NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
8674 | 1mot | 5607 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ALA 249 1HT ALA 249 4.412 -10.440 -12.454 2 2H ALA 249 2HT ALA 249 3.649 -9.185 -13.286 3 3H ALA 249 3HT ALA 249 2.756 -10.168 -12.235 4 HA ALA 249 HA ALA 249 4.878 -9.138 -10.771 5 1HB ALA 249 1HB ALA 249 3.739 -6.669 -11.146 6 2HB ALA 249 2HB ALA 249 3.906 -7.289 -12.790 7 3HB ALA 249 3HB ALA 249 5.318 -7.185 -11.737 8 HA PRO 250 HA PRO 250 1.638 -9.302 -7.799 9 1HB PRO 250 2HB PRO 250 2.995 -7.124 -6.335 10 2HB PRO 250 1HB PRO 250 2.707 -8.796 -5.844 11 1HG PRO 250 2HG PRO 250 5.153 -7.972 -6.462 12 2HG PRO 250 1HG PRO 250 4.585 -9.579 -6.967 13 1HD PRO 250 2HD PRO 250 4.688 -7.034 -8.559 14 2HD PRO 250 1HD PRO 250 5.266 -8.655 -9.006 15 H ALA 251 H ALA 251 -0.256 -8.500 -8.586 16 HA ALA 251 HA ALA 251 -0.740 -5.862 -9.407 17 1HB ALA 251 1HB ALA 251 -2.832 -7.753 -8.363 18 2HB ALA 251 2HB ALA 251 -2.104 -7.897 -9.963 19 3HB ALA 251 3HB ALA 251 -3.033 -6.457 -9.541 20 H ARG 252 H ARG 252 -1.314 -7.439 -6.289 21 HA ARG 252 HA ARG 252 -2.673 -5.344 -5.019 22 1HB ARG 252 2HB ARG 252 -2.069 -7.864 -4.335 23 2HB ARG 252 1HB ARG 252 -0.827 -7.031 -3.413 24 1HG ARG 252 2HG ARG 252 -3.789 -6.516 -3.216 25 2HG ARG 252 1HG ARG 252 -2.834 -7.475 -2.085 26 1HD ARG 252 2HD ARG 252 -1.495 -5.495 -1.550 27 2HD ARG 252 1HD ARG 252 -2.455 -4.541 -2.680 28 HE ARG 252 HE ARG 252 -4.122 -5.774 -0.757 29 1HH1 ARG 252 1HH1 ARG 252 -1.882 -3.182 -1.174 30 2HH1 ARG 252 2HH1 ARG 252 -2.541 -2.240 0.115 31 1HH2 ARG 252 1HH2 ARG 252 -4.992 -4.552 0.919 32 2HH2 ARG 252 2HH2 ARG 252 -4.302 -3.015 1.298 33 H VAL 253 H VAL 253 0.792 -6.087 -5.181 34 HA VAL 253 HA VAL 253 1.658 -3.968 -3.527 35 HB VAL 253 HB VAL 253 3.144 -5.447 -5.701 36 1HG1 VAL 253 1HG1 VAL 253 3.895 -3.127 -4.169 37 2HG1 VAL 253 2HG1 VAL 253 4.769 -3.946 -5.464 38 3HG1 VAL 253 3HG1 VAL 253 4.952 -4.488 -3.796 39 1HG2 VAL 253 1HG2 VAL 253 4.013 -6.025 -3.044 40 2HG2 VAL 253 2HG2 VAL 253 3.324 -7.115 -4.248 41 3HG2 VAL 253 3HG2 VAL 253 2.265 -6.240 -3.141 42 H GLY 254 H GLY 254 1.416 -4.276 -7.061 43 1HA GLY 254 2HA GLY 254 2.380 -1.733 -7.759 44 2HA GLY 254 1HA GLY 254 1.254 -2.686 -8.718 45 H LEU 255 H LEU 255 -0.953 -2.805 -7.140 46 HA LEU 255 HA LEU 255 -2.208 -0.318 -7.554 47 1HB LEU 255 2HB LEU 255 -2.902 -2.886 -6.298 48 2HB LEU 255 1HB LEU 255 -3.789 -1.498 -5.695 49 HG LEU 255 HG LEU 255 -3.648 -2.387 -8.571 50 1HD1 LEU 255 1HD1 LEU 255 -6.272 -2.315 -7.535 51 2HD1 LEU 255 2HD1 LEU 255 -5.275 -3.201 -6.379 52 3HD1 LEU 255 3HD1 LEU 255 -5.345 -3.719 -8.064 53 1HD2 LEU 255 1HD2 LEU 255 -4.894 -0.017 -7.216 54 2HD2 LEU 255 2HD2 LEU 255 -5.514 -0.640 -8.745 55 3HD2 LEU 255 3HD2 LEU 255 -3.853 -0.056 -8.639 56 H GLY 256 H GLY 256 -0.951 -1.871 -4.631 57 1HA GLY 256 2HA GLY 256 -1.752 0.087 -2.796 58 2HA GLY 256 1HA GLY 256 -0.428 -1.042 -2.568 59 H ILE 257 H ILE 257 1.463 -0.299 -4.380 60 HA ILE 257 HA ILE 257 2.531 2.037 -3.203 61 HB ILE 257 HB ILE 257 4.305 1.964 -4.898 62 1HG1 ILE 257 2HG1 ILE 257 4.056 -0.372 -6.277 63 2HG1 ILE 257 1HG1 ILE 257 2.389 0.193 -6.281 64 1HG2 ILE 257 1HG2 ILE 257 4.372 0.556 -2.876 65 2HG2 ILE 257 2HG2 ILE 257 5.261 -0.139 -4.233 66 3HG2 ILE 257 3HG2 ILE 257 3.669 -0.768 -3.805 67 1HD1 ILE 257 1HD1 ILE 257 4.644 1.981 -7.111 68 2HD1 ILE 257 2HD1 ILE 257 2.925 2.118 -7.480 69 3HD1 ILE 257 3HD1 ILE 257 3.891 0.851 -8.236 70 H THR 258 H THR 258 0.758 1.530 -6.226 71 HA THR 258 HA THR 258 1.114 4.135 -7.285 72 HB THR 258 HB THR 258 -1.241 2.266 -7.672 73 HG1 THR 258 1HG THR 258 0.540 1.216 -8.440 74 1HG2 THR 258 1HG2 THR 258 -1.991 3.594 -9.378 75 2HG2 THR 258 2HG2 THR 258 -0.387 4.239 -9.729 76 3HG2 THR 258 3HG2 THR 258 -1.294 4.837 -8.340 77 H THR 259 H THR 259 -1.326 2.725 -5.143 78 HA THR 259 HA THR 259 -3.002 4.989 -4.931 79 HB THR 259 HB THR 259 -2.538 2.837 -2.847 80 HG1 THR 259 1HG THR 259 -3.230 1.876 -4.766 81 1HG2 THR 259 1HG2 THR 259 -5.196 3.707 -2.810 82 2HG2 THR 259 2HG2 THR 259 -4.226 5.177 -2.904 83 3HG2 THR 259 3HG2 THR 259 -3.956 4.023 -1.597 84 H VAL 260 H VAL 260 -0.325 3.825 -2.884 85 HA VAL 260 HA VAL 260 -0.365 5.910 -1.003 86 HB VAL 260 HB VAL 260 1.987 4.259 -1.953 87 1HG1 VAL 260 1HG1 VAL 260 1.890 6.515 -0.191 88 2HG1 VAL 260 2HG1 VAL 260 3.279 5.553 -0.695 89 3HG1 VAL 260 3HG1 VAL 260 2.337 5.069 0.715 90 1HG2 VAL 260 1HG2 VAL 260 0.221 2.886 -1.038 91 2HG2 VAL 260 2HG2 VAL 260 0.111 3.921 0.385 92 3HG2 VAL 260 3HG2 VAL 260 1.563 2.959 0.104 93 H LEU 261 H LEU 261 1.537 5.551 -4.005 94 HA LEU 261 HA LEU 261 2.921 7.988 -3.890 95 1HB LEU 261 2HB LEU 261 3.333 6.091 -5.479 96 2HB LEU 261 1HB LEU 261 1.936 6.634 -6.393 97 HG LEU 261 HG LEU 261 3.024 8.758 -6.864 98 1HD1 LEU 261 1HD1 LEU 261 4.294 9.047 -4.836 99 2HD1 LEU 261 2HD1 LEU 261 5.389 9.093 -6.217 100 3HD1 LEU 261 3HD1 LEU 261 5.290 7.643 -5.216 101 1HD2 LEU 261 1HD2 LEU 261 4.051 6.169 -7.667 102 2HD2 LEU 261 2HD2 LEU 261 5.262 7.445 -7.810 103 3HD2 LEU 261 3HD2 LEU 261 3.712 7.603 -8.637 104 H THR 262 H THR 262 -0.276 7.188 -5.149 105 HA THR 262 HA THR 262 -0.891 9.708 -6.289 106 HB THR 262 HB THR 262 -2.761 7.618 -5.137 107 HG1 THR 262 1HG THR 262 -1.575 6.758 -6.847 108 1HG2 THR 262 1HG2 THR 262 -3.416 9.746 -7.164 109 2HG2 THR 262 2HG2 THR 262 -3.722 9.930 -5.438 110 3HG2 THR 262 3HG2 THR 262 -4.526 8.648 -6.345 111 H MET 263 H MET 263 -1.636 8.287 -3.117 112 HA MET 263 HA MET 263 -3.027 10.489 -2.060 113 1HB MET 263 2HB MET 263 -1.473 8.320 -0.651 114 2HB MET 263 1HB MET 263 -2.528 9.467 0.162 115 1HG MET 263 2HG MET 263 -3.350 7.442 -1.906 116 2HG MET 263 1HG MET 263 -3.656 7.357 -0.173 117 1HE MET 263 1HE MET 263 -4.967 10.758 0.280 118 2HE MET 263 2HE MET 263 -4.619 9.222 1.073 119 3HE MET 263 3HE MET 263 -6.283 9.655 0.681 120 H THR 264 H THR 264 0.442 9.633 -1.765 121 HA THR 264 HA THR 264 0.974 11.991 -0.190 122 HB THR 264 HB THR 264 2.340 10.035 0.214 123 HG1 THR 264 1HG THR 264 3.834 12.165 -0.964 124 1HG2 THR 264 1HG2 THR 264 2.349 9.093 -2.063 125 2HG2 THR 264 2HG2 THR 264 3.976 9.216 -1.394 126 3HG2 THR 264 3HG2 THR 264 3.421 10.392 -2.586 127 H THR 265 H THR 265 -0.227 13.066 -2.254 128 HA THR 265 HA THR 265 1.306 13.729 -4.514 129 HB THR 265 HB THR 265 -0.978 14.191 -4.727 130 HG1 THR 265 1HG THR 265 0.117 15.843 -5.751 131 1HG2 THR 265 1HG2 THR 265 -2.083 15.939 -3.201 132 2HG2 THR 265 2HG2 THR 265 -0.719 15.659 -2.118 133 3HG2 THR 265 3HG2 THR 265 -1.799 14.329 -2.537 134 H GLN 266 H GLN 266 0.919 15.503 -1.452 135 HA GLN 266 HA GLN 266 2.210 17.034 -0.389 136 1HB GLN 266 2HB GLN 266 4.297 16.298 -2.442 137 2HB GLN 266 1HB GLN 266 4.588 17.291 -1.021 138 1HG GLN 266 2HG GLN 266 4.028 15.424 0.426 139 2HG GLN 266 1HG GLN 266 3.665 14.426 -0.980 140 1HE2 GLN 266 1HE2 GLN 266 6.206 16.390 -1.756 141 2HE2 GLN 266 2HE2 GLN 266 7.507 15.318 -1.389 142 H SER 267 H SER 267 2.515 17.341 -3.912 143 HA SER 267 HA SER 267 2.889 20.168 -3.888 144 1HB SER 267 2HB SER 267 3.639 18.838 -5.787 145 2HB SER 267 1HB SER 267 1.981 18.344 -6.126 146 HG SER 267 HG SER 267 1.920 20.954 -6.047 147 H SER 268 H SER 268 0.109 18.152 -3.673 148 HA SER 268 HA SER 268 -2.104 18.570 -3.400 149 1HB SER 268 2HB SER 268 -1.443 20.272 -1.788 150 2HB SER 268 1HB SER 268 -1.206 21.444 -3.084 151 HG SER 268 HG SER 268 -3.473 21.168 -3.563 152 H GLY 269 H GLY 269 -1.354 18.187 -5.959 153 1HA GLY 269 2HA GLY 269 -3.322 19.818 -7.391 154 2HA GLY 269 1HA GLY 269 -1.682 19.805 -8.020 155 H SER 270 H SER 270 -3.759 17.254 -6.676 156 HA SER 270 HA SER 270 -4.558 15.291 -7.483 157 1HB SER 270 2HB SER 270 -3.888 16.441 -10.201 158 2HB SER 270 1HB SER 270 -4.812 14.964 -9.927 159 HG SER 270 HG SER 270 -5.942 17.129 -10.223 160 H ARG 271 H ARG 271 -1.642 16.187 -9.326 161 HA ARG 271 HA ARG 271 -0.701 13.435 -9.289 162 1HB ARG 271 2HB ARG 271 0.571 15.955 -10.379 163 2HB ARG 271 1HB ARG 271 1.271 14.351 -10.515 164 1HG ARG 271 2HG ARG 271 0.291 14.650 -12.575 165 2HG ARG 271 1HG ARG 271 -0.945 13.744 -11.701 166 1HD ARG 271 2HD ARG 271 -1.852 15.641 -13.012 167 2HD ARG 271 1HD ARG 271 -2.205 15.746 -11.291 168 HE ARG 271 HE ARG 271 -1.112 17.734 -11.276 169 1HH1 ARG 271 1HH1 ARG 271 0.152 15.924 -13.973 170 2HH1 ARG 271 2HH1 ARG 271 1.213 17.215 -14.474 171 1HH2 ARG 271 1HH2 ARG 271 0.271 19.374 -11.983 172 2HH2 ARG 271 2HH2 ARG 271 1.267 19.105 -13.378 173 H ALA 272 H ALA 272 1.304 12.785 -8.352 174 HA ALA 272 HA ALA 272 1.830 13.989 -5.795 175 1HB ALA 272 1HB ALA 272 1.914 