HB2 GLU 38 2HB GLU 38 17.026 -3.470 4.378 311 HB3 GLU 38 3HB GLU 38 17.433 -1.944 3.602 312 HG2 GLU 38 2HG GLU 38 16.668 -0.696 5.565 313 HG3 GLU 38 3HG GLU 38 16.147 -2.187 6.347 314 H LYS 39 H LYS 39 14.014 -1.416 5.641 315 HA LYS 39 HA LYS 39 13.370 -3.765 7.054 316 HB2 LYS 39 2HB LYS 39 13.535 -1.632 8.166 317 HB3 LYS 39 3HB LYS 39 12.221 -0.962 7.203 318 HG2 LYS 39 2HG LYS 39 10.579 -2.261 8.332 319 HG3 LYS 39 3HG LYS 39 11.795 -3.332 9.036 320 HD2 LYS 39 2HD LYS 39 12.620 -1.451 10.434 321 HD3 LYS 39 3HD LYS 39 11.369 -0.407 9.745 322 HE2 LYS 39 2HE LYS 39 10.777 -1.364 11.986 323 HE3 LYS 39 3HE LYS 39 9.617 -1.755 10.716 324 HZ1 LYS 39 3HZ LYS 39 11.757 -3.574 11.698 325 HZ2 LYS 39 1HZ LYS 39 10.606 -3.939 10.514 326 HZ3 LYS 39 2HZ LYS 39 10.121 -3.665 12.106 327 H VAL 40 H VAL 40 11.573 -1.986 4.585 328 HA VAL 40 HA VAL 40 9.025 -3.102 5.058 329 HB VAL 40 HB VAL 40 10.045 -2.190 2.334 330 HG11 VAL 40 1HG1 VAL 40 7.661 -1.618 1.924 331 HG12 VAL 40 2HG1 VAL 40 7.231 -2.252 3.515 332 HG13 VAL 40 3HG1 VAL 40 7.856 -3.340 2.273 333 HG21 VAL 40 3HG2 VAL 40 8.889 -0.486 4.587 334 HG22 VAL 40 1HG2 VAL 40 9.250 0.089 2.955 335 HG23 VAL 40 2HG2 VAL 40 10.556 -0.451 4.012 336 H LYS 41 H LYS 41 11.850 -4.353 3.386 337 HA LYS 41 HA LYS 41 10.680 -6.574 2.054 338 HB2 LYS 41 2HB LYS 41 13.549 -6.113 2.978 339 HB3 LYS 41 3HB LYS 41 13.053 -7.565 2.117 340 HG2 LYS 41 2HG LYS 41 14.057 -6.093 0.522 341 HG3 LYS 41 3HG LYS 41 12.320 -6.123 0.198 342 HD2 LYS 41 2HD LYS 41 12.079 -3.953 1.396 343 HD3 LYS 41 3HD LYS 41 13.821 -3.931 1.684 344 HE2 LYS 41 2HE LYS 41 12.487 -3.881 -1.041 345 HE3 LYS 41 3HE LYS 41 13.166 -2.484 -0.208 346 HZ1 LYS 41 3HZ LYS 41 15.338 -3.573 -0.300 347 HZ2 LYS 41 1HZ LYS 41 14.691 -3.319 -1.838 348 HZ3 LYS 41 2HZ LYS 41 14.660 -4.860 -1.154 349 H GLU 42 H GLU 42 12.063 -6.248 5.386 350 HA GLU 42 HA GLU 42 11.756 -9.020 6.029 351 HB2 GLU 42 2HB GLU 42 12.270 -8.521 8.312 352 HB3 GLU 42 3HB GLU 42 13.274 -7.451 7.344 353 HG2 GLU 42 2HG GLU 42 11.969 -5.553 7.896 354 HG3 GLU 42 3HG GLU 42 10.652 -6.521 8.537 355 H GLU 43 H GLU 43 9.648 -6.230 6.161 356 HA GLU 43 HA GLU 43 7.534 -7.364 7.689 357 HB2 GLU 43 2HB GLU 43 7.425 -5.105 5.638 358 HB3 GLU 43 3HB GLU 43 6.190 -5.465 6.840 359 HG2 GLU 43 2HG GLU 43 8.982 -4.407 7.331 360 HG3 GLU 43 3HG GLU 43 7.455 -3.561 7.572 361 H ILE 44 H ILE 44 8.241 -7.208 4.205 362 HA ILE 44 HA ILE 44 5.916 -8.473 3.195 363 HB ILE 44 HB ILE 44 8.750 -8.250 2.069 364 HG12 ILE 44 2HG1 ILE 44 6.187 -6.772 1.290 365 HG13 ILE 44 3HG1 ILE 44 7.480 -6.103 2.278 366 HG21 ILE 44 1HG2 ILE 44 7.893 -8.961 -0.134 367 HG22 ILE 44 2HG2 ILE 44 6.310 -9.273 0.576 368 HG23 ILE 44 3HG2 ILE 44 7.696 -10.245 1.066 369 HD11 ILE 44 3HD1 ILE 44 7.607 -5.290 0.003 370 HD12 ILE 44 1HD1 ILE 44 7.713 -6.943 -0.612 371 HD13 ILE 44 2HD1 ILE 44 9.017 -6.278 0.381 372 H GLU 45 H GLU 45 8.979 -9.696 4.473 373 HA GLU 45 HA GLU 45 8.724 -12.426 3.774 374 HB2 GLU 45 2HB GLU 45 10.869 -11.332 4.526 375 HB3 GLU 45 3HB GLU 45 10.229 -11.277 6.166 376 HG2 GLU 45 2HG GLU 45 10.061 -13.768 6.140 377 HG3 GLU 45 3HG GLU 45 10.789 -13.775 4.535 378 H LYS 46 H LYS 46 7.857 -10.612 6.688 379 HA LYS 46 HA LYS 46 6.720 -12.705 8.197 380 HB2 LYS 46 2HB LYS 46 6.048 -9.726 8.204 381 HB3 LYS 46 3HB LYS 46 5.570 -10.871 9.458 382 HG2 LYS 46 2HG LYS 46 7.830 -11.199 10.165 383 HG3 LYS 46 3HG LYS 46 8.469 -10.368 8.741 384 HD2 LYS 46 2HD LYS 46 7.319 -8.254 9.587 385 HD3 LYS 46 3HD LYS 46 6.981 -9.123 11.091 386 HE2 LYS 46 2HE LYS 46 9.352 -9.394 11.518 387 HE3 LYS 46 3HE LYS 46 9.759 -8.735 9.932 388 HZ1 LYS 46 3HZ LYS 46 10.113 -7.038 11.467 389 HZ2 LYS 46 1HZ LYS 46 8.641 -7.295 12.258 390 HZ3 LYS 46 2HZ LYS 46 8.661 -6.640 10.704 391 H ALA 47 H ALA 47 5.387 -10.561 5.703 392 HA ALA 47 HA ALA 47 2.635 -11.026 6.200 393 HB1 ALA 47 3HB ALA 47 3.966 -10.052 3.643 394 HB2 ALA 47 1HB ALA 47 3.491 -9.040 5.006 395 HB3 ALA 47 2HB ALA 47 2.256 -9.877 4.061 396 H ARG 48 H ARG 48 4.859 -12.513 3.798 397 HA ARG 48 HA ARG 48 2.829 -14.198 2.672 398 HB2 ARG 48 2HB ARG 48 4.601 -15.293 1.428 399 HB3 ARG 48 3HB ARG 48 4.814 -13.554 1.360 400 HG2 ARG 48 2HG ARG 48 6.694 -13.635 2.857 401 HG3 ARG 48 3HG ARG 48 6.400 -15.338 3.231 402 HD2 ARG 48 2HD ARG 48 7.269 -14.204 0.539 403 HD3 ARG 48 3HD ARG 48 8.261 -15.150 1.657 404 HE ARG 48 HE ARG 48 5.932 -16.604 0.964 405 HH11 ARG 48 1HH1 ARG 48 9.024 -15.695 -0.459 406 HH12 ARG 48 2HH1 ARG 48 9.049 -17.059 -1.529 407 HH21 ARG 48 1HH2 ARG 48 5.987 -18.348 -0.436 408 HH22 ARG 48 2HH2 ARG 48 7.326 -18.563 -1.515 409 H LYS 49 H LYS 49 4.996 -14.440 5.375 410 HA LYS 49 HA LYS 49 4.977 -17.292 5.701 411 HB2 LYS 49 2HB LYS 49 6.787 -15.754 6.527 412 HB3 LYS 49 3HB LYS 49 5.676 -15.132 7.744 413 HG2 LYS 49 2HG LYS 49 5.569 -17.333 8.815 414 HG3 LYS 49 3HG LYS 49 6.574 -18.032 7.542 415 HD2 LYS 49 2HD LYS 49 7.453 -15.884 9.517 416 HD3 LYS 49 3HD LYS 49 7.868 -17.594 9.612 417 HE2 LYS 49 2HE LYS 49 9.057 -17.372 7.409 418 HE3 LYS 49 3HE LYS 49 8.713 -15.640 7.442 419 HZ1 LYS 49 3HZ LYS 49 9.994 -15.456 9.471 420 HZ2 LYS 49 1HZ LYS 49 10.935 -16.132 8.244 421 HZ3 LYS 49 2HZ LYS 49 10.307 -17.116 9.466 422 H GLN 50 H GLN 50 3.295 -14.603 7.352 423 HA GLN 50 HA GLN 50 1.568 -16.275 8.930 424 HB2 GLN 50 2HB GLN 50 0.519 -14.188 9.650 425 HB3 GLN 50 3HB GLN 50 2.266 -13.998 9.661 426 HG2 GLN 50 2HG GLN 50 2.124 -12.788 7.499 427 HG3 GLN 50 3HG GLN 50 0.369 -12.911 7.569 428 HE21 GLN 50 1HE2 GLN 50 2.129 -10.547 7.549 429 HE22 GLN 50 2HE2 GLN 50 1.703 -9.643 8.944 430 H GLY 51 H GLY 51 1.514 -14.997 5.721 431 HA2 GLY 51 2HA GLY 51 0.129 -15.409 3.950 432 HA3 GLY 51 3HA GLY 51 -0.813 -16.481 4.973 433 H ARG 52 H ARG 52 -0.221 -13.109 5.759 434 HA ARG 52 HA ARG 52 -3.100 -12.490 5.359 435 HB2 ARG 52 2HB ARG 52 -1.121 -11.278 7.347 436 HB3 ARG 52 3HB ARG 52 -2.798 -10.772 7.148 437 HG2 ARG 52 2HG ARG 52 -3.554 -13.000 7.917 438 HG3 ARG 52 3HG ARG 52 -1.869 -13.493 8.131 439 HD2 ARG 52 2HD ARG 52 -1.550 -11.726 9.799 440 HD3 ARG 52 3HD ARG 52 -3.212 -11.174 9.559 441 HE ARG 52 HE ARG 52 -3.414 -13.828 10.292 442 HH11 ARG 52 1HH1 ARG 52 -2.061 -10.911 11.728 443 HH12 ARG 52 2HH1 ARG 52 -2.347 -11.440 13.355 444 HH21 ARG 52 1HH2 ARG 52 -3.829 -14.476 12.441 445 HH22 ARG 52 2HH2 ARG 52 -3.350 -13.461 13.763 446 HA PRO 53 HA PRO 53 -1.745 -9.054 2.675 447 HB2 PRO 53 2HB PRO 53 -3.816 -7.266 3.131 448 HB3 PRO 53 3HB PRO 53 -3.970 -8.675 2.059 449 HG2 PRO 53 2HG PRO 53 -4.858 -8.382 4.917 450 HG3 PRO 53 3HG PRO 53 -5.720 -9.112 3.541 451 HD2 PRO 53 2HD PRO 53 -4.439 -10.645 5.369 452 HD3 PRO 53 3HD PRO 53 -4.502 -11.105 3.652 453 H ILE 54 H ILE 54 -0.588 -7.148 2.970 454 HA ILE 54 HA ILE 54 -0.288 -6.122 5.742 455 HB ILE 54 HB ILE 54 1.695 -7.404 5.206 456 HG12 ILE 54 2HG1 ILE 54 2.313 -4.426 4.931 457 HG13 ILE 54 3HG1 ILE 54 2.058 -5.286 6.445 458 HG21 ILE 54 1HG2 ILE 54 3.147 -6.980 3.262 459 HG22 ILE 54 2HG2 ILE 54 2.009 -5.770 2.667 460 HG23 ILE 54 3HG2 ILE 54 1.526 -7.465 2.754 461 HD11 ILE 54 3HD1 ILE 54 4.326 -5.700 4.512 462 HD12 ILE 54 1HD1 ILE 54 4.061 -6.625 5.994 463 HD13 ILE 54 2HD1 ILE 54 4.388 -4.895 6.079 464 H VAL 55 H VAL 55 -0.600 -3.968 5.976 465 HA VAL 55 HA VAL 55 -0.978 -2.333 3.550 466 HB VAL 55 HB VAL 55 -2.105 -1.567 6.275 467 HG11 VAL 55 1HG1 VAL 55 -2.940 -0.905 3.420 468 HG12 VAL 55 2HG1 VAL 55 -2.060 0.163 4.522 469 HG13 VAL 55 3HG1 VAL 55 -3.723 -0.311 4.884 470 HG21 VAL 55 3HG2 VAL 55 -3.515 -3.315 4.228 471 HG22 VAL 55 1HG2 VAL 55 -4.248 -2.618 5.672 472 HG23 VAL 55 2HG2 VAL 55 -2.968 -3.821 5.826 473 H ILE 56 H ILE 56 0.786 -1.115 3.164 474 HA ILE 56 HA ILE 56 2.419 -0.040 5.364 475 HB ILE 56 HB ILE 56 2.853 0.049 2.333 476 HG12 ILE 56 2HG1 ILE 56 3.020 -2.255 3.274 477 HG13 ILE 56 3HG1 ILE 56 4.576 -1.685 2.683 478 HG21 ILE 56 1HG2 ILE 56 4.759 0.887 4.559 479 HG22 ILE 56 2HG2 ILE 56 3.975 1.961 3.396 480 HG23 ILE 56 3HG2 ILE 56 5.171 0.789 2.845 481 HD11 ILE 56 3HD1 ILE 56 4.829 -2.905 4.753 482 HD12 ILE 56 1HD1 ILE 56 3.705 -1.824 5.575 483 HD13 ILE 56 2HD1 ILE 56 5.264 -1.216 5.007 484 H PHE 57 H PHE 57 1.635 1.829 6.205 485 HA PHE 57 HA PHE 57 0.267 3.824 4.517 486 HB2 PHE 57 2HB PHE 57 0.608 3.618 7.531 487 HB3 PHE 57 3HB PHE 57 -0.122 5.008 6.741 488 HD1 PHE 57 HD2 PHE 57 -0.572 1.420 7.561 489 HD2 PHE 57 HD1 PHE 57 -2.357 4.909 5.847 490 HE1 PHE 57 HE2 PHE 57 -2.788 0.344 7.614 491 HE2 PHE 57 HE1 PHE 57 -4.554 3.822 5.922 492 HZ PHE 57 HZ PHE 57 -4.754 1.545 6.770 493 H ILE 58 H ILE 58 1.479 5.324 3.598 494 HA ILE 58 HA ILE 58 3.704 6.642 4.982 495 HB ILE 58 HB ILE 58 5.106 6.454 2.817 496 HG12 ILE 58 2HG1 ILE 58 3.243 4.093 2.279 497 HG13 ILE 58 3HG1 ILE 58 3.288 5.594 1.356 498 HG21 ILE 58 1HG2 ILE 58 6.125 4.299 3.475 499 HG22 ILE 58 2HG2 ILE 58 4.712 3.918 4.463 500 HG23 ILE 58 3HG2 ILE 58 5.748 5.282 4.891 501 HD11 ILE 58 3HD1 ILE 58 4.467 3.874 0.197 502 HD12 ILE 58 1HD1 ILE 58 5.505 3.576 1.589 503 HD13 ILE 58 2HD1 ILE 58 5.605 5.112 0.723 504 H ARG 59 H ARG 59 4.521 8.485 3.673 505 HA ARG 59 HA ARG 59 2.317 9.971 2.406 506 HB2 ARG 59 2HB ARG 59 3.597 10.823 4.479 507 HB3 ARG 59 3HB ARG 59 4.989 11.036 3.424 508 HG2 ARG 59 2HG ARG 59 3.611 12.607 2.029 509 HG3 ARG 59 3HG ARG 59 2.311 12.449 3.212 510 HD2 ARG 59 2HD ARG 59 3.784 13.368 4.961 511 HD3 ARG 59 3HD ARG 59 5.096 13.521 3.788 512 HE ARG 59 HE ARG 59 3.133 14.960 2.634 513 HH11 ARG 59 1HH1 ARG 59 4.417 15.032 5.919 514 HH12 ARG 59 2HH1 ARG 59 4.087 16.723 6.128 515 HH21 ARG 59 1HH2 ARG 59 2.718 17.149 2.923 516 HH22 ARG 59 2HH2 ARG 59 3.115 17.929 4.419 517 H GLY 60 H GLY 60 3.060 11.518 0.609 518 HA2 GLY 60 2HA GLY 60 3.839 10.109 -1.649 519 HA3 GLY 60 3HA GLY 60 3.796 11.853 -1.525 520 H ALA 61 H ALA 61 5.953 11.715 0.619 521 HA ALA 61 HA ALA 61 8.313 11.876 -0.957 522 HB1 ALA 61 3HB ALA 61 8.042 13.069 1.181 523 HB2 ALA 61 1HB ALA 61 9.484 12.052 1.217 524 HB3 ALA 61 2HB ALA 61 8.010 11.536 2.049 525 H TYR 62 H TYR 62 7.122 9.447 1.322 526 HA TYR 62 HA TYR 62 9.297 7.595 1.056 527 HB2 TYR 62 2HB TYR 62 6.521 7.107 2.230 528 HB3 TYR 62 3HB TYR 62 7.971 6.155 2.534 529 HD1 TYR 62 HD1 TYR 62 6.213 9.310 3.289 530 HD2 TYR 