11.544 -6.169 176 2HB ALA 272 2HB ALA 272 3.408 12.180 -5.479 177 3HB ALA 272 3HB ALA 272 3.331 11.774 -7.194 178 H SER 273 H SER 273 4.807 12.970 -6.784 179 HA SER 273 HA SER 273 5.790 15.688 -7.017 180 1HB SER 273 2HB SER 273 8.028 14.556 -7.201 181 2HB SER 273 1HB SER 273 7.147 14.242 -5.707 182 HG SER 273 HG SER 273 7.764 12.529 -7.816 183 H LEU 274 H LEU 274 4.192 15.432 -9.018 184 HA LEU 274 HA LEU 274 6.026 15.334 -11.307 185 1HB LEU 274 2HB LEU 274 4.447 13.368 -11.265 186 2HB LEU 274 1HB LEU 274 3.125 14.507 -11.428 187 HG LEU 274 HG LEU 274 4.061 15.249 -13.600 188 1HD1 LEU 274 1HD1 LEU 274 6.401 14.700 -13.186 189 2HD1 LEU 274 2HD1 LEU 274 5.816 13.931 -14.662 190 3HD1 LEU 274 3HD1 LEU 274 6.005 12.981 -13.188 191 1HD2 LEU 274 1HD2 LEU 274 3.020 12.578 -13.006 192 2HD2 LEU 274 2HD2 LEU 274 3.827 12.714 -14.568 193 3HD2 LEU 274 3HD2 LEU 274 2.475 13.776 -14.180 194 HA PRO 275 HA PRO 275 3.481 19.388 -10.554 195 1HB PRO 275 2HB PRO 275 6.245 20.467 -10.296 196 2HB PRO 275 1HB PRO 275 4.777 20.890 -9.403 197 1HG PRO 275 2HG PRO 275 6.580 19.410 -8.211 198 2HG PRO 275 1HG PRO 275 4.866 18.948 -8.106 199 1HD PRO 275 2HD PRO 275 6.998 17.831 -9.906 200 2HD PRO 275 1HD PRO 275 5.840 16.952 -8.871 201 H LYS 276 H LYS 276 3.702 18.323 -13.028 202 HA LYS 276 HA LYS 276 4.164 20.605 -14.701 203 1HB LYS 276 2HB LYS 276 5.814 19.523 -16.202 204 2HB LYS 276 1HB LYS 276 6.466 19.855 -14.604 205 1HG LYS 276 2HG LYS 276 6.621 17.643 -14.052 206 2HG LYS 276 1HG LYS 276 5.297 17.171 -15.118 207 1HD LYS 276 2HD LYS 276 7.810 18.241 -16.316 208 2HD LYS 276 1HD LYS 276 7.790 16.583 -15.714 209 1HE LYS 276 2HE LYS 276 7.252 16.599 -18.071 210 2HE LYS 276 1HE LYS 276 5.835 16.116 -17.143 211 1HZ LYS 276 1HZ LYS 276 6.266 18.899 -18.068 212 2HZ LYS 276 2HZ LYS 276 4.827 18.215 -17.474 213 3HZ LYS 276 3HZ LYS 276 5.440 17.746 -18.989 Start of MODEL 2 1 1H ALA 249 1HT ALA 249 3.513 -11.846 3.890 2 2H ALA 249 2HT ALA 249 3.321 -13.217 2.919 3 3H ALA 249 3HT ALA 249 1.972 -12.281 3.329 4 HA ALA 249 HA ALA 249 3.942 -10.672 2.096 5 1HB ALA 249 1HB ALA 249 4.795 -12.266 0.739 6 2HB ALA 249 2HB ALA 249 3.366 -11.874 -0.215 7 3HB ALA 249 3HB ALA 249 3.356 -13.283 0.843 8 HA PRO 250 HA PRO 250 0.158 -8.622 1.091 9 1HB PRO 250 2HB PRO 250 0.988 -6.960 -0.872 10 2HB PRO 250 1HB PRO 250 1.479 -6.770 0.811 11 1HG PRO 250 2HG PRO 250 2.988 -7.896 -1.489 12 2HG PRO 250 1HG PRO 250 3.560 -6.896 -0.141 13 1HD PRO 250 2HD PRO 250 3.840 -9.629 -0.308 14 2HD PRO 250 1HD PRO 250 3.895 -8.695 1.194 15 H ALA 251 H ALA 251 -0.321 -7.566 -1.623 16 HA ALA 251 HA ALA 251 -0.697 -9.928 -3.299 17 1HB ALA 251 1HB ALA 251 -2.891 -10.221 -2.990 18 2HB ALA 251 2HB ALA 251 -3.212 -8.493 -3.121 19 3HB ALA 251 3HB ALA 251 -2.738 -9.185 -1.571 20 H ARG 252 H ARG 252 -2.215 -6.700 -3.148 21 HA ARG 252 HA ARG 252 -1.431 -6.290 -5.919 22 1HB ARG 252 2HB ARG 252 -3.488 -5.020 -4.166 23 2HB ARG 252 1HB ARG 252 -2.942 -4.203 -5.629 24 1HG ARG 252 2HG ARG 252 -4.409 -6.793 -5.351 25 2HG ARG 252 1HG ARG 252 -4.793 -5.391 -6.353 26 1HD ARG 252 2HD ARG 252 -2.874 -5.869 -7.789 27 2HD ARG 252 1HD ARG 252 -2.431 -7.234 -6.766 28 HE ARG 252 HE ARG 252 -5.072 -7.580 -7.698 29 1HH1 ARG 252 1HH1 ARG 252 -1.815 -7.632 -8.864 30 2HH1 ARG 252 2HH1 ARG 252 -2.149 -8.781 -10.108 31 1HH2 ARG 252 1HH2 ARG 252 -5.508 -9.086 -9.326 32 2HH2 ARG 252 2HH2 ARG 252 -4.232 -9.602 -10.370 33 H VAL 253 H VAL 253 0.769 -6.132 -5.058 34 HA VAL 253 HA VAL 253 1.780 -4.028 -3.562 35 HB VAL 253 HB VAL 253 3.173 -5.210 -5.950 36 1HG1 VAL 253 1HG1 VAL 253 4.092 -3.266 -4.488 37 2HG1 VAL 253 2HG1 VAL 253 5.149 -4.600 -4.949 38 3HG1 VAL 253 3HG1 VAL 253 4.442 -4.553 -3.334 39 1HG2 VAL 253 1HG2 VAL 253 3.630 -6.525 -3.382 40 2HG2 VAL 253 2HG2 VAL 253 3.368 -7.218 -4.983 41 3HG2 VAL 253 3HG2 VAL 253 1.990 -6.721 -4.001 42 H GLY 254 H GLY 254 1.422 -4.228 -7.098 43 1HA GLY 254 2HA GLY 254 2.386 -1.673 -7.736 44 2HA GLY 254 1HA GLY 254 1.275 -2.610 -8.724 45 H LEU 255 H LEU 255 -0.940 -2.752 -7.102 46 HA LEU 255 HA LEU 255 -2.200 -0.266 -7.523 47 1HB LEU 255 2HB LEU 255 -2.908 -2.842 -6.326 48 2HB LEU 255 1HB LEU 255 -3.753 -1.471 -5.632 49 HG LEU 255 HG LEU 255 -3.737 -2.259 -8.542 50 1HD1 LEU 255 1HD1 LEU 255 -6.117 -2.704 -8.153 51 2HD1 LEU 255 2HD1 LEU 255 -5.895 -2.351 -6.439 52 3HD1 LEU 255 3HD1 LEU 255 -5.083 -3.737 -7.167 53 1HD2 LEU 255 1HD2 LEU 255 -4.707 -0.306 -9.072 54 2HD2 LEU 255 2HD2 LEU 255 -3.967 0.275 -7.581 55 3HD2 LEU 255 3HD2 LEU 255 -5.648 -0.254 -7.582 56 H GLY 256 H GLY 256 -0.939 -1.820 -4.590 57 1HA GLY 256 2HA GLY 256 -1.741 0.158 -2.770 58 2HA GLY 256 1HA GLY 256 -0.427 -0.982 -2.532 59 H ILE 257 H ILE 257 1.442 -0.270 -4.384 60 HA ILE 257 HA ILE 257 2.533 2.067 -3.217 61 HB ILE 257 HB ILE 257 4.324 1.948 -4.874 62 1HG1 ILE 257 2HG1 ILE 257 4.082 -0.339 -6.306 63 2HG1 ILE 257 1HG1 ILE 257 2.408 0.201 -6.296 64 1HG2 ILE 257 1HG2 ILE 257 4.423 -0.820 -4.377 65 2HG2 ILE 257 2HG2 ILE 257 3.565 -0.075 -3.029 66 3HG2 ILE 257 3HG2 ILE 257 5.179 0.487 -3.463 67 1HD1 ILE 257 1HD1 ILE 257 3.038 2.303 -7.287 68 2HD1 ILE 257 2HD1 ILE 257 3.647 0.962 -8.262 69 3HD1 ILE 257 3HD1 ILE 257 4.740 1.854 -7.212 70 H THR 258 H THR 258 0.704 1.531 -6.182 71 HA THR 258 HA THR 258 1.084 4.121 -7.294 72 HB THR 258 HB THR 258 -1.253 2.226 -7.667 73 HG1 THR 258 1HG THR 258 0.519 1.193 -8.464 74 1HG2 THR 258 1HG2 THR 258 -0.876 3.753 -9.974 75 2HG2 THR 258 2HG2 THR 258 -0.765 4.904 -8.640 76 3HG2 THR 258 3HG2 THR 258 -2.198 3.890 -8.817 77 H THR 259 H THR 259 -1.337 2.705 -5.121 78 HA THR 259 HA THR 259 -3.033 4.968 -4.927 79 HB THR 259 HB THR 259 -2.577 2.804 -2.850 80 HG1 THR 259 1HG THR 259 -3.284 1.903 -4.817 81 1HG2 THR 259 1HG2 THR 259 -3.751 4.907 -2.091 82 2HG2 THR 259 2HG2 THR 259 -4.675 3.416 -1.912 83 3HG2 THR 259 3HG2 THR 259 -5.025 4.516 -3.246 84 H VAL 260 H VAL 260 -0.370 3.795 -2.868 85 HA VAL 260 HA VAL 260 -0.412 5.900 -1.001 86 HB VAL 260 HB VAL 260 1.918 4.200 -1.914 87 1HG1 VAL 260 1HG1 VAL 260 1.889 5.524 0.743 88 2HG1 VAL 260 2HG1 VAL 260 2.288 6.508 -0.667 89 3HG1 VAL 260 3HG1 VAL 260 3.250 5.078 -0.288 90 1HG2 VAL 260 1HG2 VAL 260 1.136 2.590 -0.593 91 2HG2 VAL 260 2HG2 VAL 260 -0.354 3.522 -0.448 92 3HG2 VAL 260 3HG2 VAL 260 0.926 3.712 0.750 93 H LEU 261 H LEU 261 1.514 5.490 -3.988 94 HA LEU 261 HA LEU 261 2.943 7.895 -3.891 95 1HB LEU 261 2HB LEU 261 2.800 5.782 -5.613 96 2HB LEU 261 1HB LEU 261 2.018 7.032 -6.557 97 HG LEU 261 HG LEU 261 4.403 6.837 -7.079 98 1HD1 LEU 261 1HD1 LEU 261 4.627 9.418 -5.856 99 2HD1 LEU 261 2HD1 LEU 261 3.002 9.191 -6.502 100 3HD1 LEU 261 3HD1 LEU 261 4.404 8.998 -7.554 101 1HD2 LEU 261 1HD2 LEU 261 5.403 6.088 -5.105 102 2HD2 LEU 261 2HD2 LEU 261 4.708 7.399 -4.150 103 3HD2 LEU 261 3HD2 LEU 261 6.000 7.736 -5.303 104 H THR 262 H THR 262 -0.248 7.150 -5.218 105 HA THR 262 HA THR 262 -0.836 9.673 -6.332 106 HB THR 262 HB THR 262 -2.705 7.572 -5.205 107 HG1 THR 262 1HG THR 262 -1.597 6.753 -6.954 108 1HG2 THR 262 1HG2 THR 262 -4.128 9.369 -5.314 109 2HG2 THR 262 2HG2 THR 262 -4.255 8.765 -6.967 110 3HG2 THR 262 3HG2 THR 262 -3.220 10.149 -6.610 111 H MET 263 H MET 263 -1.567 8.295 -3.138 112 HA MET 263 HA MET 263 -2.937 10.519 -2.084 113 1HB MET 263 2HB MET 263 -1.363 8.354 -0.684 114 2HB MET 263 1HB MET 263 -2.400 9.512 0.137 115 1HG MET 263 2HG MET 263 -4.339 8.654 -1.000 116 2HG MET 263 1HG MET 263 -3.334 7.572 -1.964 117 1HE MET 263 1HE MET 263 -4.373 8.680 1.477 118 2HE MET 263 2HE MET 263 -2.845 8.081 2.122 119 3HE MET 263 3HE MET 263 -4.348 7.230 2.481 120 H THR 264 H THR 264 0.488 9.536 -1.576 121 HA THR 264 HA THR 264 1.042 12.141 -0.379 122 HB THR 264 HB THR 264 2.106 10.218 0.666 123 HG1 THR 264 1HG THR 264 4.007 11.864 -0.684 124 1HG2 THR 264 1HG2 THR 264 3.116 8.557 -0.436 125 2HG2 THR 264 2HG2 THR 264 4.136 9.683 -1.332 126 3HG2 THR 264 3HG2 THR 264 2.521 9.292 -1.925 127 H THR 265 H THR 265 0.210 12.511 -2.920 128 HA THR 265 HA THR 265 2.342 12.652 -4.827 129 HB THR 265 HB THR 265 0.028 12.389 -5.544 130 HG1 THR 265 1HG THR 265 1.308 14.798 -6.386 131 1HG2 THR 265 1HG2 THR 265 -0.353 15.089 -4.273 132 2HG2 THR 265 2HG2 THR 265 -1.246 13.598 -3.972 133 3HG2 THR 265 3HG2 THR 265 -1.454 14.459 -5.498 134 H GLN 266 H GLN 266 3.252 13.946 -2.559 135 HA GLN 266 HA GLN 266 3.085 16.818 -3.130 136 1HB GLN 266 2HB GLN 266 4.185 15.269 -0.786 137 2HB GLN 266 1HB GLN 266 4.417 17.001 -0.971 138 1HG GLN 266 2HG GLN 266 1.730 15.649 -0.851 139 2HG GLN 266 1HG GLN 266 