62 HD2 TYR 62 9.691 6.967 4.096 531 HE1 TYR 62 HE1 TYR 62 6.716 10.742 5.220 532 HE2 TYR 62 HE2 TYR 62 10.197 8.405 6.028 533 HH TYR 62 HH TYR 62 9.713 10.653 6.836 534 H GLU 63 H GLU 63 6.210 8.055 -0.452 535 HA GLU 63 HA GLU 63 5.447 5.663 -1.559 536 HB2 GLU 63 2HB GLU 63 4.171 7.769 -1.643 537 HB3 GLU 63 3HB GLU 63 5.347 8.463 -2.752 538 HG2 GLU 63 2HG GLU 63 4.678 6.601 -4.398 539 HG3 GLU 63 3HG GLU 63 3.331 6.274 -3.310 540 H GLU 64 H GLU 64 7.948 7.877 -2.642 541 HA GLU 64 HA GLU 64 8.559 6.970 -5.183 542 HB2 GLU 64 2HB GLU 64 9.461 9.044 -4.243 543 HB3 GLU 64 3HB GLU 64 10.415 8.139 -3.070 544 HG2 GLU 64 2HG GLU 64 11.766 7.181 -4.847 545 HG3 GLU 64 3HG GLU 64 10.755 7.943 -6.072 546 H VAL 65 H VAL 65 9.771 5.777 -2.063 547 HA VAL 65 HA VAL 65 11.816 4.086 -3.078 548 HB VAL 65 HB VAL 65 10.410 3.941 -0.367 549 HG11 VAL 65 1HG1 VAL 65 12.440 2.797 0.433 550 HG12 VAL 65 2HG1 VAL 65 13.139 2.861 -1.185 551 HG13 VAL 65 3HG1 VAL 65 11.701 1.886 -0.888 552 HG21 VAL 65 3HG2 VAL 65 12.936 5.452 -1.144 553 HG22 VAL 65 1HG2 VAL 65 12.250 5.347 0.482 554 HG23 VAL 65 2HG2 VAL 65 11.367 6.183 -0.799 555 H VAL 66 H VAL 66 8.382 3.613 -2.600 556 HA VAL 66 HA VAL 66 8.146 0.893 -2.130 557 HB VAL 66 HB VAL 66 6.245 2.631 -3.772 558 HG11 VAL 66 1HG1 VAL 66 5.724 0.245 -4.139 559 HG12 VAL 66 2HG1 VAL 66 4.467 1.000 -3.157 560 HG13 VAL 66 3HG1 VAL 66 5.681 -0.034 -2.396 561 HG21 VAL 66 3HG2 VAL 66 5.035 2.933 -1.641 562 HG22 VAL 66 1HG2 VAL 66 6.696 3.524 -1.531 563 HG23 VAL 66 2HG2 VAL 66 6.263 1.973 -0.809 564 H ARG 67 H ARG 67 8.538 2.536 -5.257 565 HA ARG 67 HA ARG 67 7.914 0.483 -7.034 566 HB2 ARG 67 2HB ARG 67 8.204 2.866 -7.666 567 HB3 ARG 67 3HB ARG 67 9.928 2.754 -7.369 568 HG2 ARG 67 2HG ARG 67 8.707 0.927 -9.428 569 HG3 ARG 67 3HG ARG 67 8.916 2.626 -9.837 570 HD2 ARG 67 2HD ARG 67 11.340 2.445 -9.431 571 HD3 ARG 67 3HD ARG 67 11.153 0.758 -8.944 572 HE ARG 67 HE ARG 67 10.094 0.783 -11.433 573 HH11 ARG 67 1HH1 ARG 67 13.212 1.898 -10.223 574 HH12 ARG 67 2HH1 ARG 67 14.028 1.593 -11.722 575 HH21 ARG 67 1HH2 ARG 67 11.167 0.368 -13.356 576 HH22 ARG 67 2HH2 ARG 67 12.862 0.723 -13.507 577 H ASP 68 H ASP 68 10.969 1.192 -5.407 578 HA ASP 68 HA ASP 68 12.585 -0.791 -6.680 579 HB2 ASP 68 2HB ASP 68 12.988 0.395 -3.889 580 HB3 ASP 68 3HB ASP 68 14.220 -0.328 -4.921 581 H ILE 69 H ILE 69 10.769 -0.644 -3.651 582 HA ILE 69 HA ILE 69 11.499 -3.086 -2.474 583 HB ILE 69 HB ILE 69 8.921 -1.491 -2.071 584 HG12 ILE 69 2HG1 ILE 69 11.535 -1.263 -0.497 585 HG13 ILE 69 3HG1 ILE 69 11.033 -0.134 -1.751 586 HG21 ILE 69 1HG2 ILE 69 10.255 -3.482 -0.197 587 HG22 ILE 69 2HG2 ILE 69 8.763 -3.754 -1.097 588 HG23 ILE 69 3HG2 ILE 69 8.817 -2.526 0.166 589 HD11 ILE 69 3HD1 ILE 69 10.594 0.734 0.473 590 HD12 ILE 69 1HD1 ILE 69 9.560 -0.647 0.829 591 HD13 ILE 69 2HD1 ILE 69 9.097 0.503 -0.425 592 H VAL 70 H VAL 70 8.990 -2.301 -4.810 593 HA VAL 70 HA VAL 70 7.176 -4.376 -4.453 594 HB VAL 70 HB VAL 70 7.849 -2.825 -6.999 595 HG11 VAL 70 1HG1 VAL 70 5.691 -3.652 -7.903 596 HG12 VAL 70 2HG1 VAL 70 5.498 -4.689 -6.502 597 HG13 VAL 70 3HG1 VAL 70 6.819 -4.971 -7.629 598 HG21 VAL 70 3HG2 VAL 70 6.910 -1.445 -5.182 599 HG22 VAL 70 1HG2 VAL 70 5.547 -2.543 -5.021 600 HG23 VAL 70 2HG2 VAL 70 5.745 -1.588 -6.495 601 H GLU 71 H GLU 71 10.194 -4.331 -6.359 602 HA GLU 71 HA GLU 71 9.805 -6.650 -7.892 603 HB2 GLU 71 2HB GLU 71 11.603 -5.018 -8.359 604 HB3 GLU 71 3HB GLU 71 12.439 -5.494 -6.883 605 HG2 GLU 71 2HG GLU 71 12.690 -7.808 -7.832 606 HG3 GLU 71 3HG GLU 71 11.954 -7.238 -9.327 607 H TYR 72 H TYR 72 11.020 -6.257 -4.588 608 HA TYR 72 HA TYR 72 11.787 -8.957 -4.132 609 HB2 TYR 72 2HB TYR 72 12.563 -7.136 -2.650 610 HB3 TYR 72 3HB TYR 72 10.911 -6.834 -2.122 611 HD1 TYR 72 HD1 TYR 72 13.720 -9.295 -1.968 612 HD2 TYR 72 HD2 TYR 72 9.891 -8.220 -0.399 613 HE1 TYR 72 HE1 TYR 72 13.974 -10.964 -0.173 614 HE2 TYR 72 HE2 TYR 72 10.140 -9.889 1.379 615 HH TYR 72 HH TYR 72 13.078 -11.378 2.114 616 H ALA 73 H ALA 73 8.743 -7.177 -3.541 617 HA ALA 73 HA ALA 73 7.322 -9.331 -2.359 618 HB1 ALA 73 3HB ALA 73 6.620 -7.002 -2.089 619 HB2 ALA 73 1HB ALA 73 5.311 -7.970 -2.768 620 HB3 ALA 73 2HB ALA 73 6.246 -6.893 -3.811 621 H GLN 74 H GLN 74 7.869 -8.386 -5.714 622 HA GLN 74 HA GLN 74 5.870 -9.944 -6.981 623 HB2 GLN 74 2HB GLN 74 8.540 -8.919 -8.047 624 HB3 GLN 74 3HB GLN 74 7.362 -9.755 -9.051 625 HG2 GLN 74 2HG GLN 74 5.721 -7.916 -8.534 626 HG3 GLN 74 3HG GLN 74 7.020 -7.062 -7.701 627 HE21 GLN 74 1HE2 GLN 74 7.040 -5.308 -9.166 628 HE22 GLN 74 2HE2 GLN 74 7.564 -5.446 -10.799 629 H LYS 75 H LYS 75 9.365 -10.595 -6.385 630 HA LYS 75 HA LYS 75 9.388 -13.166 -7.593 631 HB2 LYS 75 2HB LYS 75 11.607 -13.479 -6.550 632 HB3 LYS 75 3HB LYS 75 11.476 -11.890 -7.295 633 HG2 LYS 75 2HG LYS 75 11.250 -10.808 -5.174 634 HG3 LYS 75 3HG LYS 75 11.043 -12.341 -4.330 635 HD2 LYS 75 2HD LYS 75 13.603 -11.464 -5.726 636 HD3 LYS 75 3HD LYS 75 13.292 -11.310 -3.997 637 HE2 LYS 75 2HE LYS 75 13.078 -13.778 -3.827 638 HE3 LYS 75 3HE LYS 75 13.424 -13.918 -5.553 639 HZ1 LYS 75 3HZ LYS 75 15.593 -12.994 -5.184 640 HZ2 LYS 75 1HZ LYS 75 15.374 -14.315 -4.165 641 HZ3 LYS 75 2HZ LYS 75 15.269 -12.749 -3.545 642 H GLU 76 H GLU 76 8.686 -12.082 -4.304 643 HA GLU 76 HA GLU 76 8.696 -14.709 -3.106 644 HB2 GLU 76 2HB GLU 76 7.669 -12.033 -2.053 645 HB3 GLU 76 3HB GLU 76 7.776 -13.513 -1.098 646 HG2 GLU 76 2HG GLU 76 10.078 -11.947 -2.298 647 HG3 GLU 76 3HG GLU 76 9.673 -12.097 -0.594 648 H GLY 77 H GLY 77 6.585 -13.398 -5.271 649 HA2 GLY 77 2HA GLY 77 4.639 -14.272 -6.116 650 HA3 GLY 77 3HA GLY 77 4.676 -15.500 -4.860 651 H LEU 78 H LEU 78 4.754 -12.064 -4.234 652 HA LEU 78 HA LEU 78 2.028 -12.153 -3.088 653 HB2 LEU 78 2HB LEU 78 4.351 -10.298 -2.414 654 HB3 LEU 78 3HB LEU 78 2.749 -10.227 -1.689 655 HG LEU 78 HG LEU 78 4.831 -12.426 -1.337 656 HD11 LEU 78 1HD1 LEU 78 3.581 -10.522 0.662 657 HD12 LEU 78 2HD1 LEU 78 5.224 -10.445 0.019 658 HD13 LEU 78 3HD1 LEU 78 4.743 -11.803 1.029 659 HD21 LEU 78 3HD2 LEU 78 2.647 -13.511 -1.527 660 HD22 LEU 78 1HD2 LEU 78 1.959 -12.409 -0.333 661 HD23 LEU 78 2HD2 LEU 78 3.199 -13.571 0.142 662 H ARG 79 H ARG 79 0.549 -11.095 -4.174 663 HA ARG 79 HA ARG 79 1.073 -9.528 -6.502 664 HB2 ARG 79 2HB ARG 79 -0.932 -11.039 -6.127 665 HB3 ARG 79 3HB ARG 79 -1.543 -9.895 -4.945 666 HG2 ARG 79 2HG ARG 79 -1.044 -9.094 -7.822 667 HG3 ARG 79 3HG ARG 79 -2.542 -9.879 -7.336 668 HD2 ARG 79 2HD ARG 79 -2.964 -8.003 -5.730 669 HD3 ARG 79 3HD ARG 79 -1.501 -7.206 -6.310 670 HE ARG 79 HE ARG 79 -2.599 -6.586 -8.224 671 HH11 ARG 79 1HH1 ARG 79 -4.589 -8.916 -6.524 672 HH12 ARG 79 2HH1 ARG 79 -5.969 -8.647 -7.535 673 HH21 ARG 79 1HH2 ARG 79 -4.416 -6.277 -9.570 674 HH22 ARG 79 2HH2 ARG 79 -5.871 -7.161 -9.250 675 H VAL 80 H VAL 80 1.241 -7.283 -6.650 676 HA VAL 80 HA VAL 80 1.282 -5.824 -4.083 677 HB VAL 80 HB VAL 80 2.786 -5.107 -6.648 678 HG11 VAL 80 1HG1 VAL 80 3.067 -4.072 -3.798 679 HG12 VAL 80 2HG1 VAL 80 2.377 -3.186 -5.159 680 HG13 VAL 80 3HG1 VAL 80 4.089 -3.607 -5.160 681 HG21 VAL 80 3HG2 VAL 80 3.829 -6.569 -4.191 682 HG22 VAL 80 1HG2 VAL 80 4.815 -6.011 -5.546 683 HG23 VAL 80 2HG2 VAL 80 3.605 -7.272 -5.794 684 H LEU 81 H LEU 81 0.083 -4.062 -3.894 685 HA LEU 81 HA LEU 81 -1.544 -3.042 -6.118 686 HB2 LEU 81 2HB LEU 81 -2.673 -4.898 -4.686 687 HB3 LEU 81 3HB LEU 81 -2.631 -3.752 -3.359 688 HG LEU 81 HG LEU 81 -4.069 -2.194 -4.712 689 HD11 LEU 81 1HD1 LEU 81 -3.462 -2.959 -6.938 690 HD12 LEU 81 2HD1 LEU 81 -5.203 -3.079 -6.704 691 HD13 LEU 81 3HD1 LEU 81 -4.200 -4.533 -6.628 692 HD21 LEU 81 3HD2 LEU 81 -5.193 -4.968 -4.237 693 HD22 LEU 81 1HD2 LEU 81 -6.149 -3.492 -4.443 694 HD23 LEU 81 2HD2 LEU 81 -5.081 -3.663 -3.052 695 H VAL 82 H VAL 82 -0.823 -0.945 -6.125 696 HA VAL 82 HA VAL 82 -0.207 0.379 -3.551 697 HB VAL 82 HB VAL 82 0.802 2.196 -5.055 698 HG11 VAL 82 1HG1 VAL 82 2.209 0.536 -3.895 699 HG12 VAL 82 2HG1 VAL 82 2.893 0.913 -5.478 700 HG13 VAL 82 3HG1 VAL 82 2.012 -0.602 -5.233 701 HG21 VAL 82 3HG2 VAL 82 1.404 1.529 -7.388 702 HG22 VAL 82 1HG2 VAL 82 -0.338 1.693 -7.164 703 HG23 VAL 82 2HG2 VAL 82 0.396 0.091 -7.219 704 H ILE 83 H ILE 83 -1.841 1.356 -2.665 705 HA ILE 83 HA ILE 83 -4.006 2.600 -4.257 706 HB ILE 83 HB ILE 83 -4.015 1.915 -1.268 707 HG12 ILE 83 2HG1 ILE 83 -5.216 0.220 -3.514 708 HG13 ILE 83 3HG1 ILE 83 -3.714 -0.162 -2.682 709 HG21 ILE 83 1HG2 ILE 83 -6.313 2.544 -3.170 710 HG22 ILE 83 2HG2 ILE 83 -5.667 3.628 -1.935 711 HG23 ILE 83 3HG2 ILE 83 -6.477 2.133 -1.460 712 HD11 ILE 83 3HD1 ILE 83 -6.454 -0.046 -1.424 713 HD12 ILE 83 1HD1 ILE 83 -4.944 -0.411 -0.580 714 HD13 ILE 83 2HD1 ILE 83 -5.536 -1.494 -1.839 715 H LYS 84 H LYS 84 -3.526 4.815 -4.522 716 HA LYS 84 HA LYS 84 -2.475 6.243 -2.142 717 HB2 LYS 84 2HB LYS 84 -0.908 7.535 -3.505 718 HB3 LYS 84 3HB LYS 84 -0.560 5.819 -3.594 719 HG2 LYS 84 2HG LYS 84 -1.558 5.741 -5.856 720 HG3 LYS 84 3HG LYS 84 -1.896 7.475 -5.751 721 HD2 LYS 84 2HD LYS 84 0.631 7.775 -5.316 722 HD3 LYS 84 3HD LYS 84 0.807 6.096 -5.833 723 HE2 LYS 84 2HE LYS 84 -0.054 6.646 -8.038 724 HE3 LYS 84 3HE LYS 84 -0.426 8.295 -7.513 725 HZ1 LYS 84 3HZ LYS 84 2.279 7.076 -7.768 726 HZ2 LYS 84 1HZ LYS 84 1.989 8.592 -7.071 727 HZ3 LYS 84 2HZ LYS 84 1.637 8.326 -8.707 728 H VAL 85 H VAL 85 -3.366 8.100 -1.665 729 HA VAL 85 HA VAL 85 -5.570 9.152 -3.226 730 HB VAL 85 HB VAL 85 -4.468 10.224 -0.576 731 HG11 VAL 85 1HG1 VAL 85 -6.675 11.338 -0.347 732 HG12 VAL 85 2HG1 VAL 85 -7.159 10.717 -1.925 733 HG13 VAL 85 3HG1 VAL 85 -5.836 11.881 -1.804 734 HG21 VAL 85 3HG2 VAL 85 -5.185 7.900 -0.263 735 HG22 VAL 85 1HG2 VAL 85 -6.757 8.272 -0.979 736 HG23 VAL 85 2HG2 VAL 85 -6.291 9.006 0.559 737 H ALA 86 H ALA 86 -5.161 10.539 -4.726 738 HA ALA 86 HA ALA 86 -3.297 12.763 -4.365 739 HB1 ALA 86 3HB ALA 86 -2.366 12.401 -6.628 740 HB2 ALA 86 1HB ALA 86 -3.302 10.910 -6.780 741 HB3 ALA 86 2HB ALA 86 -2.023 11.031 -5.570 742 H GLN 87 H GLN 87 -3.631 14.115 -6.553 743 HA GLN 87 HA GLN 87 -6.459 14.276 -7.286 744 HB2 GLN 87 2HB GLN 87 -4.713 16.597 -6.311 745 HB3 GLN 87 3HB GLN 87 -6.327 16.770 -7.005 746 HG2 GLN 87 2HG GLN 87 -7.266 15.452 -5.129 747 HG3 