2.546 16.382 0.528 140 1HE2 GLN 266 1HE2 GLN 266 0.278 16.894 -1.787 141 2HE2 GLN 266 2HE2 GLN 266 0.284 18.620 -1.808 142 H SER 267 H SER 267 4.338 16.102 -5.207 143 HA SER 267 HA SER 267 7.089 16.895 -4.800 144 1HB SER 267 2HB SER 267 7.244 14.460 -4.415 145 2HB SER 267 1HB SER 267 6.523 14.168 -5.997 146 HG SER 267 HG SER 267 9.094 14.709 -5.365 147 H SER 268 H SER 268 7.786 18.085 -6.457 148 HA SER 268 HA SER 268 6.119 18.252 -8.848 149 1HB SER 268 2HB SER 268 8.393 19.999 -7.866 150 2HB SER 268 1HB SER 268 7.509 20.276 -9.365 151 HG SER 268 HG SER 268 6.732 21.495 -7.525 152 H GLY 269 H GLY 269 6.637 17.166 -10.646 153 1HA GLY 269 2HA GLY 269 9.175 17.118 -11.831 154 2HA GLY 269 1HA GLY 269 9.002 15.639 -10.899 155 H SER 270 H SER 270 8.710 14.065 -12.383 156 HA SER 270 HA SER 270 7.462 14.394 -14.881 157 1HB SER 270 2HB SER 270 7.810 11.821 -13.320 158 2HB SER 270 1HB SER 270 7.501 11.954 -15.051 159 HG SER 270 HG SER 270 9.557 12.227 -15.328 160 H ARG 271 H ARG 271 6.168 13.257 -11.778 161 HA ARG 271 HA ARG 271 3.565 12.692 -12.876 162 1HB ARG 271 2HB ARG 271 4.282 11.421 -10.946 163 2HB ARG 271 1HB ARG 271 4.539 12.894 -10.020 164 1HG ARG 271 2HG ARG 271 2.084 13.353 -10.244 165 2HG ARG 271 1HG ARG 271 1.916 11.744 -10.943 166 1HD ARG 271 2HD ARG 271 2.631 10.703 -8.932 167 2HD ARG 271 1HD ARG 271 3.166 12.238 -8.250 168 HE ARG 271 HE ARG 271 1.020 12.662 -7.577 169 1HH1 ARG 271 1HH1 ARG 271 0.938 10.102 -9.926 170 2HH1 ARG 271 2HH1 ARG 271 -0.742 9.777 -9.679 171 1HH2 ARG 271 1HH2 ARG 271 -1.143 12.249 -7.290 172 2HH2 ARG 271 2HH2 ARG 271 -1.922 11.000 -8.197 173 H ALA 272 H ALA 272 1.934 14.082 -13.152 174 HA ALA 272 HA ALA 272 2.277 16.866 -12.613 175 1HB ALA 272 1HB ALA 272 -0.351 16.619 -13.287 176 2HB ALA 272 2HB ALA 272 0.348 15.183 -14.033 177 3HB ALA 272 3HB ALA 272 0.977 16.781 -14.436 178 H SER 273 H SER 273 2.504 16.970 -10.322 179 HA SER 273 HA SER 273 0.430 16.018 -8.579 180 1HB SER 273 2HB SER 273 2.707 17.925 -8.031 181 2HB SER 273 1HB SER 273 1.603 17.297 -6.808 182 HG SER 273 HG SER 273 3.821 16.175 -7.677 183 H LEU 274 H LEU 274 -1.129 17.191 -10.128 184 HA LEU 274 HA LEU 274 -1.827 19.713 -8.778 185 1HB LEU 274 2HB LEU 274 -1.029 19.990 -11.163 186 2HB LEU 274 1HB LEU 274 -2.450 19.094 -11.663 187 HG LEU 274 HG LEU 274 -3.883 20.839 -10.647 188 1HD1 LEU 274 1HD1 LEU 274 -2.187 23.021 -10.442 189 2HD1 LEU 274 2HD1 LEU 274 -1.339 21.725 -9.597 190 3HD1 LEU 274 3HD1 LEU 274 -2.977 22.168 -9.114 191 1HD2 LEU 274 1HD2 LEU 274 -3.166 22.679 -12.291 192 2HD2 LEU 274 2HD2 LEU 274 -3.603 21.098 -12.941 193 3HD2 LEU 274 3HD2 LEU 274 -1.905 21.546 -12.782 194 HA PRO 275 HA PRO 275 -5.255 16.244 -8.842 195 1HB PRO 275 2HB PRO 275 -4.690 16.272 -5.915 196 2HB PRO 275 1HB PRO 275 -5.104 14.913 -6.971 197 1HG PRO 275 2HG PRO 275 -2.617 15.164 -6.192 198 2HG PRO 275 1HG PRO 275 -2.960 14.839 -7.908 199 1HD PRO 275 2HD PRO 275 -2.329 17.474 -6.597 200 2HD PRO 275 1HD PRO 275 -1.573 16.747 -8.037 201 H LYS 276 H LYS 276 -4.481 18.938 -6.714 202 HA LYS 276 HA LYS 276 -7.083 20.076 -7.070 203 1HB LYS 276 2HB LYS 276 -7.398 18.453 -5.180 204 2HB LYS 276 1HB LYS 276 -6.233 19.386 -4.253 205 1HG LYS 276 2HG LYS 276 -8.373 20.079 -3.546 206 2HG LYS 276 1HG LYS 276 -7.743 21.375 -4.564 207 1HD LYS 276 2HD LYS 276 -9.518 19.208 -5.646 208 2HD LYS 276 1HD LYS 276 -10.174 20.675 -4.922 209 1HE LYS 276 2HE LYS 276 -8.428 20.441 -7.366 210 2HE LYS 276 1HE LYS 276 -10.107 20.974 -7.294 211 1HZ LYS 276 1HZ LYS 276 -7.661 22.403 -6.431 212 2HZ LYS 276 2HZ LYS 276 -9.180 22.809 -5.780 213 3HZ LYS 276 3HZ LYS 276 -8.919 22.938 -7.445 Start of MODEL 3 1 1H ALA 249 1HT ALA 249 0.866 -12.025 -10.470 2 2H ALA 249 2HT ALA 249 2.274 -12.605 -11.209 3 3H ALA 249 3HT ALA 249 1.029 -11.958 -12.154 4 HA ALA 249 HA ALA 249 3.228 -10.642 -11.165 5 1HB ALA 249 1HB ALA 249 2.065 -8.629 -12.126 6 2HB ALA 249 2HB ALA 249 0.678 -9.675 -12.433 7 3HB ALA 249 3HB ALA 249 2.225 -10.010 -13.213 8 HA PRO 250 HA PRO 250 2.126 -8.895 -7.264 9 1HB PRO 250 2HB PRO 250 3.637 -6.683 -7.231 10 2HB PRO 250 1HB PRO 250 4.364 -8.295 -7.246 11 1HG PRO 250 2HG PRO 250 3.902 -6.416 -9.535 12 2HG PRO 250 1HG PRO 250 5.384 -7.289 -9.091 13 1HD PRO 250 2HD PRO 250 3.694 -8.196 -10.985 14 2HD PRO 250 1HD PRO 250 4.604 -9.290 -9.926 15 H ALA 251 H ALA 251 -0.073 -8.497 -8.706 16 HA ALA 251 HA ALA 251 -0.781 -5.890 -9.440 17 1HB ALA 251 1HB ALA 251 -2.397 -8.266 -8.587 18 2HB ALA 251 2HB ALA 251 -2.203 -7.572 -10.197 19 3HB ALA 251 3HB ALA 251 -3.163 -6.727 -8.983 20 H ARG 252 H ARG 252 -1.178 -7.534 -6.312 21 HA ARG 252 HA ARG 252 -2.561 -5.490 -4.971 22 1HB ARG 252 2HB ARG 252 -1.762 -8.007 -4.318 23 2HB ARG 252 1HB ARG 252 -0.612 -7.059 -3.388 24 1HG ARG 252 2HG ARG 252 -3.613 -6.993 -3.192 25 2HG ARG 252 1HG ARG 252 -2.466 -7.576 -1.986 26 1HD ARG 252 2HD ARG 252 -1.572 -5.293 -1.769 27 2HD ARG 252 1HD ARG 252 -2.766 -4.729 -2.934 28 HE ARG 252 HE ARG 252 -3.962 -6.071 -0.718 29 1HH1 ARG 252 1HH1 ARG 252 -2.672 -3.056 -1.812 30 2HH1 ARG 252 2HH1 ARG 252 -3.541 -2.122 -0.647 31 1HH2 ARG 252 1HH2 ARG 252 -5.090 -4.861 0.797 32 2HH2 ARG 252 2HH2 ARG 252 -4.909 -3.147 0.827 33 H VAL 253 H VAL 253 0.892 -6.156 -5.297 34 HA VAL 253 HA VAL 253 1.860 -4.075 -3.672 35 HB VAL 253 HB VAL 253 3.203 -5.344 -6.064 36 1HG1 VAL 253 1HG1 VAL 253 4.559 -3.546 -5.639 37 2HG1 VAL 253 2HG1 VAL 253 5.257 -4.736 -4.540 38 3HG1 VAL 253 3HG1 VAL 253 4.154 -3.504 -3.924 39 1HG2 VAL 253 1HG2 VAL 253 3.718 -6.113 -3.221 40 2HG2 VAL 253 2HG2 VAL 253 3.998 -7.033 -4.700 41 3HG2 VAL 253 3HG2 VAL 253 2.355 -6.811 -4.096 42 H GLY 254 H GLY 254 1.363 -4.264 -7.190 43 1HA GLY 254 2HA GLY 254 2.223 -1.681 -7.865 44 2HA GLY 254 1HA GLY 254 1.049 -2.622 -8.775 45 H LEU 255 H LEU 255 -1.037 -2.827 -7.017 46 HA LEU 255 HA LEU 255 -2.371 -0.365 -7.294 47 1HB LEU 255 2HB LEU 255 -2.895 -2.923 -5.911 48 2HB LEU 255 1HB LEU 255 -3.815 -1.531 -5.373 49 HG LEU 255 HG LEU 255 -3.719 -2.577 -8.196 50 1HD1 LEU 255 1HD1 LEU 255 -5.015 -4.097 -7.018 51 2HD1 LEU 255 2HD1 LEU 255 -6.206 -2.931 -7.594 52 3HD1 LEU 255 3HD1 LEU 255 -5.643 -2.862 -5.924 53 1HD2 LEU 255 1HD2 LEU 255 -4.927 -0.164 -6.919 54 2HD2 LEU 255 2HD2 LEU 255 -5.730 -0.923 -8.292 55 3HD2 LEU 255 3HD2 LEU 255 -4.084 -0.314 -8.457 56 H GLY 256 H GLY 256 -0.862 -1.892 -4.471 57 1HA GLY 256 2HA GLY 256 -1.565 0.088 -2.609 58 2HA GLY 256 1HA GLY 256 -0.229 -1.037 -2.447 59 H ILE 257 H ILE 257 1.531 -0.311 -4.399 60 HA ILE 257 HA ILE 257 2.673 2.025 -3.296 61 HB ILE 257 HB ILE 257 4.350 1.929 -5.087 62 1HG1 ILE 257 2HG1 ILE 257 3.951 -0.467 -6.382 63 2HG1 ILE 257 1HG1 ILE 257 2.333 0.226 -6.365 64 1HG2 ILE 257 1HG2 ILE 257 3.973 0.192 -3.024 65 2HG2 ILE 257 2HG2 ILE 257 5.433 0.299 -4.009 66 3HG2 ILE 257 3HG2 ILE 257 4.198 -0.904 -4.387 67 1HD1 ILE 257 1HD1 ILE 257 4.781 1.148 -7.757 68 2HD1 ILE 257 2HD1 ILE 257 3.623 2.364 -7.214 69 3HD1 ILE 257 3HD1 ILE 257 3.110 1.086 -8.317 70 H THR 258 H THR 258 0.796 1.559 -6.290 71 HA THR 258 HA THR 258 1.184 4.197 -7.265 72 HB THR 258 HB THR 258 -0.918 3.793 -8.602 73 HG1 THR 258 1HG THR 258 -0.748 1.110 -7.704 74 1HG2 THR 258 1HG2 THR 258 1.028 3.315 -9.767 75 2HG2 THR 258 2HG2 THR 258 0.156 1.784 -9.850 76 3HG2 THR 258 3HG2 THR 258 1.469 1.989 -8.691 77 H THR 259 H THR 259 -1.399 2.781 -5.243 78 HA THR 259 HA THR 259 -2.958 5.155 -5.152 79 HB THR 259 HB THR 259 -3.970 4.157 -3.062 80 HG1 THR 259 1HG THR 259 -2.500 1.822 -3.740 81 1HG2 THR 259 1HG2 THR 259 -3.941 2.180 -5.323 82 2HG2 THR 259 2HG2 THR 259 -4.705 3.761 -5.484 83 3HG2 THR 259 3HG2 THR 259 -5.279 2.626 -4.262 84 H VAL 260 H VAL 260 -0.519 3.807 -2.925 85 HA VAL 260 HA VAL 260 -0.649 5.862 -1.006 86 HB VAL 260 HB VAL 260 1.661 4.072 -1.783 87 1HG1 VAL 260 1HG1 VAL 260 2.959 5.466 -0.613 88 2HG1 VAL 260 2HG1 VAL 260 2.104 4.874 0.811 89 3HG1 VAL 260 3HG1 VAL 260 1.576 6.358 0.020 90 1HG2 VAL 260 1HG2 VAL 260 0.951 3.210 0.616 91 2HG2 VAL 260 2HG2 VAL 260 0.142 2.647 -0.846 92 3HG2 VAL 260 3HG2 VAL 260 -0.598 3.907 0.141 93 H LEU 261 H LEU 261 1.390 5.523 -3.913 94 HA LEU 261 HA LEU 261 2.864 7.906 -3.610 95 1HB LEU 261 2HB LEU 261 3.359 6.042 -5.206 96 2HB LEU 261 1HB LEU 261 2.045 6.628 -6.210 97 HG LEU 261 HG LEU 261 3.203 8.740 -6.552 98 1HD1 LEU 261 1HD1 LEU 261 5.091 7.584 -4.546 99 2HD1 LEU 261 2HD1 LEU 261 4.401 9.204 -4.634 100 3HD1 LEU 261 3HD1 LEU 261 5.678 8.729 -5.754 101 1HD2 LEU 261 1HD2 LEU 261 4.932 6.323 -7.055 102 2HD2 LEU 261 2HD2 LEU 261 