GLN 87 3HG GLN 87 -5.653 15.288 -4.444 748 HE21 GLN 87 1HE2 GLN 87 -8.329 17.435 -4.965 749 HE22 GLN 87 2HE2 GLN 87 -7.799 18.647 -3.859 750 H ASP 88 H ASP 88 -6.411 16.221 -9.040 751 HA ASP 88 HA ASP 88 -5.053 15.134 -11.278 752 HB2 ASP 88 2HB ASP 88 -7.266 16.216 -11.423 753 HB3 ASP 88 3HB ASP 88 -6.565 17.754 -10.933 754 H GLN 89 H GLN 89 -2.856 15.187 -10.736 755 HA GLN 89 HA GLN 89 -1.457 17.805 -10.811 756 HB2 GLN 89 2HB GLN 89 -0.553 15.192 -9.512 757 HB3 GLN 89 3HB GLN 89 0.407 16.665 -9.589 758 HG2 GLN 89 2HG GLN 89 -2.205 16.319 -8.081 759 HG3 GLN 89 3HG GLN 89 -0.596 16.315 -7.364 760 HE21 GLN 89 1HE2 GLN 89 0.597 18.290 -7.352 761 HE22 GLN 89 2HE2 GLN 89 -0.206 19.817 -7.444 762 H GLU 90 H GLU 90 0.263 17.976 -12.227 763 HA GLU 90 HA GLU 90 0.453 16.156 -14.454 764 HB2 GLU 90 2HB GLU 90 2.366 18.449 -13.774 765 HB3 GLU 90 3HB GLU 90 2.201 17.638 -15.325 766 HG2 GLU 90 2HG GLU 90 1.099 19.673 -15.665 767 HG3 GLU 90 3HG GLU 90 -0.219 18.549 -15.349 768 H LEU 91 H LEU 91 2.478 17.065 -11.702 769 HA LEU 91 HA LEU 91 4.706 15.421 -12.017 770 HB2 LEU 91 2HB LEU 91 4.600 17.261 -10.418 771 HB3 LEU 91 3HB LEU 91 3.331 16.460 -9.511 772 HG LEU 91 HG LEU 91 4.973 14.686 -8.822 773 HD11 LEU 91 1HD1 LEU 91 6.519 14.792 -10.706 774 HD12 LEU 91 2HD1 LEU 91 7.376 15.003 -9.181 775 HD13 LEU 91 3HD1 LEU 91 7.053 16.400 -10.211 776 HD21 LEU 91 3HD2 LEU 91 4.528 16.595 -7.348 777 HD22 LEU 91 1HD2 LEU 91 5.821 17.517 -8.119 778 HD23 LEU 91 2HD2 LEU 91 6.201 16.060 -7.197 779 H LEU 92 H LEU 92 1.473 14.598 -10.973 780 HA LEU 92 HA LEU 92 1.895 12.382 -9.331 781 HB2 LEU 92 2HB LEU 92 -0.293 13.477 -9.561 782 HB3 LEU 92 3HB LEU 92 -0.406 12.962 -11.237 783 HG LEU 92 HG LEU 92 -0.541 10.581 -10.497 784 HD11 LEU 92 1HD1 LEU 92 0.745 10.689 -8.453 785 HD12 LEU 92 2HD1 LEU 92 -0.856 10.043 -8.109 786 HD13 LEU 92 3HD1 LEU 92 -0.471 11.716 -7.690 787 HD21 LEU 92 3HD2 LEU 92 -2.625 12.361 -9.179 788 HD22 LEU 92 1HD2 LEU 92 -2.812 10.646 -9.562 789 HD23 LEU 92 2HD2 LEU 92 -2.628 11.823 -10.862 790 H GLU 93 H GLU 93 1.444 12.543 -12.864 791 HA GLU 93 HA GLU 93 1.401 9.750 -13.347 792 HB2 GLU 93 2HB GLU 93 2.080 12.012 -15.269 793 HB3 GLU 93 3HB GLU 93 1.679 10.357 -15.732 794 HG2 GLU 93 2HG GLU 93 -0.598 10.672 -14.752 795 HG3 GLU 93 3HG GLU 93 -0.181 12.351 -14.394 796 H ARG 94 H ARG 94 3.988 12.007 -12.881 797 HA ARG 94 HA ARG 94 5.980 10.919 -14.541 798 HB2 ARG 94 2HB ARG 94 5.878 13.219 -13.463 799 HB3 ARG 94 3HB ARG 94 6.445 12.469 -11.973 800 HG2 ARG 94 2HG ARG 94 8.568 11.896 -12.998 801 HG3 ARG 94 3HG ARG 94 7.978 12.374 -14.595 802 HD2 ARG 94 2HD ARG 94 8.464 14.203 -12.220 803 HD3 ARG 94 3HD ARG 94 9.417 14.135 -13.710 804 HE ARG 94 HE ARG 94 6.963 14.711 -14.663 805 HH11 ARG 94 1HH1 ARG 94 8.761 16.259 -12.043 806 HH12 ARG 94 2HH1 ARG 94 7.990 17.795 -12.289 807 HH21 ARG 94 1HH2 ARG 94 5.961 16.710 -14.923 808 HH22 ARG 94 2HH2 ARG 94 6.414 18.046 -13.912 809 H PHE 95 H PHE 95 5.441 10.474 -11.003 810 HA PHE 95 HA PHE 95 7.343 8.304 -10.834 811 HB2 PHE 95 2HB PHE 95 6.976 9.649 -8.816 812 HB3 PHE 95 3HB PHE 95 5.255 9.253 -8.811 813 HD1 PHE 95 HD2 PHE 95 8.584 7.488 -8.862 814 HD2 PHE 95 HD1 PHE 95 4.560 7.475 -7.360 815 HE1 PHE 95 HE2 PHE 95 9.056 5.437 -7.596 816 HE2 PHE 95 HE1 PHE 95 5.061 5.424 -6.103 817 HZ PHE 95 HZ PHE 95 7.297 4.406 -6.220 818 H TYR 96 H TYR 96 3.817 8.634 -10.881 819 HA TYR 96 HA TYR 96 2.986 6.057 -10.322 820 HB2 TYR 96 2HB TYR 96 1.330 7.699 -10.233 821 HB3 TYR 96 3HB TYR 96 1.812 8.426 -11.755 822 HD1 TYR 96 HD2 TYR 96 0.982 7.513 -13.910 823 HD2 TYR 96 HD1 TYR 96 -0.343 5.910 -10.172 824 HE1 TYR 96 HE2 TYR 96 -0.908 6.448 -15.044 825 HE2 TYR 96 HE1 TYR 96 -2.246 4.864 -11.305 826 HH TYR 96 HH TYR 96 -3.571 5.215 -13.417 827 H GLU 97 H GLU 97 4.269 7.285 -13.325 828 HA GLU 97 HA GLU 97 3.290 5.382 -15.172 829 HB2 GLU 97 2HB GLU 97 4.219 7.512 -15.887 830 HB3 GLU 97 3HB GLU 97 5.799 7.108 -15.209 831 HG2 GLU 97 2HG GLU 97 5.721 5.094 -16.904 832 HG3 GLU 97 3HG GLU 97 4.457 6.031 -17.696 833 H GLN 98 H GLN 98 6.222 5.495 -13.150 834 HA GLN 98 HA GLN 98 7.572 3.212 -14.064 835 HB2 GLN 98 2HB GLN 98 7.564 4.781 -11.504 836 HB3 GLN 98 3HB GLN 98 8.289 3.178 -11.429 837 HG2 GLN 98 2HG GLN 98 9.974 4.902 -11.837 838 HG3 GLN 98 3HG GLN 98 9.877 3.763 -13.183 839 HE21 GLN 98 1HE2 GLN 98 7.695 6.498 -12.533 840 HE22 GLN 98 2HE2 GLN 98 8.106 7.373 -13.963 841 H LEU 99 H LEU 99 4.872 3.466 -11.870 842 HA LEU 99 HA LEU 99 4.869 0.839 -10.783 843 HB2 LEU 99 2HB LEU 99 2.683 2.934 -11.111 844 HB3 LEU 99 3HB LEU 99 2.393 1.406 -10.304 845 HG LEU 99 HG LEU 99 3.789 1.995 -8.430 846 HD11 LEU 99 1HD1 LEU 99 5.695 2.987 -9.588 847 HD12 LEU 99 2HD1 LEU 99 5.148 4.030 -8.282 848 HD13 LEU 99 3HD1 LEU 99 4.747 4.428 -9.957 849 HD21 LEU 99 3HD2 LEU 99 2.239 4.478 -9.228 850 HD22 LEU 99 1HD2 LEU 99 2.785 4.083 -7.596 851 HD23 LEU 99 2HD2 LEU 99 1.585 3.068 -8.393 852 H LYS 100 H LYS 100 3.324 2.356 -13.559 853 HA LYS 100 HA LYS 100 1.966 0.018 -14.530 854 HB2 LYS 100 2HB LYS 100 2.579 2.584 -16.055 855 HB3 LYS 100 3HB LYS 100 1.303 1.417 -16.399 856 HG2 LYS 100 2HG LYS 100 1.462 3.216 -13.958 857 HG3 LYS 100 3HG LYS 100 0.419 3.472 -15.357 858 HD2 LYS 100 2HD LYS 100 0.228 0.998 -13.592 859 HD3 LYS 100 3HD LYS 100 -0.675 2.475 -13.272 860 HE2 LYS 100 2HE LYS 100 -2.145 0.973 -14.424 861 HE3 LYS 100 3HE LYS 100 -1.720 2.248 -15.558 862 HZ1 LYS 100 3HZ LYS 100 -0.192 0.768 -16.645 863 HZ2 LYS 100 1HZ LYS 100 -1.698 0.012 -16.534 864 HZ3 LYS 100 2HZ LYS 100 -0.453 -0.437 -15.492 865 H LYS 101 H LYS 101 5.103 1.429 -14.948 866 HA LYS 101 HA LYS 101 5.831 0.358 -17.497 867 HB2 LYS 101 2HB LYS 101 6.856 2.393 -16.516 868 HB3 LYS 101 3HB LYS 101 7.528 1.443 -15.197 869 HG2 LYS 101 2HG LYS 101 8.921 0.202 -16.917 870 HG3 LYS 101 3HG LYS 101 8.333 1.344 -18.132 871 HD2 LYS 101 2HD LYS 101 9.951 2.034 -15.641 872 HD3 LYS 101 3HD LYS 101 10.554 2.018 -17.299 873 HE2 LYS 101 2HE LYS 101 8.394 3.882 -16.238 874 HE3 LYS 101 3HE LYS 101 10.085 4.314 -16.467 875 HZ1 LYS 101 3HZ LYS 101 9.850 4.025 -18.813 876 HZ2 LYS 101 1HZ LYS 101 8.631 5.057 -18.275 877 HZ3 LYS 101 2HZ LYS 101 8.270 3.446 -18.651 878 H ASP 102 H ASP 102 6.406 -0.582 -14.135 879 HA ASP 102 HA ASP 102 7.962 -2.937 -14.911 880 HB2 ASP 102 2HB ASP 102 7.354 -1.695 -12.199 881 HB3 ASP 102 3HB ASP 102 8.316 -3.159 -12.411 882 H GLY 103 H GLY 103 4.773 -2.144 -13.703 883 HA2 GLY 103 2HA GLY 103 2.950 -3.606 -14.257 884 HA3 GLY 103 3HA GLY 103 3.998 -4.995 -14.017 885 H VAL 104 H VAL 104 2.529 -2.265 -12.347 886 HA VAL 104 HA VAL 104 1.984 -3.954 -9.978 887 HB VAL 104 HB VAL 104 2.707 -0.974 -9.843 888 HG11 VAL 104 1HG1 VAL 104 1.111 -1.665 -8.081 889 HG12 VAL 104 2HG1 VAL 104 2.693 -1.302 -7.389 890 HG13 VAL 104 3HG1 VAL 104 2.191 -2.982 -7.600 891 HG21 VAL 104 3HG2 VAL 104 4.356 -3.382 -8.995 892 HG22 VAL 104 1HG2 VAL 104 4.786 -1.686 -8.722 893 HG23 VAL 104 2HG2 VAL 104 4.701 -2.317 -10.370 894 H ASP 105 H ASP 105 -0.085 -3.920 -9.397 895 HA ASP 105 HA ASP 105 -2.071 -2.618 -10.988 896 HB2 ASP 105 2HB ASP 105 -2.270 -4.179 -8.380 897 HB3 ASP 105 3HB ASP 105 -3.645 -3.687 -9.369 898 H VAL 106 H VAL 106 -2.423 -0.506 -10.793 899 HA VAL 106 HA VAL 106 -1.976 0.918 -8.263 900 HB VAL 106 HB VAL 106 -2.156 3.003 -9.559 901 HG11 VAL 106 1HG1 VAL 106 -0.319 0.985 -10.898 902 HG12 VAL 106 2HG1 VAL 106 0.038 1.935 -9.453 903 HG13 VAL 106 3HG1 VAL 106 -0.162 2.741 -11.009 904 HG21 VAL 106 3HG2 VAL 106 -2.443 3.000 -12.028 905 HG22 VAL 106 1HG2 VAL 106 -3.870 2.363 -11.202 906 HG23 VAL 106 2HG2 VAL 106 -2.741 1.259 -11.990 907 H ARG 107 H ARG 107 -3.549 1.914 -7.155 908 HA ARG 107 HA ARG 107 -6.314 2.058 -8.184 909 HB2 ARG 107 2HB ARG 107 -5.482 1.452 -5.294 910 HB3 ARG 107 3HB ARG 107 -7.135 1.618 -5.877 911 HG2 ARG 107 2HG ARG 107 -5.194 -0.556 -6.739 912 HG3 ARG 107 3HG ARG 107 -6.449 -0.754 -5.516 913 HD2 ARG 107 2HD ARG 107 -8.194 -0.610 -7.121 914 HD3 ARG 107 3HD ARG 107 -7.141 0.117 -8.333 915 HE ARG 107 HE ARG 107 -6.200 -1.979 -8.796 916 HH11 ARG 107 1HH1 ARG 107 -8.785 -2.296 -6.431 917 HH12 ARG 107 2HH1 ARG 107 -8.960 -4.002 -6.682 918 HH21 ARG 107 1HH2 ARG 107 -6.465 -4.190 -9.136 919 HH22 ARG 107 2HH2 ARG 107 -7.644 -5.072 -8.219 920 H VAL 108 H VAL 108 -6.350 4.177 -8.677 921 HA VAL 108 HA VAL 108 -5.633 6.159 -6.602 922 HB VAL 108 HB VAL 108 -5.385 7.833 -8.501 923 HG11 VAL 108 1HG1 VAL 108 -3.435 5.489 -8.581 924 HG12 VAL 108 2HG1 VAL 108 -3.401 6.825 -7.428 925 HG13 VAL 108 3HG1 VAL 108 -3.098 7.134 -9.138 926 HG21 VAL 108 3HG2 VAL 108 -4.995 7.013 -10.821 927 HG22 VAL 108 1HG2 VAL 108 -6.637 6.653 -10.280 928 HG23 VAL 108 2HG2 VAL 108 -5.422 5.376 -10.314 929 H THR 109 H THR 109 -7.357 6.873 -5.657 930 HA THR 109 HA THR 109 -10.020 6.502 -6.839 931 HB THR 109 HB THR 109 -10.808 7.143 -4.519 932 HG1 THR 109 HG1 THR 109 -9.374 7.713 -3.023 933 HG21 THR 109 3HG2 THR 109 -8.791 4.865 -4.640 934 HG22 THR 109 1HG2 THR 109 -10.486 4.765 -5.122 935 HG23 THR 109 2HG2 THR 109 -10.064 5.050 -3.433 936 H ASP 110 H ASP 110 -7.718 9.015 -6.207 937 HA ASP 110 HA ASP 110 -7.593 11.221 -6.660 938 HB2 ASP 110 2HB ASP 110 -8.395 10.475 -8.896 939 HB3 ASP 110 3HB ASP 110 -10.056 10.652 -8.367 940 H ASN 111 H ASN 111 -9.210 10.166 -4.398 941 HA ASN 111 HA ASN 111 -10.287 12.606 -3.355 942 HB2 ASN 111 2HB ASN 111 -12.211 11.943 -4.735 943 HB3 ASN 111 3HB ASN 111 -12.204 10.333 -4.033 944 HD21 ASN 111 1HD2 ASN 111 -14.379 10.582 -3.388 945 HD22 ASN 111 2HD2 ASN 111 -14.830 11.564 -2.037 946 H GLU 112 H GLU 112 -10.452 12.535 -1.174 947 HA GLU 112 HA GLU 112 -8.759 10.742 0.196 948 HB2 GLU 112 2HB GLU 112 -9.451 12.095 2.220 949 HB3 GLU 112 3HB GLU 112 -8.845 13.043 0.867 950 HG2 GLU 112 2HG GLU 112 -11.306 13.432 0.225 951 HG3 GLU 112 3HG GLU 112 -11.718 12.756 1.797 952 H ASP 113 H ASP 113 -12.313 11.231 0.522 953 HA ASP 113 HA ASP 113 -12.637 9.093 2.426 954 HB2 ASP 113 2HB ASP 113 -15.082 9.564 2.225 955 HB3 ASP 113 3HB ASP 113 -14.134 11.006 2.571 956 H GLU 114 H GLU 114 -12.876 9.391 -1.064 957 HA GLU 114 HA GLU 114 -14.304 7.000 -1.585 958 HB2 GLU 114 2HB GLU 114 -14.048 8.821 -3.228 959 HB3 