5.120 7.893 -7.840 103 3HD2 LEU 261 3HD2 LEU 261 3.658 6.943 -8.107 104 H THR 262 H THR 262 -0.166 7.240 -5.351 105 HA THR 262 HA THR 262 -0.602 9.815 -6.395 106 HB THR 262 HB THR 262 -2.679 7.786 -5.531 107 HG1 THR 262 1HG THR 262 -1.396 6.828 -7.071 108 1HG2 THR 262 1HG2 THR 262 -2.991 9.884 -7.659 109 2HG2 THR 262 2HG2 THR 262 -3.419 10.191 -5.975 110 3HG2 THR 262 3HG2 THR 262 -4.238 8.914 -6.875 111 H MET 263 H MET 263 -1.795 8.311 -3.413 112 HA MET 263 HA MET 263 -3.227 10.508 -2.422 113 1HB MET 263 2HB MET 263 -3.399 8.164 -1.605 114 2HB MET 263 1HB MET 263 -1.830 8.348 -0.836 115 1HG MET 263 2HG MET 263 -2.746 10.144 0.564 116 2HG MET 263 1HG MET 263 -4.324 9.900 -0.185 117 1HE MET 263 1HE MET 263 -4.428 6.045 0.367 118 2HE MET 263 2HE MET 263 -4.875 7.401 -0.669 119 3HE MET 263 3HE MET 263 -5.823 7.042 0.775 120 H THR 264 H THR 264 0.157 9.505 -1.745 121 HA THR 264 HA THR 264 0.642 11.625 0.068 122 HB THR 264 HB THR 264 2.064 9.627 0.055 123 HG1 THR 264 1HG THR 264 2.949 12.225 0.054 124 1HG2 THR 264 1HG2 THR 264 2.826 8.868 -1.907 125 2HG2 THR 264 2HG2 THR 264 4.025 10.160 -1.823 126 3HG2 THR 264 3HG2 THR 264 2.519 10.410 -2.708 127 H THR 265 H THR 265 1.126 11.442 -3.459 128 HA THR 265 HA THR 265 2.503 13.959 -3.547 129 HB THR 265 HB THR 265 2.814 12.328 -5.366 130 HG1 THR 265 1HG THR 265 2.157 14.975 -5.682 131 1HG2 THR 265 1HG2 THR 265 0.703 11.347 -5.727 132 2HG2 THR 265 2HG2 THR 265 0.997 12.325 -7.166 133 3HG2 THR 265 3HG2 THR 265 -0.087 12.915 -5.906 134 H GLN 266 H GLN 266 -0.849 12.966 -3.774 135 HA GLN 266 HA GLN 266 -1.889 15.450 -4.701 136 1HB GLN 266 2HB GLN 266 -3.135 13.327 -4.868 137 2HB GLN 266 1HB GLN 266 -3.232 13.248 -3.115 138 1HG GLN 266 2HG GLN 266 -4.541 15.335 -3.121 139 2HG GLN 266 1HG GLN 266 -4.497 15.326 -4.884 140 1HE2 GLN 266 1HE2 GLN 266 -6.322 14.547 -2.287 141 2HE2 GLN 266 2HE2 GLN 266 -7.341 13.349 -2.997 142 H SER 267 H SER 267 -1.389 14.009 -1.521 143 HA SER 267 HA SER 267 -2.315 16.428 -0.167 144 1HB SER 267 2HB SER 267 -2.984 14.216 0.724 145 2HB SER 267 1HB SER 267 -1.289 13.805 0.969 146 HG SER 267 HG SER 267 -2.811 14.896 2.715 147 H SER 268 H SER 268 -0.462 16.020 2.099 148 HA SER 268 HA SER 268 1.681 17.686 1.154 149 1HB SER 268 2HB SER 268 2.409 17.796 3.428 150 2HB SER 268 1HB SER 268 0.647 17.773 3.481 151 HG SER 268 HG SER 268 1.780 15.270 3.538 152 H GLY 269 H GLY 269 3.583 17.060 0.334 153 1HA GLY 269 2HA GLY 269 4.247 14.297 0.028 154 2HA GLY 269 1HA GLY 269 5.247 15.662 -0.444 155 H SER 270 H SER 270 4.077 14.147 2.560 156 HA SER 270 HA SER 270 6.720 13.611 3.518 157 1HB SER 270 2HB SER 270 6.753 15.979 4.006 158 2HB SER 270 1HB SER 270 5.168 15.888 4.774 159 HG SER 270 HG SER 270 7.261 15.811 6.091 160 H ARG 271 H ARG 271 6.717 12.209 5.234 161 HA ARG 271 HA ARG 271 5.976 10.727 6.786 162 1HB ARG 271 2HB ARG 271 3.419 12.330 6.780 163 2HB ARG 271 1HB ARG 271 3.855 11.096 7.956 164 1HG ARG 271 2HG ARG 271 5.454 12.413 8.953 165 2HG ARG 271 1HG ARG 271 5.669 13.412 7.514 166 1HD ARG 271 2HD ARG 271 3.277 13.404 9.352 167 2HD ARG 271 1HD ARG 271 4.515 14.657 9.257 168 HE ARG 271 HE ARG 271 3.343 14.284 6.718 169 1HH1 ARG 271 1HH1 ARG 271 2.638 15.575 9.848 170 2HH1 ARG 271 2HH1 ARG 271 1.497 16.727 9.251 171 1HH2 ARG 271 1HH2 ARG 271 1.858 15.794 5.928 172 2HH2 ARG 271 2HH2 ARG 271 1.058 16.847 7.046 173 H ALA 272 H ALA 272 5.863 9.993 4.145 174 HA ALA 272 HA ALA 272 3.294 8.706 3.674 175 1HB ALA 272 1HB ALA 272 3.841 8.888 1.531 176 2HB ALA 272 2HB ALA 272 5.305 7.936 1.782 177 3HB ALA 272 3HB ALA 272 5.339 9.683 2.014 178 H SER 273 H SER 273 2.866 6.610 4.068 179 HA SER 273 HA SER 273 4.949 4.994 5.316 180 1HB SER 273 2HB SER 273 3.113 3.430 5.846 181 2HB SER 273 1HB SER 273 2.787 5.065 6.423 182 HG SER 273 HG SER 273 1.081 3.801 5.186 183 H LEU 274 H LEU 274 4.427 2.522 4.846 184 HA LEU 274 HA LEU 274 4.985 0.794 3.516 185 1HB LEU 274 2HB LEU 274 2.735 1.398 2.563 186 2HB LEU 274 1HB LEU 274 3.577 2.285 1.306 187 HG LEU 274 HG LEU 274 4.689 0.175 0.607 188 1HD1 LEU 274 1HD1 LEU 274 4.620 -1.048 2.679 189 2HD1 LEU 274 2HD1 LEU 274 3.748 -1.953 1.442 190 3HD1 LEU 274 3HD1 LEU 274 2.856 -1.047 2.664 191 1HD2 LEU 274 1HD2 LEU 274 1.695 0.385 0.599 192 2HD2 LEU 274 2HD2 LEU 274 2.537 -0.921 -0.236 193 3HD2 LEU 274 3HD2 LEU 274 2.837 0.755 -0.695 194 HA PRO 275 HA PRO 275 8.307 3.758 1.469 195 1HB PRO 275 2HB PRO 275 9.889 2.431 3.632 196 2HB PRO 275 1HB PRO 275 10.060 4.053 2.943 197 1HG PRO 275 2HG PRO 275 8.893 3.799 5.276 198 2HG PRO 275 1HG PRO 275 8.162 4.852 4.046 199 1HD PRO 275 2HD PRO 275 7.356 2.090 4.877 200 2HD PRO 275 1HD PRO 275 6.332 3.505 4.529 201 H LYS 276 H LYS 276 9.334 2.939 -0.256 202 HA LYS 276 HA LYS 276 10.448 0.229 -0.156 203 1HB LYS 276 2HB LYS 276 8.451 1.237 -2.172 204 2HB LYS 276 1HB LYS 276 9.577 -0.050 -2.572 205 1HG LYS 276 2HG LYS 276 7.590 -0.133 -0.311 206 2HG LYS 276 1HG LYS 276 7.372 -0.887 -1.890 207 1HD LYS 276 2HD LYS 276 9.480 -1.547 0.164 208 2HD LYS 276 1HD LYS 276 8.113 -2.552 -0.313 209 1HE LYS 276 2HE LYS 276 10.455 -1.760 -2.038 210 2HE LYS 276 1HE LYS 276 10.136 -3.357 -1.367 211 1HZ LYS 276 1HZ LYS 276 7.994 -3.275 -2.675 212 2HZ LYS 276 2HZ LYS 276 9.417 -3.438 -3.578 213 3HZ LYS 276 3HZ LYS 276 8.640 -1.937 -3.486 Start of MODEL 4 1 1H ALA 249 1HT ALA 249 4.039 -12.719 1.468 2 2H ALA 249 2HT ALA 249 3.312 -11.247 1.874 3 3H ALA 249 3HT ALA 249 4.979 -11.451 2.082 4 HA ALA 249 HA ALA 249 5.457 -11.010 -0.029 5 1HB ALA 249 1HB ALA 249 4.845 -12.598 -1.454 6 2HB ALA 249 2HB ALA 249 3.295 -11.779 -1.641 7 3HB ALA 249 3HB ALA 249 3.481 -13.049 -0.432 8 HA PRO 250 HA PRO 250 3.395 -7.147 -0.515 9 1HB PRO 250 2HB PRO 250 4.194 -7.147 -3.347 10 2HB PRO 250 1HB PRO 250 4.707 -6.079 -2.040 11 1HG PRO 250 2HG PRO 250 6.376 -7.873 -3.079 12 2HG PRO 250 1HG PRO 250 6.370 -7.531 -1.336 13 1HD PRO 250 2HD PRO 250 5.058 -9.786 -2.819 14 2HD PRO 250 1HD PRO 250 6.063 -9.847 -1.354 15 H ALA 251 H ALA 251 1.258 -8.363 -0.387 16 HA ALA 251 HA ALA 251 -0.182 -9.223 -2.607 17 1HB ALA 251 1HB ALA 251 -1.946 -9.424 -1.206 18 2HB ALA 251 2HB ALA 251 -1.699 -7.833 -0.487 19 3HB ALA 251 3HB ALA 251 -0.691 -9.191 0.010 20 H ARG 252 H ARG 252 -0.795 -8.193 -4.343 21 HA ARG 252 HA ARG 252 -1.259 -6.582 -5.847 22 1HB ARG 252 2HB ARG 252 -3.330 -6.824 -4.426 23 2HB ARG 252 1HB ARG 252 -2.843 -5.333 -3.628 24 1HG ARG 252 2HG ARG 252 -4.522 -5.097 -5.493 25 2HG ARG 252 1HG ARG 252 -3.084 -4.077 -5.615 26 1HD ARG 252 2HD ARG 252 -2.109 -5.494 -7.251 27 2HD ARG 252 1HD ARG 252 -3.310 -6.754 -6.975 28 HE ARG 252 HE ARG 252 -3.539 -4.581 -8.757 29 1HH1 ARG 252 1HH1 ARG 252 -5.399 -6.454 -6.529 30 2HH1 ARG 252 2HH1 ARG 252 -6.897 -6.133 -7.321 31 1HH2 ARG 252 1HH2 ARG 252 -5.488 -4.169 -9.795 32 2HH2 ARG 252 2HH2 ARG 252 -6.946 -4.852 -9.172 33 H VAL 253 H VAL 253 1.158 -6.188 -4.734 34 HA VAL 253 HA VAL 253 1.870 -3.851 -3.532 35 HB VAL 253 HB VAL 253 3.465 -5.557 -4.039 36 1HG1 VAL 253 1HG1 VAL 253 4.134 -6.298 -6.100 37 2HG1 VAL 253 2HG1 VAL 253 3.640 -4.810 -6.908 38 3HG1 VAL 253 3HG1 VAL 253 2.423 -5.969 -6.375 39 1HG2 VAL 253 1HG2 VAL 253 4.836 -3.592 -5.628 40 2HG2 VAL 253 2HG2 VAL 253 5.125 -4.086 -3.960 41 3HG2 VAL 253 3HG2 VAL 253 3.934 -2.836 -4.315 42 H GLY 254 H GLY 254 1.538 -4.279 -7.032 43 1HA GLY 254 2HA GLY 254 2.226 -1.762 -7.927 44 2HA GLY 254 1HA GLY 254 1.035 -2.778 -8.721 45 H LEU 255 H LEU 255 -1.106 -2.774 -7.092 46 HA LEU 255 HA LEU 255 -2.213 -0.194 -7.482 47 1HB LEU 255 2HB LEU 255 -3.167 -2.766 -6.705 48 2HB LEU 255 1HB LEU 255 -3.749 -1.583 -5.547 49 HG LEU 255 HG LEU 255 -4.220 -1.620 -8.523 50 1HD1 LEU 255 1HD1 LEU 255 -6.515 -1.268 -6.833 51 2HD1 LEU 255 2HD1 LEU 255 -5.616 -2.711 -6.364 52 3HD1 LEU 255 3HD1 LEU 255 -6.180 -2.523 -8.025 53 1HD2 LEU 255 1HD2 LEU 255 -3.928 0.655 -6.897 54 2HD2 LEU 255 2HD2 LEU 255 -5.660 0.447 -7.161 55 3HD2 LEU 255 3HD2 LEU 255 -4.566 0.571 -8.538 56 H GLY 256 H GLY 256 -0.962 -1.891 -4.637 57 1HA GLY 256 2HA GLY 256 -1.695 0.014 -2.702 58 2HA GLY 256 1HA GLY 256 -0.354 -1.113 -2.562 59 H ILE 257 H ILE 257 1.433 -0.330 -4.433 60 HA ILE 257 HA ILE 257 2.540 1.992 -3.253 61 HB ILE 257 HB ILE 257 4.290 1.907 -4.972 62 1HG1 ILE 257 2HG1 ILE 257 3.965 -0.481 -6.294 63 2HG1 ILE 257 1HG1 ILE 257 2.338 0.189 -6.337 64 1HG2 ILE 257 1HG2 ILE 257 5.298 -0.076 -4.208 65 2HG2 ILE 257 2HG2 ILE 257 3.741 -0.863 -3.953 66 3HG2 ILE 257 3HG2 ILE 257 4.240 0.464 -2.905 67 1HD1 ILE 257 1HD1 ILE 257 4.279 2.198 -7.018 68 2HD1 ILE 257 2HD1 ILE 257 2.902 1.602 -7.944 69 3HD1 ILE 257 3HD1 ILE 257 4.456 0.774 -8.043 70 H THR 258 H THR 258 0.792 1.550 -6.344 71 HA THR 258 HA THR 258 1.220 4.213 -7.237 72 HB THR 258 HB THR 258 -0.866 3.851 -8.638 73 HG1 THR 258 1HG THR 258 -0.660 1.134 -7.876 74 1HG2 THR 258 1HG2 THR 258 0.919 1.537 -9.136 75 2HG2 THR 258 2HG2 THR 258 1.662 3.136 -9.092 76 3HG2 THR 258 3HG2 THR 258 0.363 2.799 -10.236 77 H THR 259 H THR 259 -1.272 2.738 -5.206 78 HA THR 259 HA THR 259 -2.965 5.014 -5.045 79 HB THR 259 HB THR 259 -2.610 2.795 -3.010 80 HG1 THR 259 1HG THR 259 -3.316 1.900 -4.927 81 1HG2 THR 259 1HG2 THR 259 -4.023 5.194 -2.775 82 2HG2 THR 259 2HG2 THR 259 -4.191 3.759 -1.764 83 3HG2 THR 259 3HG2 THR 259 -5.241 3.980 -3.164 84 H VAL 260 H VAL 260 -0.381 3.784 -2.900 85 HA VAL 260 HA VAL 260 -0.498 5.865 -1.011 86 HB VAL 260 HB VAL 260 1.859 4.161 -1.844 87 1HG1 VAL 260 1HG1 VAL 260 1.699 5.533 0.799 88 2HG1 VAL 260 2HG1 VAL 260 2.263 6.438 -0.606 89 3HG1 VAL 260 3HG1 VAL 260 3.112 4.978 -0.098 90 1HG2 VAL 260 1HG2 VAL 260 0.055 2.845 -0.951 91 2HG2 VAL 260 2HG2 VAL 260 -0.121 3.939 0.420 92 3HG2 VAL 260 3HG2 VAL 260 1.332 2.951 0.261 93 H LEU 261 H LEU 261 1.443 5.530 -3.981 94 HA LEU 261 HA LEU 261 2.907 7.913 -3.766 95 1HB LEU 261 2HB LEU 261 2.840 5.856 -5.531 96 2HB LEU 261 1HB LEU 261 2.037 7.093 -6.473 97 HG LEU 261 HG LEU 261 4.448 6.972 -6.950 98 1HD1 LEU 261 1HD1 LEU 261 3.578 9.515 -5.584 99 2HD1 LEU 261 2HD1 LEU 261 3.335 9.095 -7.279 100 3HD1 LEU 261 3HD1 LEU 261 4.965 9.360 -6.661 101 1HD2 LEU 261 1HD2 LEU 261 4.899 6.361 -4.449 102 2HD2 LEU 261 2HD2 LEU 261 5.051 8.107 -4.260 103 3HD2 LEU 261 3HD2 LEU 261 6.104 7.247 -5.383 104 H THR 262 H THR 262 -0.230 7.247 -5.274 105 HA THR 262 HA THR 262 -0.763 9.817 -6.288 106 HB THR 262 HB THR 262 -2.748 7.761 -5.284 107 HG1 THR 262 1HG THR 262 -1.578 6.811 -6.918 108 1HG2 THR 262 1HG2 THR 262 -3.560 10.143 -5.659 109 2HG2 THR 262 2HG2 THR 262 -4.404 8.870 -6.539 110 3HG2 THR 262 3HG2 THR 262 -3.219 9.876 -7.370 111 H MET 263 H MET 263 -1.725 8.293 -3.232 112 HA MET 263 HA MET 263 -3.104 10.477 -2.143 113 1HB MET 263 2HB MET 263 -1.642 8.218 -0.772 114 2HB MET 263 1HB MET 263 -2.686 9.360 0.061 115 1HG MET 263 2HG MET 263 -3.524 7.478 -2.133 116 2HG MET 263 1HG MET 263 -3.836 7.271 -0.410 117 1HE MET 263 1HE MET 263 -7.090 8.067 -2.542 118 2HE MET 263 2HE MET 263 -6.925 7.343 -0.942 119 3HE MET 263 3HE MET 263 -5.857 6.840 -2.251 120 H THR 264 H THR 264 0.338 9.531 -1.731 121 HA THR 264 HA THR 264 0.881 11.697 0.026 122 HB THR 264 HB THR 264 2.321 9.720 0.020 123 HG1 THR 264 1HG THR 264 3.251 12.318 -0.249 124 1HG2 THR 264 1HG2 THR 264 2.345 9.922 -2.707 125 2HG2 THR 264 2HG2 THR 264 3.457 8.939 -1.754 126 3HG2 THR 264 3HG2 THR 264 3.933 10.555 -2.277 127 H THR 265 H THR 265 1.269 11.393 -3.515 128 HA THR 265 HA THR 265 2.645 13.869 -3.778 129 HB THR 265 HB THR 265 2.714 12.138 -5.552 130 HG1 THR 265 1HG THR 265 2.109 14.827 -5.995 131 1HG2 THR 265 1HG2 THR 265 0.052 11.935 -5.383 132 2HG2 THR 265 2HG2 THR 265 0.946 11.521 -6.846 133 3HG2 THR 265 3HG2 THR 265 0.156 13.091 -6.710 134 H GLN 266 H GLN 266 -0.783 13.033 -3.808 135 HA GLN 266 HA GLN 266 -1.571 15.708 -4.565 136 1HB GLN 266 2HB GLN 266 -2.944 13.792 -5.236 137 2HB GLN 266 1HB GLN 266 -3.235 13.397 -3.547 138 1HG GLN 266 2HG GLN 266 -4.435 15.480 -3.237 139 2HG GLN 266 1HG GLN 266 -4.088 15.947 -4.901 140 1HE2 GLN 266 1HE2 GLN 266 -5.936 15.889 -5.974 141 2HE2 GLN 266 2HE2 GLN 266 -7.068 14.577 -5.941 142 H SER 267 H SER 267 -1.306 13.833 -1.595 143 HA SER 267 HA SER 267 -1.396 14.395 0.601 144 1HB SER 267 2HB SER 267 -0.963 17.195 -0.469 145 2HB SER 267 1HB SER 267 -0.851 16.744 1.231 146 HG SER 267 HG SER 267 0.666 15.282 -0.613 147 H SER 268 H SER 268 -2.565 17.429 0.949 148 HA SER 268 HA SER 268 -5.177 16.496 1.702 149 1HB SER 268 2HB SER 268 -5.539 18.893 2.357 150 2HB SER 268 1HB SER 268 -4.122 18.149 3.097 151 HG SER 268 HG SER 268 -4.076 20.372 1.902 152 H GLY 269 H GLY 269 -4.899 16.082 -1.019 153 1HA GLY 269 2HA GLY 269 -6.081 18.222 -2.543 154 2HA GLY 269 1HA GLY 269 -5.786 16.584 -3.100 155 H SER 270 H SER 270 -7.836 18.097 -0.613 156 HA SER 270 HA SER 270 -9.939 16.264 -0.714 157 1HB SER 270 2HB SER 270 -9.836 17.772 1.126 158 2HB SER 270 1HB SER 270 -9.875 19.180 0.067 159 HG SER 270 HG SER 270 -11.931 17.720 1.089 160 H ARG 271 H ARG 271 -11.739 16.009 -1.923 161 HA ARG 271 HA ARG 271 -13.177 16.160 -3.676 162 1HB ARG 271 2HB ARG 271 -12.652 19.102 -3.240 163 2HB ARG 271 1HB ARG 271 -13.905 18.477 -4.302 164 1HG ARG 271 2HG ARG 271 -15.196 17.710 -2.558 165 2HG ARG 271 1HG ARG 271 -13.822 17.589 -1.457 166 1HD ARG 271 2HD ARG 271 -14.821 20.229 -2.493 167 2HD ARG 271 1HD ARG 271 -15.489 19.476 -1.044 168 HE ARG 271 HE ARG 271 -12.768 19.506 -0.654 169 1HH1 ARG 271 1HH1 ARG 271 -15.199 21.906 -1.274 170 2HH1 ARG 271 2HH1 ARG 271 -14.368 23.135 -0.376 171 1HH2 ARG 271 1HH2 ARG 271 -11.727 21.138 0.512 172 2HH2 ARG 271 2HH2 ARG 271 -12.450 22.727 0.601 173 H ALA 272 H ALA 272 -10.720 15.419 -4.523 174 HA ALA 272 HA ALA 272 -9.396 15.202 -6.358 175 1HB ALA 272 1HB ALA 272 -11.503 14.986 -7.557 176 2HB ALA 272 2HB ALA 272 -10.312 15.838 -8.539 177 3HB ALA 272 3HB ALA 272 -11.597 16.738 -7.735 178 H SER 273 H SER 273 -8.524 17.070 -4.678 179 HA SER 273 HA SER 273 -7.091 18.821 -4.441 180 1HB SER 273 2HB SER 273 -6.883 18.795 -7.454 181 2HB SER 273 1HB SER 273 -5.778 19.580 -6.329 182 HG SER 273 HG SER 273 -4.816 17.671 -6.767 183 H LEU 274 H LEU 274 -9.567 19.521 -4.123 184 HA LEU 274 HA LEU 274 -9.625 22.207 -5.322 185 1HB LEU 274 2HB LEU 274 -11.420 20.686 -6.227 186 2HB LEU 274 1HB LEU 274 -12.069 20.584 -4.603 187 HG LEU 274 HG LEU 274 -12.414 23.057 -4.643 188 1HD1 LEU 274 1HD1 LEU 274 -10.726 23.000 -6.810 189 2HD1 LEU 274 2HD1 LEU 274 -11.736 24.361 -6.321 190 3HD1 LEU 274 3HD1 LEU 274 -12.311 23.232 -7.546 191 1HD2 LEU 274 1HD2 LEU 274 -14.238 21.514 -5.126 192 2HD2 LEU 274 2HD2 LEU 274 -13.776 21.487 -6.827 193 3HD2 LEU 274 3HD2 LEU 274 -14.374 22.977 -6.100 194 HA PRO 275 HA PRO 275 -9.545 21.835 -0.482 195 1HB PRO 275 2HB PRO 275 -7.088 23.454 -0.946 196 2HB PRO 275 1HB PRO 275 -7.399 22.187 0.249 197 1HG PRO 275 2HG PRO 275 -5.923 21.599 -1.830 198 2HG PRO 275 1HG PRO 275 -7.217 20.481 -1.342 199 1HD PRO 275 2HD PRO 275 -7.237 22.521 -3.548 200 2HD PRO 275 1HD PRO 275 -7.725 20.807 -3.612 201 H LYS 276 H LYS 276 -11.371 23.463 -1.567 202 HA LYS 276 HA LYS 276 -10.704 26.165 -0.565 203 1HB LYS 276 2HB LYS 276 -12.695 25.371 -2.697 204 2HB LYS 276 1HB LYS 276 -12.491 27.002 -2.072 205 1HG LYS 276 2HG LYS 276 -10.197 27.040 -2.902 206 2HG LYS 276 1HG LYS 276 -10.394 25.400 -3.522 207 1HD LYS 276 2HD LYS 276 -12.163 26.159 -5.012 208 2HD LYS 276 1HD LYS 276 -12.022 27.796 -4.367 209 1HE LYS 276 2HE LYS 276 -9.724 27.924 -5.187 210 2HE LYS 276 1HE LYS 276 -9.853 26.281 -5.817 211 1HZ LYS 276 1HZ LYS 276 -10.471 28.599 -7.148 212 2HZ LYS 276 2HZ LYS 276 -11.974 27.928 -6.760 213 3HZ LYS 276 3HZ LYS 276 -10.848 27.023 -7.638 Start of MODEL 5 1 1H ALA 249 1HT ALA 249 1.157 -11.929 -11.973 2 2H ALA 249 2HT ALA 249 0.997 -11.935 -10.289 3 3H ALA 249 3HT ALA 249 2.424 -12.498 -11.006 4 HA ALA 249 HA ALA 249 3.310 -10.496 -11.078 5 1HB ALA 249 1HB ALA 249 2.601 -9.143 -12.694 6 2HB ALA 249 2HB ALA 249 1.081 -8.824 -11.858 7 3HB ALA 249 3HB ALA 249 1.234 -10.239 -12.900 8 HA PRO 250 HA PRO 250 2.174 -8.694 -7.215 9 1HB PRO 250 2HB PRO 250 3.595 -6.280 -7.592 10 2HB PRO 250 1HB PRO 250 4.168 -7.750 -6.812 11 1HG PRO 250 2HG PRO 250 5.050 -6.647 -9.241 12 2HG PRO 250 1HG PRO 250 5.490 -8.217 -8.555 13 1HD PRO 250 2HD PRO 250 3.617 -7.566 -10.710 14 2HD PRO 250 1HD PRO 250 4.437 -9.092 -10.344 15 H ALA 251 H ALA 251 -0.001 -8.396 -8.706 16 HA ALA 251 HA ALA 251 -0.791 -5.834 -9.493 17 1HB ALA 251 1HB ALA 251 -2.832 -7.638 -8.308 18 2HB ALA 251 2HB ALA 251 -1.938 -8.200 -9.721 19 3HB ALA 251 3HB ALA 251 -2.873 -6.707 -9.805 20 H ARG 252 H ARG 252 -1.253 -7.425 -6.335 21 HA ARG 252 HA ARG 252 -2.640 -5.293 -5.109 22 1HB ARG 252 2HB ARG 252 -2.156 -7.824 -4.384 23 2HB ARG 252 1HB ARG 252 -0.891 -7.040 -3.452 24 1HG ARG 252 2HG ARG 252 -3.788 -6.243 -3.308 25 2HG ARG 252 1HG ARG 252 -3.048 -7.434 -2.240 26 1HD ARG 252 2HD ARG 252 -1.494 -5.758 -1.416 27 2HD ARG 252 1HD ARG 252 -2.153 -4.567 -2.535 28 HE ARG 252 HE ARG 252 -3.253 -5.354 -0.013 29 1HH1 ARG 252 1HH1 ARG 252 -4.019 -4.087 -3.138 30 2HH1 ARG 252 2HH1 ARG 252 -5.509 -3.382 -2.620 31 1HH2 ARG 252 1HH2 ARG 252 -5.188 -4.427 0.663 32 2HH2 ARG 252 2HH2 ARG 252 -6.162 -3.563 -0.472 33 H VAL 253 H VAL 253 0.793 -6.095 -5.306 34 HA VAL 253 HA VAL 253 1.748 -4.053 -3.603 35 HB VAL 253 HB VAL 253 3.183 -5.355 -5.925 36 1HG1 VAL 253 1HG1 VAL 253 5.051 -4.774 -4.003 37 2HG1 VAL 253 2HG1 VAL 253 3.986 -3.371 -3.945 38 3HG1 VAL 253 3HG1 VAL 253 4.753 -3.833 -5.463 39 1HG2 VAL 253 1HG2 VAL 253 4.131 -6.452 -3.567 40 2HG2 VAL 253 2HG2 VAL 253 3.043 -7.225 -4.720 41 3HG2 VAL 253 3HG2 VAL 253 2.386 -6.367 -3.328 42 H GLY 254 H GLY 254 1.422 -4.239 -7.141 43 1HA GLY 254 2HA GLY 254 2.359 -1.661 -7.759 44 2HA GLY 254 1HA GLY 254 1.246 -2.599 -8.746 45 H LEU 255 H LEU 255 -0.956 -2.800 -7.135 46 HA LEU 255 HA LEU 255 -2.263 -0.336 -7.496 47 1HB LEU 255 2HB LEU 255 -2.884 -2.911 -6.206 48 2HB LEU 255 1HB LEU 255 -3.796 -1.532 -5.623 49 HG LEU 255 HG LEU 255 -3.655 -2.475 -8.482 50 1HD1 LEU 255 1HD1 LEU 255 -5.025 -3.990 -7.367 51 2HD1 LEU 255 2HD1 LEU 255 -6.161 -2.788 -7.981 52 3HD1 LEU 255 3HD1 LEU 255 -5.672 -2.755 -6.286 53 1HD2 LEU 255 1HD2 LEU 255 -3.951 -0.195 -8.691 54 2HD2 LEU 255 2HD2 LEU 255 -4.834 -0.065 -7.171 55 3HD2 LEU 255 3HD2 LEU 255 -5.617 -0.765 -8.587 56 H GLY 256 H GLY 256 -0.942 -1.880 -4.594 57 1HA GLY 256 2HA GLY 256 -1.733 0.076 -2.751 58 2HA GLY 256 1HA GLY 256 -0.408 -1.054 -2.534 59 H ILE 257 H ILE 257 1.467 -0.307 -4.369 60 HA ILE 257 HA ILE 257 2.545 2.025 -3.190 61 HB ILE 257 HB ILE 257 4.301 1.963 -4.907 62 1HG1 ILE 257 2HG1 ILE 257 4.045 -0.377 -6.279 63 2HG1 ILE 257 1HG1 ILE 257 2.378 0.187 -6.268 64 1HG2 ILE 257 1HG2 ILE 257 4.267 0.498 -2.857 65 2HG2 ILE 257 2HG2 ILE 257 5.326 -0.022 -4.168 66 3HG2 ILE 257 3HG2 ILE 257 3.774 -0.821 -3.917 67 1HD1 ILE 257 1HD1 ILE 257 4.119 2.350 -6.956 68 2HD1 ILE 257 2HD1 ILE 257 2.815 1.621 -7.893 69 3HD1 ILE 257 3HD1 ILE 257 4.446 0.959 -7.989 70 H THR 258 H THR 258 0.743 1.534 -6.194 71 HA THR 258 HA THR 258 1.096 4.144 -7.247 72 HB THR 258 HB THR 258 -1.241 2.258 -7.656 73 HG1 THR 258 1HG THR 258 0.550 1.224 -8.418 74 1HG2 THR 258 1HG2 THR 258 -2.159 3.909 -8.842 75 2HG2 THR 258 2HG2 THR 258 -0.787 3.813 -9.948 76 3HG2 THR 258 3HG2 THR 258 -0.750 4.938 -8.588 77 H THR 259 H THR 259 -1.340 2.718 -5.103 78 HA THR 259 HA THR 259 -3.031 4.977 -4.915 79 HB THR 259 HB THR 259 -2.583 2.831 -2.821 80 HG1 THR 259 1HG THR 259 -3.258 1.860 -4.740 81 1HG2 THR 259 1HG2 THR 259 -3.791 4.526 -1.753 82 2HG2 THR 259 2HG2 THR 259 -5.045 3.432 -2.338 83 3HG2 THR 259 3HG2 THR 259 -4.701 4.925 -3.211 84 H VAL 260 H VAL 260 -0.340 3.838 -2.881 85 HA VAL 260 HA VAL 260 -0.421 5.931 -0.993 86 HB VAL 260 HB VAL 260 1.925 4.245 -1.892 87 1HG1 VAL 260 1HG1 VAL 260 3.224 5.574 -0.672 88 2HG1 VAL 260 2HG1 VAL 260 2.295 5.106 0.752 89 3HG1 VAL 260 3HG1 VAL 260 1.838 6.540 -0.167 90 1HG2 VAL 260 1HG2 VAL 260 0.704 2.657 -0.869 91 2HG2 VAL 260 2HG2 VAL 260 -0.319 3.833 -0.046 92 3HG2 VAL 260 3HG2 VAL 260 1.264 3.427 0.615 93 H LEU 261 H LEU 261 1.522 5.558 -3.966 94 HA LEU 261 HA LEU 261 2.928 7.983 -3.819 95 1HB LEU 261 2HB LEU 261 2.874 5.861 -5.535 96 2HB LEU 261 1HB LEU 261 2.111 7.099 -6.511 97 HG LEU 261 HG LEU 261 4.519 6.944 -6.939 98 1HD1 LEU 261 1HD1 LEU 261 3.829 9.059 -7.469 99 2HD1 LEU 261 2HD1 LEU 261 5.045 9.417 -6.242 100 3HD1 LEU 261 3HD1 LEU 261 3.333 9.433 -5.818 101 1HD2 LEU 261 1HD2 LEU 261 6.084 7.748 -5.169 102 2HD2 LEU 261 2HD2 LEU 261 5.334 6.188 -4.828 103 3HD2 LEU 261 3HD2 LEU 261 4.751 7.643 -4.019 104 H THR 262 H THR 262 -0.208 7.196 -5.250 105 HA THR 262 HA THR 262 -0.767 9.717 -6.396 106 HB THR 262 HB THR 262 -2.691 7.621 -5.359 107 HG1 THR 262 1HG THR 262 -1.515 6.724 -7.004 108 1HG2 THR 262 1HG2 THR 262 -3.725 9.139 -7.543 109 2HG2 THR 262 2HG2 THR 262 -3.209 10.248 -6.272 110 3HG2 THR 262 3HG2 THR 262 -4.369 8.971 -5.910 111 H MET 263 H MET 263 -1.716 8.305 -3.265 112 HA MET 263 HA MET 263 -3.148 10.539 -2.316 113 1HB MET 263 2HB MET 263 -3.307 8.250 -1.375 114 2HB MET 263 1HB MET 263 -1.694 8.437 -0.702 115 1HG MET 263 2HG MET 263 -3.378 8.802 0.992 116 2HG MET 263 1HG MET 263 -2.480 10.286 0.680 117 1HE MET 263 1HE MET 263 -4.268 11.349 2.096 118 2HE MET 263 2HE MET 263 -5.615 10.212 2.142 119 3HE MET 263 3HE MET 263 -5.857 11.843 1.514 120 H THR 264 H THR 264 0.208 9.509 -1.559 121 HA THR 264 HA THR 264 0.805 12.325 -0.976 122 HB THR 264 HB THR 264 0.509 11.074 1.127 123 HG1 THR 264 1HG THR 264 2.594 11.749 2.009 124 1HG2 THR 264 1HG2 THR 264 2.403 9.510 1.774 125 2HG2 THR 264 2HG2 THR 264 2.774 9.417 0.051 126 3HG2 THR 264 3HG2 THR 264 1.205 8.873 0.646 127 H THR 265 H THR 265 2.650 13.097 -1.826 128 HA THR 265 HA THR 265 4.087 11.483 -3.699 129 HB THR 265 HB THR 265 3.785 13.785 -4.270 130 HG1 THR 265 1HG THR 265 6.171 12.625 -4.189 131 1HG2 THR 265 1HG2 THR 265 4.757 15.623 -2.983 132 2HG2 THR 265 2HG2 THR 265 5.330 14.479 -1.769 133 3HG2 THR 265 3HG2 THR 265 3.599 14.715 -2.010 134 H GLN 266 H GLN 266 4.669 12.584 -0.436 135 HA GLN 266 HA GLN 266 6.760 10.665 -0.066 136 1HB GLN 266 2HB GLN 266 8.106 12.386 -1.111 137 2HB GLN 266 1HB GLN 266 7.455 13.608 -0.029 138 1HG GLN 266 2HG GLN 266 8.568 12.606 1.852 139 2HG GLN 266 1HG GLN 266 9.116 11.259 0.855 140 1HE2 GLN 266 1HE2 GLN 266 9.901 14.258 2.105 141 2HE2 GLN 266 2HE2 GLN 266 11.279 14.586 1.092 142 H SER 267 H SER 267 6.631 9.947 1.947 143 HA SER 267 HA SER 267 6.176 11.638 4.213 144 1HB SER 267 2HB SER 267 3.956 9.757 3.364 145 2HB SER 267 1HB SER 267 4.073 10.487 4.965 146 HG SER 267 HG SER 267 4.304 12.360 3.008 147 H SER 268 H SER 268 5.821 8.264 3.100 148 HA SER 268 HA SER 268 6.696 7.119 5.550 149 1HB SER 268 2HB SER 268 7.038 5.054 4.040 150 2HB SER 268 1HB SER 268 5.401 5.693 4.197 151 HG SER 268 HG SER 268 7.205 5.958 2.034 152 H GLY 269 H GLY 269 8.696 6.557 6.261 153 1HA GLY 269 2HA GLY 269 10.956 6.668 4.399 154 2HA GLY 269 1HA GLY 269 10.970 7.807 5.734 155 H SER 270 H SER 270 12.871 5.715 5.134 156 HA SER 270 HA SER 270 12.565 3.438 6.761 157 1HB SER 270 2HB SER 270 14.232 3.665 4.934 158 2HB SER 270 1HB SER 270 15.139 4.796 5.933 159 HG SER 270 HG SER 270 15.915 2.613 6.013 160 H ARG 271 H ARG 271 12.910 3.029 8.858 161 HA ARG 271 HA ARG 271 13.393 3.248 11.070 162 1HB ARG 271 2HB ARG 271 15.350 5.182 9.918 163 2HB ARG 271 1HB ARG 271 15.078 5.199 11.652 164 1HG ARG 271 2HG ARG 271 16.975 3.822 11.168 165 2HG ARG 271 1HG ARG 271 15.657 2.794 11.725 166 1HD ARG 271 2HD ARG 271 15.138 2.209 9.406 167 2HD ARG 271 1HD ARG 271 16.455 3.241 8.851 168 HE ARG 271 HE ARG 271 17.538 1.416 10.641 169 1HH1 ARG 271 1HH1 ARG 271 15.941 1.364 7.575 170 2HH1 ARG 271 2HH1 ARG 271 16.784 -0.046 7.028 171 1HH2 ARG 271 1HH2 ARG 271 18.636 -0.407 9.932 172 2HH2 ARG 271 2HH2 ARG 271 18.307 -1.044 8.362 173 H ALA 272 H ALA 272 13.115 6.492 9.639 174 HA ALA 272 HA ALA 272 10.923 7.062 11.503 175 1HB ALA 272 1HB ALA 272 12.692 9.355 11.066 176 2HB ALA 272 2HB ALA 272 13.429 8.057 12.002 177 3HB ALA 272 3HB ALA 272 11.917 8.791 12.548 178 H SER 273 H SER 273 9.235 7.807 10.384 179 HA SER 273 HA SER 273 9.657 8.669 7.627 180 1HB SER 273 2HB SER 273 7.093 8.109 9.127 181 2HB SER 273 1HB SER 273 7.212 8.503 7.411 182 HG SER 273 HG SER 273 8.773 6.383 8.354 183 H LEU 274 H LEU 274 7.830 10.307 6.952 184 HA LEU 274 HA LEU 274 7.330 12.496 6.796 185 1HB LEU 274 2HB LEU 274 6.125 11.897 8.946 186 2HB LEU 274 1HB LEU 274 7.479 12.606 9.803 187 HG LEU 274 HG LEU 274 7.016 14.771 8.692 188 1HD1 LEU 274 1HD1 LEU 274 4.598 14.857 7.718 189 2HD1 LEU 274 2HD1 LEU 274 4.870 13.142 7.410 190 3HD1 LEU 274 3HD1 LEU 274 5.944 14.346 6.701 191 1HD2 LEU 274 1HD2 LEU 274 4.525 13.775 10.039 192 2HD2 LEU 274 2HD2 LEU 274 5.261 15.376 10.120 193 3HD2 LEU 274 3HD2 LEU 274 6.034 14.007 10.921 194 HA PRO 275 HA PRO 275 11.943 13.465 8.115 195 1HB PRO 275 2HB PRO 275 12.413 12.967 5.216 196 2HB PRO 275 1HB PRO 275 13.455 12.615 6.603 197 1HG PRO 275 2HG PRO 275 12.182 10.629 5.458 198 2HG PRO 275 1HG PRO 275 12.186 10.756 7.233 199 1HD PRO 275 2HD PRO 275 10.023 11.557 5.304 200 2HD PRO 275 1HD PRO 275 9.886 10.593 6.800 201 H LYS 276 H LYS 276 10.162 14.119 5.143 202 HA LYS 276 HA LYS 276 9.992 16.906 5.545 203 1HB LYS 276 2HB LYS 276 12.380 16.821 4.906 204 2HB LYS 276 1HB LYS 276 11.952 16.001 3.413 205 1HG LYS 276 2HG LYS 276 10.677 18.621 3.945 206 2HG LYS 276 1HG LYS 276 12.392 18.610 3.535 207 1HD LYS 276 2HD LYS 276 12.018 17.834 1.408 208 2HD LYS 276 1HD LYS 276 10.529 