GLU 114 3HB GLU 114 -12.325 8.495 -3.351 960 HG2 GLU 114 2HG GLU 114 -13.668 7.614 -5.264 961 HG3 GLU 114 3HG GLU 114 -12.721 6.380 -4.427 962 H ALA 115 H ALA 115 -10.856 7.663 -1.061 963 HA ALA 115 HA ALA 115 -9.885 5.035 -1.635 964 HB1 ALA 115 3HB ALA 115 -7.863 5.732 -0.432 965 HB2 ALA 115 1HB ALA 115 -8.709 7.165 0.173 966 HB3 ALA 115 2HB ALA 115 -8.397 6.985 -1.553 967 H LYS 116 H LYS 116 -11.148 6.646 1.219 968 HA LYS 116 HA LYS 116 -10.624 4.724 3.182 969 HB2 LYS 116 2HB LYS 116 -11.336 7.091 3.568 970 HB3 LYS 116 3HB LYS 116 -12.939 6.687 2.961 971 HG2 LYS 116 2HG LYS 116 -12.863 4.875 4.899 972 HG3 LYS 116 3HG LYS 116 -11.636 5.958 5.566 973 HD2 LYS 116 2HD LYS 116 -13.267 7.827 5.512 974 HD3 LYS 116 3HD LYS 116 -14.480 6.743 4.819 975 HE2 LYS 116 2HE LYS 116 -14.120 5.285 6.923 976 HE3 LYS 116 3HE LYS 116 -13.285 6.685 7.598 977 HZ1 LYS 116 3HZ LYS 116 -16.106 6.552 6.711 978 HZ2 LYS 116 1HZ LYS 116 -15.335 7.964 7.216 979 HZ3 LYS 116 2HZ LYS 116 -15.539 6.684 8.296 980 H LYS 117 H LYS 117 -13.488 5.183 1.051 981 HA LYS 117 HA LYS 117 -15.085 3.021 1.887 982 HB2 LYS 117 2HB LYS 117 -14.823 4.036 -0.985 983 HB3 LYS 117 3HB LYS 117 -16.166 3.101 -0.330 984 HG2 LYS 117 2HG LYS 117 -16.724 5.072 1.136 985 HG3 LYS 117 3HG LYS 117 -15.450 5.982 0.306 986 HD2 LYS 117 2HD LYS 117 -16.661 5.389 -1.894 987 HD3 LYS 117 3HD LYS 117 -18.011 4.844 -0.890 988 HE2 LYS 117 2HE LYS 117 -18.482 7.082 -1.614 989 HE3 LYS 117 3HE LYS 117 -18.072 7.174 0.101 990 HZ1 LYS 117 3HZ LYS 117 -15.852 7.875 -0.502 991 HZ2 LYS 117 1HZ LYS 117 -17.000 8.911 -1.189 992 HZ3 LYS 117 2HZ LYS 117 -16.223 7.755 -2.147 993 H ARG 118 H ARG 118 -12.576 3.313 -0.578 994 HA ARG 118 HA ARG 118 -12.945 0.809 -1.799 995 HB2 ARG 118 2HB ARG 118 -11.830 2.933 -2.784 996 HB3 ARG 118 3HB ARG 118 -10.371 2.431 -1.943 997 HG2 ARG 118 2HG ARG 118 -10.058 1.580 -4.110 998 HG3 ARG 118 3HG ARG 118 -10.649 0.173 -3.224 999 HD2 ARG 118 2HD ARG 118 -12.257 1.966 -5.082 1000 HD3 ARG 118 3HD ARG 118 -11.736 0.319 -5.411 1001 HE ARG 118 HE ARG 118 -13.268 -0.371 -3.553 1002 HH11 ARG 118 1HH1 ARG 118 -13.902 2.641 -5.266 1003 HH12 ARG 118 2HH1 ARG 118 -15.600 2.625 -4.915 1004 HH21 ARG 118 1HH2 ARG 118 -15.533 -0.351 -3.093 1005 HH22 ARG 118 2HH2 ARG 118 -16.508 0.944 -3.697 1006 H LEU 119 H LEU 119 -10.922 1.864 0.899 1007 HA LEU 119 HA LEU 119 -9.164 -0.327 1.032 1008 HB2 LEU 119 2HB LEU 119 -10.162 1.592 3.157 1009 HB3 LEU 119 3HB LEU 119 -9.078 0.271 3.573 1010 HG LEU 119 HG LEU 119 -8.475 2.609 1.727 1011 HD11 LEU 119 1HD1 LEU 119 -6.739 3.125 3.368 1012 HD12 LEU 119 2HD1 LEU 119 -7.233 1.742 4.353 1013 HD13 LEU 119 3HD1 LEU 119 -8.335 3.105 4.119 1014 HD21 LEU 119 3HD2 LEU 119 -6.709 0.208 2.323 1015 HD22 LEU 119 1HD2 LEU 119 -6.255 1.635 1.390 1016 HD23 LEU 119 2HD2 LEU 119 -7.496 0.549 0.777 1017 H LYS 120 H LYS 120 -12.252 0.231 2.780 1018 HA LYS 120 HA LYS 120 -12.198 -2.280 4.101 1019 HB2 LYS 120 2HB LYS 120 -13.544 -0.318 4.900 1020 HB3 LYS 120 3HB LYS 120 -14.656 -0.559 3.549 1021 HG2 LYS 120 2HG LYS 120 -15.200 -2.823 4.399 1022 HG3 LYS 120 3HG LYS 120 -14.076 -2.586 5.743 1023 HD2 LYS 120 2HD LYS 120 -15.477 -0.720 6.578 1024 HD3 LYS 120 3HD LYS 120 -16.599 -0.962 5.231 1025 HE2 LYS 120 2HE LYS 120 -15.984 -2.949 7.447 1026 HE3 LYS 120 3HE LYS 120 -17.478 -2.032 7.241 1027 HZ1 LYS 120 3HZ LYS 120 -17.828 -3.203 5.130 1028 HZ2 LYS 120 1HZ LYS 120 -17.741 -4.272 6.430 1029 HZ3 LYS 120 2HZ LYS 120 -16.425 -4.107 5.392 1030 H GLU 121 H GLU 121 -13.684 -1.153 1.094 1031 HA GLU 121 HA GLU 121 -15.148 -3.337 0.215 1032 HB2 GLU 121 2HB GLU 121 -15.071 -1.169 -0.964 1033 HB3 GLU 121 3HB GLU 121 -13.380 -1.422 -1.366 1034 HG2 GLU 121 2HG GLU 121 -14.578 -1.868 -3.359 1035 HG3 GLU 121 3HG GLU 121 -14.108 -3.443 -2.730 1036 H LEU 122 H LEU 122 -11.688 -2.666 -0.270 1037 HA LEU 122 HA LEU 122 -11.125 -5.066 -1.736 1038 HB2 LEU 122 2HB LEU 122 -9.308 -2.948 -0.520 1039 HB3 LEU 122 3HB LEU 122 -8.732 -4.277 -1.513 1040 HG LEU 122 HG LEU 122 -10.535 -1.989 -2.405 1041 HD11 LEU 122 1HD1 LEU 122 -8.718 -1.389 -3.919 1042 HD12 LEU 122 2HD1 LEU 122 -7.740 -2.727 -3.306 1043 HD13 LEU 122 3HD1 LEU 122 -8.174 -1.387 -2.241 1044 HD21 LEU 122 3HD2 LEU 122 -11.334 -4.000 -3.518 1045 HD22 LEU 122 1HD2 LEU 122 -9.698 -4.399 -4.051 1046 HD23 LEU 122 2HD2 LEU 122 -10.510 -2.958 -4.672 1047 H LEU 123 H LEU 123 -10.996 -4.109 1.631 1048 HA LEU 123 HA LEU 123 -9.478 -6.287 2.660 1049 HB2 LEU 123 2HB LEU 123 -11.120 -4.084 3.799 1050 HB3 LEU 123 3HB LEU 123 -11.158 -5.544 4.768 1051 HG LEU 123 HG LEU 123 -8.698 -5.500 4.994 1052 HD11 LEU 123 1HD1 LEU 123 -7.361 -3.577 4.259 1053 HD12 LEU 123 2HD1 LEU 123 -8.760 -2.921 3.406 1054 HD13 LEU 123 3HD1 LEU 123 -8.051 -4.451 2.889 1055 HD21 LEU 123 3HD2 LEU 123 -8.581 -3.544 6.470 1056 HD22 LEU 123 1HD2 LEU 123 -10.103 -4.411 6.660 1057 HD23 LEU 123 2HD2 LEU 123 -10.054 -2.901 5.745 1058 H GLU 124 H GLU 124 -12.925 -5.839 1.942 1059 HA GLU 124 HA GLU 124 -13.977 -8.113 3.195 1060 HB2 GLU 124 2HB GLU 124 -14.955 -6.866 0.586 1061 HB3 GLU 124 3HB GLU 124 -15.880 -7.959 1.610 1062 HG2 GLU 124 2HG GLU 124 -15.050 -5.120 2.209 1063 HG3 GLU 124 3HG GLU 124 -16.679 -5.721 1.944 1064 H LYS 125 H LYS 125 -11.937 -7.884 0.421 1065 HA LYS 125 HA LYS 125 -12.444 -10.693 -0.363 1066 HB2 LYS 125 2HB LYS 125 -13.678 -8.865 -1.732 1067 HB3 LYS 125 3HB LYS 125 -12.099 -8.426 -2.369 1068 HG2 LYS 125 2HG LYS 125 -11.874 -10.483 -3.538 1069 HG3 LYS 125 3HG LYS 125 -13.153 -11.258 -2.601 1070 HD2 LYS 125 2HD LYS 125 -13.577 -8.982 -4.578 1071 HD3 LYS 125 3HD LYS 125 -13.868 -10.687 -4.921 1072 HE2 LYS 125 2HE LYS 125 -15.622 -10.760 -3.203 1073 HE3 LYS 125 3HE LYS 125 -15.299 -9.082 -2.770 1074 HZ1 LYS 125 3HZ LYS 125 -16.019 -8.410 -4.962 1075 HZ2 LYS 125 1HZ LYS 125 -17.230 -9.305 -4.197 1076 HZ3 LYS 125 2HZ LYS 125 -16.293 -10.014 -5.406 1077 H VAL 126 H VAL 126 -10.295 -9.121 1.118 1078 HA VAL 126 HA VAL 126 -8.067 -9.065 1.453 1079 HB VAL 126 HB VAL 126 -7.985 -11.620 -0.214 1080 HG11 VAL 126 1HG1 VAL 126 -5.961 -12.198 1.111 1081 HG12 VAL 126 2HG1 VAL 126 -6.038 -10.627 1.913 1082 HG13 VAL 126 3HG1 VAL 126 -5.722 -10.716 0.178 1083 HG21 VAL 126 3HG2 VAL 126 -9.655 -11.808 1.584 1084 HG22 VAL 126 1HG2 VAL 126 -8.452 -11.313 2.779 1085 HG23 VAL 126 2HG2 VAL 126 -8.266 -12.844 1.916 1086 H GLY 127 H GLY 127 -7.788 -7.117 0.256 1087 HA2 GLY 127 2HA GLY 127 -6.385 -5.819 -1.013 1088 HA3 GLY 127 3HA GLY 127 -5.662 -7.274 -1.668 1089 H SER 128 H SER 128 -6.940 -8.417 -3.357 1090 HA SER 128 HA SER 128 -9.192 -7.331 -4.672 1091 HB2 SER 128 2HB SER 128 -7.512 -5.604 -5.442 1092 HB3 SER 128 3HB SER 128 -6.542 -6.890 -6.158 1093 HG SER 128 HG SER 128 -8.336 -7.357 -7.522 1094 H LEU 129 H LEU 129 -10.083 -9.280 -5.202 1095 HA LEU 129 HA LEU 129 -8.532 -11.645 -5.628 1096 HB2 LEU 129 2HB LEU 129 -10.846 -11.670 -4.663 1097 HB3 LEU 129 3HB LEU 129 -11.484 -11.194 -6.230 1098 HG LEU 129 HG LEU 129 -10.567 -13.348 -7.197 1099 HD11 LEU 129 1HD1 LEU 129 -8.787 -13.782 -5.584 1100 HD12 LEU 129 2HD1 LEU 129 -9.888 -15.153 -5.673 1101 HD13 LEU 129 3HD1 LEU 129 -9.974 -14.042 -4.302 1102 HD21 LEU 129 3HD2 LEU 129 -12.538 -13.693 -4.916 1103 HD22 LEU 129 1HD2 LEU 129 -12.318 -14.793 -6.280 1104 HD23 LEU 129 2HD2 LEU 129 -12.928 -13.163 -6.553 1105 H GLU 130 H GLU 130 -10.930 -10.214 -7.881 1106 HA GLU 130 HA GLU 130 -9.202 -9.944 -10.121 1107 HB2 GLU 130 2HB GLU 130 -10.084 -11.817 -11.522 1108 HB3 GLU 130 3HB GLU 130 -9.178 -12.392 -10.128 1109 HG2 GLU 130 2HG GLU 130 -11.290 -12.909 -8.955 1110 HG3 GLU 130 3HG GLU 130 -12.207 -12.313 -10.339 1111 H HIS 131 H HIS 131 -10.853 -10.118 -12.232 1112 HA HIS 131 HA HIS 131 -12.607 -9.309 -13.383 1113 HB2 HIS 131 2HB HIS 131 -13.740 -11.126 -12.087 1114 HB3 HIS 131 3HB HIS 131 -14.177 -9.956 -10.849 1115 HD1 HIS 131 HD1 HIS 131 -16.321 -8.675 -11.213 1116 HD2 HIS 131 HD2 HIS 131 -15.065 -10.681 -14.627 1117 HE1 HIS 131 HE1 HIS 131 -18.209 -8.475 -12.857 1118 HE2 HIS 131 HE2 HIS 131 -17.506 -9.895 -14.806 1119 H HIS 132 H HIS 132 -11.824 -7.219 -13.544 1120 HA HIS 132 HA HIS 132 -11.935 -5.206 -11.606 1121 HB2 HIS 132 2HB HIS 132 -11.336 -3.652 -13.408 1122 HB3 HIS 132 3HB HIS 132 -10.431 -5.147 -13.588 1123 HD1 HIS 132 HD1 HIS 132 -12.397 -2.806 -15.497 1124 HD2 HIS 132 HD2 HIS 132 -11.689 -6.897 -15.703 1125 HE1 HIS 132 HE1 HIS 132 -13.048 -3.499 -17.821 1126 HE2 HIS 132 HE2 HIS 132 -12.429 -5.923 -17.967 1127 H HIS 133 H HIS 133 -13.633 -4.146 -10.790 1128 HA HIS 133 HA HIS 133 -16.234 -4.104 -12.072 1129 HB2 HIS 133 2HB HIS 133 -15.237 -2.808 -9.494 1130 HB3 HIS 133 3HB HIS 133 -16.897 -2.687 -10.072 1131 HD1 HIS 133 HD1 HIS 133 -14.952 -4.587 -7.805 1132 HD2 HIS 133 HD2 HIS 133 -18.020 -5.505 -10.449 1133 HE1 HIS 133 HE1 HIS 133 -15.919 -6.746 -6.996 1134 HE2 HIS 133 HE2 HIS 133 -17.636 -7.368 -8.710 1135 H HIS 134 H HIS 134 -14.446 -1.344 -10.654 1136 HA HIS 134 HA HIS 134 -14.081 0.798 -11.300 1137 HB2 HIS 134 2HB HIS 134 -12.481 -0.544 -12.737 1138 HB3 HIS 134 3HB HIS 134 -13.656 -0.490 -14.035 1139 HD1 HIS 134 HD1 HIS 134 -10.823 1.299 -12.621 1140 HD2 HIS 134 HD2 HIS 134 -13.994 2.195 -15.144 1141 HE1 HIS 134 HE1 HIS 134 -10.111 3.328 -13.905 1142 HE2 HIS 134 HE2 HIS 134 -11.950 3.687 -15.577 1143 H HIS 135 H HIS 135 -16.639 0.537 -10.947 1144 HA HIS 135 HA HIS 135 -18.297 1.131 -13.213 1145 HB2 HIS 135 2HB HIS 135 -19.180 -0.032 -11.184 1146 HB3 HIS 135 3HB HIS 135 -18.949 1.435 -10.244 1147 HD1 HIS 135 HD1 HIS 135 -21.026 0.081 -13.115 1148 HD2 HIS 135 HD2 HIS 135 -21.031 3.268 -10.441 1149 HE1 HIS 135 HE1 HIS 135 -23.228 1.246 -13.446 1150 HE2 HIS 135 HE2 HIS 135 -23.097 3.280 -11.980 1151 H HIS 136 H HIS 136 -17.401 2.891 -14.199 1152 HA HIS 136 HA HIS 136 -17.523 5.502 -12.809 1153 HB2 HIS 136 2HB HIS 136 -15.170 4.807 -13.268 1154 HB3 HIS 136 3HB HIS 136 -15.550 4.651 -14.982 1155 HD1 HIS 136 HD1 HIS 136 -14.763 6.633 -16.260 1156 HD2 HIS 136 HD2 HIS 136 -15.905 7.668 -12.399 1157 HE1 HIS 136 HE1 HIS 136 -14.425 9.110 -16.092 1158 HE2 HIS 136 HE2 HIS 136 -15.036 9.696 -13.729
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