17.001 1.859 209 1HE LYS 276 2HE LYS 276 10.842 19.994 1.680 210 2HE LYS 276 1HE LYS 276 10.152 18.978 0.413 211 1HZ LYS 276 1HZ LYS 276 8.952 19.936 2.834 212 2HZ LYS 276 2HZ LYS 276 8.761 18.255 2.653 213 3HZ LYS 276 3HZ LYS 276 8.220 19.318 1.439 Start of MODEL 6 1 1H ALA 249 1HT ALA 249 -3.086 -2.410 -13.074 2 2H ALA 249 2HT ALA 249 -1.954 -3.342 -13.914 3 3H ALA 249 3HT ALA 249 -2.001 -1.665 -14.137 4 HA ALA 249 HA ALA 249 -0.329 -1.638 -12.683 5 1HB ALA 249 1HB ALA 249 -2.170 -2.281 -10.454 6 2HB ALA 249 2HB ALA 249 -2.606 -0.934 -11.506 7 3HB ALA 249 3HB ALA 249 -1.061 -0.926 -10.657 8 HA PRO 250 HA PRO 250 1.465 -5.536 -11.654 9 1HB PRO 250 2HB PRO 250 2.783 -4.167 -9.382 10 2HB PRO 250 1HB PRO 250 3.501 -4.975 -10.779 11 1HG PRO 250 2HG PRO 250 3.550 -2.341 -10.603 12 2HG PRO 250 1HG PRO 250 3.201 -3.125 -12.159 13 1HD PRO 250 2HD PRO 250 1.283 -1.956 -10.164 14 2HD PRO 250 1HD PRO 250 1.356 -1.705 -11.923 15 H ALA 251 H ALA 251 -0.980 -5.794 -10.735 16 HA ALA 251 HA ALA 251 -2.340 -6.785 -9.221 17 1HB ALA 251 1HB ALA 251 -1.454 -8.589 -7.976 18 2HB ALA 251 2HB ALA 251 0.156 -7.869 -7.945 19 3HB ALA 251 3HB ALA 251 -0.507 -8.480 -9.460 20 H ARG 252 H ARG 252 -1.343 -7.483 -6.438 21 HA ARG 252 HA ARG 252 -2.567 -5.398 -5.040 22 1HB ARG 252 2HB ARG 252 -1.925 -7.924 -4.444 23 2HB ARG 252 1HB ARG 252 -0.603 -7.115 -3.621 24 1HG ARG 252 2HG ARG 252 -3.528 -6.566 -3.156 25 2HG ARG 252 1HG ARG 252 -2.507 -7.587 -2.145 26 1HD ARG 252 2HD ARG 252 -1.055 -5.622 -1.719 27 2HD ARG 252 1HD ARG 252 -2.189 -4.629 -2.633 28 HE ARG 252 HE ARG 252 -3.546 -6.008 -0.580 29 1HH1 ARG 252 1HH1 ARG 252 -1.381 -3.366 -1.098 30 2HH1 ARG 252 2HH1 ARG 252 -1.848 -2.542 0.346 31 1HH2 ARG 252 1HH2 ARG 252 -4.157 -4.935 1.300 32 2HH2 ARG 252 2HH2 ARG 252 -3.417 -3.426 1.698 33 H VAL 253 H VAL 253 0.909 -6.181 -5.261 34 HA VAL 253 HA VAL 253 1.826 -4.086 -3.653 35 HB VAL 253 HB VAL 253 3.218 -5.987 -4.310 36 1HG1 VAL 253 1HG1 VAL 253 2.623 -6.254 -6.620 37 2HG1 VAL 253 2HG1 VAL 253 4.367 -6.047 -6.465 38 3HG1 VAL 253 3HG1 VAL 253 3.366 -4.704 -7.014 39 1HG2 VAL 253 1HG2 VAL 253 4.022 -3.407 -3.890 40 2HG2 VAL 253 2HG2 VAL 253 4.916 -3.865 -5.339 41 3HG2 VAL 253 3HG2 VAL 253 5.069 -4.825 -3.868 42 H GLY 254 H GLY 254 1.428 -4.258 -7.148 43 1HA GLY 254 2HA GLY 254 2.335 -1.675 -7.791 44 2HA GLY 254 1HA GLY 254 1.201 -2.614 -8.752 45 H LEU 255 H LEU 255 -0.957 -2.814 -7.054 46 HA LEU 255 HA LEU 255 -2.246 -0.329 -7.399 47 1HB LEU 255 2HB LEU 255 -2.887 -2.917 -6.168 48 2HB LEU 255 1HB LEU 255 -3.748 -1.546 -5.493 49 HG LEU 255 HG LEU 255 -3.732 -2.374 -8.390 50 1HD1 LEU 255 1HD1 LEU 255 -6.296 -2.464 -7.602 51 2HD1 LEU 255 2HD1 LEU 255 -5.500 -2.898 -6.089 52 3HD1 LEU 255 3HD1 LEU 255 -5.212 -3.853 -7.544 53 1HD2 LEU 255 1HD2 LEU 255 -4.036 0.166 -7.400 54 2HD2 LEU 255 2HD2 LEU 255 -5.699 -0.416 -7.488 55 3HD2 LEU 255 3HD2 LEU 255 -4.686 -0.423 -8.931 56 H GLY 256 H GLY 256 -0.884 -1.900 -4.527 57 1HA GLY 256 2HA GLY 256 -1.635 0.032 -2.650 58 2HA GLY 256 1HA GLY 256 -0.274 -1.066 -2.486 59 H ILE 257 H ILE 257 1.480 -0.254 -4.422 60 HA ILE 257 HA ILE 257 2.532 2.113 -3.269 61 HB ILE 257 HB ILE 257 4.256 2.062 -5.019 62 1HG1 ILE 257 2HG1 ILE 257 4.034 -0.306 -6.344 63 2HG1 ILE 257 1HG1 ILE 257 2.351 0.208 -6.305 64 1HG2 ILE 257 1HG2 ILE 257 4.814 0.796 -3.166 65 2HG2 ILE 257 2HG2 ILE 257 5.041 -0.334 -4.501 66 3HG2 ILE 257 3HG2 ILE 257 3.589 -0.427 -3.506 67 1HD1 ILE 257 1HD1 ILE 257 2.934 1.231 -8.221 68 2HD1 ILE 257 2HD1 ILE 257 4.640 1.319 -7.783 69 3HD1 ILE 257 3HD1 ILE 257 3.499 2.488 -7.121 70 H THR 258 H THR 258 0.662 1.532 -6.223 71 HA THR 258 HA THR 258 0.951 4.104 -7.357 72 HB THR 258 HB THR 258 -1.410 2.221 -7.596 73 HG1 THR 258 1HG THR 258 0.362 1.176 -8.411 74 1HG2 THR 258 1HG2 THR 258 -0.997 4.875 -8.595 75 2HG2 THR 258 2HG2 THR 258 -2.387 3.812 -8.810 76 3HG2 THR 258 3HG2 THR 258 -1.037 3.739 -9.943 77 H THR 259 H THR 259 -1.510 2.778 -5.156 78 HA THR 259 HA THR 259 -3.055 5.144 -4.991 79 HB THR 259 HB THR 259 -4.008 4.141 -2.906 80 HG1 THR 259 1HG THR 259 -2.398 1.871 -3.491 81 1HG2 THR 259 1HG2 THR 259 -4.581 1.869 -4.238 82 2HG2 THR 259 2HG2 THR 259 -3.934 2.845 -5.557 83 3HG2 THR 259 3HG2 THR 259 -5.306 3.430 -4.618 84 H VAL 260 H VAL 260 -0.495 3.813 -2.890 85 HA VAL 260 HA VAL 260 -0.536 5.881 -0.978 86 HB VAL 260 HB VAL 260 1.748 4.106 -1.861 87 1HG1 VAL 260 1HG1 VAL 260 1.642 5.669 0.703 88 2HG1 VAL 260 2HG1 VAL 260 2.416 6.298 -0.752 89 3HG1 VAL 260 3HG1 VAL 260 3.010 4.814 -0.008 90 1HG2 VAL 260 1HG2 VAL 260 -0.409 3.907 0.183 91 2HG2 VAL 260 2HG2 VAL 260 1.164 3.193 0.538 92 3HG2 VAL 260 3HG2 VAL 260 0.257 2.668 -0.880 93 H LEU 261 H LEU 261 1.505 5.491 -3.900 94 HA LEU 261 HA LEU 261 2.943 7.889 -3.682 95 1HB LEU 261 2HB LEU 261 3.407 6.009 -5.261 96 2HB LEU 261 1HB LEU 261 2.072 6.576 -6.247 97 HG LEU 261 HG LEU 261 3.217 8.685 -6.645 98 1HD1 LEU 261 1HD1 LEU 261 5.737 7.741 -5.415 99 2HD1 LEU 261 2HD1 LEU 261 4.481 8.323 -4.321 100 3HD1 LEU 261 3HD1 LEU 261 5.102 9.378 -5.591 101 1HD2 LEU 261 1HD2 LEU 261 3.670 7.012 -8.250 102 2HD2 LEU 261 2HD2 LEU 261 4.799 6.186 -7.176 103 3HD2 LEU 261 3HD2 LEU 261 5.222 7.756 -7.860 104 H THR 262 H THR 262 -0.121 7.217 -5.362 105 HA THR 262 HA THR 262 -0.581 9.760 -6.449 106 HB THR 262 HB THR 262 -2.597 7.733 -5.449 107 HG1 THR 262 1HG THR 262 -1.411 6.823 -7.085 108 1HG2 THR 262 1HG2 THR 262 -3.741 9.808 -5.674 109 2HG2 THR 262 2HG2 THR 262 -4.119 8.853 -7.108 110 3HG2 THR 262 3HG2 THR 262 -2.936 10.160 -7.202 111 H MET 263 H MET 263 -1.608 8.394 -3.342 112 HA MET 263 HA MET 263 -2.956 10.702 -2.419 113 1HB MET 263 2HB MET 263 -3.366 8.465 -1.523 114 2HB MET 263 1HB MET 263 -1.738 8.419 -0.865 115 1HG MET 263 2HG MET 263 -2.272 10.247 0.640 116 2HG MET 263 1HG MET 263 -3.892 10.355 -0.048 117 1HE MET 263 1HE MET 263 -4.575 8.894 3.510 118 2HE MET 263 2HE MET 263 -4.631 10.316 2.471 119 3HE MET 263 3HE MET 263 -3.109 9.831 3.219 120 H THR 264 H THR 264 0.372 9.520 -1.769 121 HA THR 264 HA THR 264 0.993 11.627 0.030 122 HB THR 264 HB THR 264 2.280 9.539 0.040 123 HG1 THR 264 1HG THR 264 3.470 12.064 -0.180 124 1HG2 THR 264 1HG2 THR 264 2.525 9.936 -2.704 125 2HG2 THR 264 2HG2 THR 264 3.341 8.704 -1.740 126 3HG2 THR 264 3HG2 THR 264 4.140 10.242 -2.065 127 H THR 265 H THR 265 1.388 11.394 -3.488 128 HA THR 265 HA THR 265 3.003 13.774 -3.638 129 HB THR 265 HB THR 265 3.126 12.042 -5.410 130 HG1 THR 265 1HG THR 265 2.405 14.711 -6.057 131 1HG2 THR 265 1HG2 THR 265 0.615 11.629 -5.426 132 2HG2 THR 265 2HG2 THR 265 1.404 11.714 -7.002 133 3HG2 THR 265 3HG2 THR 265 0.484 13.093 -6.401 134 H GLN 266 H GLN 266 -0.160 13.391 -2.864 135 HA GLN 266 HA GLN 266 -1.965 14.747 -2.740 136 1HB GLN 266 2HB GLN 266 0.114 16.839 -3.364 137 2HB GLN 266 1HB GLN 266 -1.570 17.238 -3.054 138 1HG GLN 266 2HG GLN 266 -1.372 16.155 -0.837 139 2HG GLN 266 1HG GLN 266 0.342 15.894 -1.157 140 1HE2 GLN 266 1HE2 GLN 266 -1.805 17.883 0.332 141 2HE2 GLN 266 2HE2 GLN 266 -0.854 19.321 0.416 142 H SER 267 H SER 267 -1.831 13.298 -4.978 143 HA SER 267 HA SER 267 -2.073 14.785 -7.393 144 1HB SER 267 2HB SER 267 -1.485 12.418 -7.436 145 2HB SER 267 1HB SER 267 -3.033 11.997 -6.703 146 HG SER 267 HG SER 267 -3.152 11.703 -8.930 147 H SER 268 H SER 268 -3.957 15.193 -8.626 148 HA SER 268 HA SER 268 -6.144 16.216 -7.132 149 1HB SER 268 2HB SER 268 -5.973 15.791 -10.122 150 2HB SER 268 1HB SER 268 -7.054 16.895 -9.273 151 HG SER 268 HG SER 268 -5.368 18.132 -9.919 152 H GLY 269 H GLY 269 -6.289 13.763 -6.250 153 1HA GLY 269 2HA GLY 269 -8.884 12.874 -6.879 154 2HA GLY 269 1HA GLY 269 -7.735 11.848 -7.729 155 H SER 270 H SER 270 -7.983 9.957 -6.600 156 HA SER 270 HA SER 270 -7.779 8.447 -4.911 157 1HB SER 270 2HB SER 270 -5.457 9.406 -4.914 158 2HB SER 270 1HB SER 270 -5.951 10.479 -3.607 159 HG SER 270 HG SER 270 -5.048 8.020 -3.397 160 H ARG 271 H ARG 271 -7.139 9.377 -2.067 161 HA ARG 271 HA ARG 271 -8.194 9.939 -0.129 162 1HB ARG 271 2HB ARG 271 -10.114 11.349 -1.979 163 2HB ARG 271 1HB ARG 271 -10.265 11.381 -0.228 164 1HG ARG 271 2HG ARG 271 -8.331 12.639 0.044 165 2HG ARG 271 1HG ARG 271 -7.722 12.223 -1.558 166 1HD ARG 271 2HD ARG 271 -8.508 14.539 -1.466 167 2HD ARG 271 1HD ARG 271 -9.461 13.576 -2.591 168 HE ARG 271 HE ARG 271 -11.299 13.940 -1.288 169 1HH1 ARG 271 1HH1 ARG 271 -8.497 14.777 0.581 170 2HH1 ARG 271 2HH1 ARG 271 -9.428 15.438 1.881 171 1HH2 ARG 271 1HH2 ARG 271 -12.482 14.797 0.398 172 2HH2 ARG 271 2HH2 ARG 271 -11.668 15.449 1.775 173 H ALA 272 H ALA 272 -9.113 8.435 1.082 174 HA ALA 272 HA ALA 272 -10.417 6.706 1.793 175 1HB ALA 272 1HB ALA 272 -12.133 8.718 1.060 176 2HB ALA 272 2HB ALA 272 -12.583 7.254 1.934 177 3HB ALA 272 3HB ALA 272 -12.772 7.328 0.182 178 H SER 273 H SER 273 -12.712 5.720 -0.057 179 HA SER 273 HA SER 273 -11.059 3.761 -1.442 180 1HB SER 273 2HB SER 273 -13.203 2.642 -1.969 181 2HB SER 273 1HB SER 273 -12.940 2.864 -0.240 182 HG SER 273 HG SER 273 -14.626 4.370 -1.954 183 H LEU 274 H LEU 274 -10.584 6.070 -2.574 184 HA LEU 274 HA LEU 274 -11.880 5.709 -5.181 185 1HB LEU 274 2HB LEU 274 -11.298 8.288 -3.768 186 2HB LEU 274 1HB LEU 274 -11.336 8.224 -5.518 187 HG LEU 274 HG LEU 274 -13.457 8.952 -4.909 188 1HD1 LEU 274 1HD1 LEU 274 -14.590 6.357 -5.038 189 2HD1 LEU 274 2HD1 LEU 274 -13.168 6.415 -6.079 190 3HD1 LEU 274 3HD1 LEU 274 -14.470 7.584 -6.299 191 1HD2 LEU 274 1HD2 LEU 274 -14.518 6.967 -3.191 192 2HD2 LEU 274 2HD2 LEU 274 -14.283 8.687 -2.881 193 3HD2 LEU 274 3HD2 LEU 274 -12.996 7.541 -2.506 194 HA PRO 275 HA PRO 275 -7.071 5.220 -4.971 195 1HB PRO 275 2HB PRO 275 -7.989 2.713 -6.310 196 2HB PRO 275 1HB PRO 275 -6.640 2.960 -5.193 197 1HG PRO 275 2HG PRO 275 -8.822 1.866 -4.265 198 2HG PRO 275 1HG PRO 275 -8.068 3.188 -3.347 199 1HD PRO 275 2HD PRO 275 -10.462 3.289 -5.160 200 2HD PRO 275 1HD PRO 275 -10.252 3.998 -3.537 201 H LYS 276 H LYS 276 -8.331 6.906 -6.849 202 HA LYS 276 HA LYS 276 -6.728 6.393 -9.178 203 1HB LYS 276 2HB LYS 276 -8.689 5.055 -9.708 204 2HB LYS 276 1HB LYS 276 -9.751 6.409 -9.356 205 1HG LYS 276 2HG LYS 276 -8.046 7.404 -11.284 206 2HG LYS 276 1HG LYS 276 -8.338 5.737 -11.788 207 1HD LYS 276 2HD LYS 276 -10.015 7.140 -12.770 208 2HD LYS 276 1HD LYS 276 -10.767 6.143 -11.526 209 1HE LYS 276 2HE LYS 276 -11.545 8.485 -11.485 210 2HE LYS 276 1HE LYS 276 -10.774 7.985 -9.981 211 1HZ LYS 276 1HZ LYS 276 -8.711 9.088 -10.759 212 2HZ LYS 276 2HZ LYS 276 -10.010 10.164 -10.579 213 3HZ LYS 276 3HZ LYS 276 -9.559 9.649 -12.123 Start of MODEL 7 1 1H ALA 249 1HT ALA 249 -1.648 -1.504 -14.608 2 2H ALA 249 2HT ALA 249 -1.994 -0.083 -13.759 3 3H ALA 249 3HT ALA 249 -2.942 -1.464 -13.519 4 HA ALA 249 HA ALA 249 -0.059 -1.305 -12.884 5 1HB ALA 249 1HB ALA 249 -0.514 -0.771 -10.700 6 2HB ALA 249 2HB ALA 249 -2.189 -1.327 -10.796 7 3HB ALA 249 3HB ALA 249 -1.718 0.193 -11.557 8 HA PRO 250 HA PRO 250 -0.292 -5.691 -12.396 9 1HB PRO 250 2HB PRO 250 1.464 -6.150 -10.425 10 2HB PRO 250 1HB PRO 250 1.974 -5.518 -11.994 11 1HG PRO 250 2HG PRO 250 1.425 -4.025 -9.455 12 2HG PRO 250 1HG PRO 250 2.843 -3.924 -10.519 13 1HD PRO 250 2HD PRO 250 0.840 -2.152 -10.663 14 2HD PRO 250 1HD PRO 250 1.715 -2.695 -12.109 15 H ALA 251 H ALA 251 0.390 -6.790 -9.668 16 HA ALA 251 HA ALA 251 -2.304 -7.221 -8.806 17 1HB ALA 251 1HB ALA 251 -1.208 -9.144 -8.435 18 2HB ALA 251 2HB ALA 251 -0.834 -8.406 -6.878 19 3HB ALA 251 3HB ALA 251 0.343 -8.341 -8.191 20 H ARG 252 H ARG 252 -1.521 -7.548 -5.964 21 HA ARG 252 HA ARG 252 -2.616 -5.218 -4.897 22 1HB ARG 252 2HB ARG 252 -2.164 -7.680 -3.939 23 2HB ARG 252 1HB ARG 252 -0.821 -6.846 -3.177 24 1HG ARG 252 2HG ARG 252 -3.704 -6.014 -2.921 25 2HG ARG 252 1HG ARG 252 -2.841 -7.019 -1.759 26 1HD ARG 252 2HD ARG 252 -1.263 -5.212 -1.348 27 2HD ARG 252 1HD ARG 252 -2.083 -4.208 -2.542 28 HE ARG 252 HE ARG 252 -3.921 -5.050 -0.583 29 1HH1 ARG 252 1HH1 ARG 252 -1.243 -2.898 -0.998 30 2HH1 ARG 252 2HH1 ARG 252 -1.781 -1.803 0.223 31 1HH2 ARG 252 1HH2 ARG 252 -4.616 -3.625 1.000 32 2HH2 ARG 252 2HH2 ARG 252 -3.684 -2.214 1.350 33 H VAL 253 H VAL 253 0.780 -6.187 -5.185 34 HA VAL 253 HA VAL 253 1.963 -4.161 -3.690 35 HB VAL 253 HB VAL 253 3.245 -6.043 -4.456 36 1HG1 VAL 253 1HG1 VAL 253 2.031 -5.984 -6.778 37 2HG1 VAL 253 2HG1 VAL 253 3.631 -6.703 -6.594 38 3HG1 VAL 253 3HG1 VAL 253 3.468 -5.071 -7.241 39 1HG2 VAL 253 1HG2 VAL 253 5.280 -4.976 -4.952 40 2HG2 VAL 253 2HG2 VAL 253 4.339 -3.790 -4.049 41 3HG2 VAL 253 3HG2 VAL 253 4.469 -3.662 -5.802 42 H GLY 254 H GLY 254 1.398 -4.229 -7.176 43 1HA GLY 254 2HA GLY 254 2.280 -1.618 -7.748 44 2HA GLY 254 1HA GLY 254 1.167 -2.551 -8.739 45 H LEU 255 H LEU 255 -0.983 -2.838 -7.038 46 HA LEU 255 HA LEU 255 -2.366 -0.422 -7.363 47 1HB LEU 255 2HB LEU 255 -2.856 -2.969 -5.942 48 2HB LEU 255 1HB LEU 255 -3.820 -1.589 -5.446 49 HG LEU 255 HG LEU 255 -3.643 -2.699 -8.240 50 1HD1 LEU 255 1HD1 LEU 255 -5.364 -3.226 -5.939 51 2HD1 LEU 255 2HD1 LEU 255 -5.099 -4.178 -7.400 52 3HD1 LEU 255 3HD1 LEU 255 -6.242 -2.834 -7.417 53 1HD2 LEU 255 1HD2 LEU 255 -5.808 -0.872 -7.703 54 2HD2 LEU 255 2HD2 LEU 255 -4.588 -0.824 -8.976 55 3HD2 LEU 255 3HD2 LEU 255 -4.246 -0.109 -7.401 56 H GLY 256 H GLY 256 -0.896 -1.870 -4.481 57 1HA GLY 256 2HA GLY 256 -1.663 0.144 -2.678 58 2HA GLY 256 1HA GLY 256 -0.337 -0.983 -2.453 59 H ILE 257 H ILE 257 1.488 -0.292 -4.370 60 HA ILE 257 HA ILE 257 2.614 2.048 -3.269 61 HB ILE 257 HB ILE 257 4.324 1.936 -5.027 62 1HG1 ILE 257 2HG1 ILE 257 3.948 -0.462 -6.323 63 2HG1 ILE 257 1HG1 ILE 257 2.329 0.229 -6.336 64 1HG2 ILE 257 1HG2 ILE 257 4.828 0.648 -3.167 65 2HG2 ILE 257 2HG2 ILE 257 5.037 -0.477 -4.510 66 3HG2 ILE 257 3HG2 ILE 257 3.575 -0.540 -3.525 67 1HD1 ILE 257 1HD1 ILE 257 4.696 1.834 -7.214 68 2HD1 ILE 257 2HD1 ILE 257 2.991 2.061 -7.603 69 3HD1 ILE 257 3HD1 ILE 257 3.885 0.715 -8.309 70 H THR 258 H THR 258 0.790 1.568 -6.297 71 HA THR 258 HA THR 258 1.179 4.221 -7.240 72 HB THR 258 HB THR 258 -0.890 3.807 -8.634 73 HG1 THR 258 1HG THR 258 -0.682 1.119 -7.741 74 1HG2 THR 258 1HG2 THR 258 1.210 3.390 -9.645 75 2HG2 THR 258 2HG2 THR 258 0.215 1.974 -9.985 76 3HG2 THR 258 3HG2 THR 258 1.443 1.907 -8.719 77 H THR 259 H THR 259 -1.333 2.723 -5.220 78 HA THR 259 HA THR 259 -3.034 4.989 -5.082 79 HB THR 259 HB THR 259 -2.674 2.783 -3.035 80 HG1 THR 259 1HG THR 259 -3.370 1.875 -4.948 81 1HG2 THR 259 1HG2 THR 259 -4.443 3.585 -1.874 82 2HG2 THR 259 2HG2 THR 259 -5.267 4.161 -3.323 83 3HG2 THR 259 3HG2 THR 259 -3.970 5.118 -2.605 84 H VAL 260 H VAL 260 -0.455 3.810 -2.921 85 HA VAL 260 HA VAL 260 -0.588 5.899 -1.038 86 HB VAL 260 HB VAL 260 1.754 4.166 -1.847 87 1HG1 VAL 260 1HG1 VAL 260 3.085 5.400 -0.569 88 2HG1 VAL 260 2HG1 VAL 260 2.009 5.148 0.806 89 3HG1 VAL 260 3HG1 VAL 260 1.760 6.524 -0.269 90 1HG2 VAL 260 1HG2 VAL 260 1.135 2.704 -0.190 91 2HG2 VAL 260 2HG2 VAL 260 -0.446 3.269 -0.729 92 3HG2 VAL 260 3HG2 VAL 260 0.279 3.939 0.732 93 H LEU 261 H LEU 261 1.475 5.521 -3.935 94 HA LEU 261 HA LEU 261 2.917 7.909 -3.720 95 1HB LEU 261 2HB LEU 261 2.638 5.842 -5.596 96 2HB LEU 261 1HB LEU 261 2.252 7.312 -6.469 97 HG LEU 261 HG LEU 261 4.608 6.724 -6.699 98 1HD1 LEU 261 1HD1 LEU 261 5.121 9.038 -5.101 99 2HD1 LEU 261 2HD1 LEU 261 3.576 9.221 -5.932 100 3HD1 LEU 261 3HD1 LEU 261 5.041 8.889 -6.855 101 1HD2 LEU 261 1HD2 LEU 261 6.044 7.081 -4.605 102 2HD2 LEU 261 2HD2 LEU 261 5.167 5.558 -4.757 103 3HD2 LEU 261 3HD2 LEU 261 4.548 6.831 -3.704 104 H THR 262 H THR 262 -0.199 7.240 -5.252 105 HA THR 262 HA THR 262 -0.683 9.791 -6.339 106 HB THR 262 HB THR 262 -2.684 7.763 -5.313 107 HG1 THR 262 1HG THR 262 -1.551 6.813 -6.953 108 1HG2 THR 262 1HG2 THR 262 -3.491 9.488 -7.522 109 2HG2 THR 262 2HG2 THR 262 -3.192 10.370 -6.024 110 3HG2 THR 262 3HG2 THR 262 -4.360 9.050 -6.050 111 H MET 263 H MET 263 -1.671 8.378 -3.222 112 HA MET 263 HA MET 263 -3.005 10.663 -2.241 113 1HB MET 263 2HB MET 263 -1.711 8.371 -0.765 114 2HB MET 263 1HB MET 263 -2.735 9.582 -0.006 115 1HG MET 263 2HG MET 263 -4.605 8.899 -1.400 116 2HG MET 263 1HG MET 263 -3.583 7.710 -2.205 117 1HE MET 263 1HE MET 263 -5.519 8.390 1.402 118 2HE MET 263 2HE MET 263 -3.848 8.949 1.339 119 3HE MET 263 3HE MET 263 -4.270 7.538 2.311 120 H THR 264 H THR 264 0.297 9.482 -1.430 121 HA THR 264 HA THR 264 0.949 12.265 -0.710 122 HB THR 264 HB THR 264 0.695 10.840 1.288 123 HG1 THR 264 1HG THR 264 3.396 11.279 1.465 124 1HG2 THR 264 1HG2 THR 264 2.884 9.327 1.582 125 2HG2 THR 264 2HG2 THR 264 2.654 9.164 -0.159 126 3HG2 THR 264 3HG2 THR 264 1.361 8.702 0.948 127 H THR 265 H THR 265 2.790 13.110 -1.520 128 HA THR 265 HA THR 265 4.090 11.824 -3.668 129 HB THR 265 HB THR 265 4.030 14.189 -3.724 130 HG1 THR 265 1HG THR 265 6.583 14.474 -3.372 131 1HG2 THR 265 1HG2 THR 265 4.954 13.981 -0.938 132 2HG2 THR 265 2HG2 THR 265 3.929 15.194 -1.707 133 3HG2 THR 265 3HG2 THR 265 5.684 15.289 -1.872 134 H GLN 266 H GLN 266 5.550 10.312 -3.667 135 HA GLN 266 HA GLN 266 7.322 8.991 -3.179 136 1HB GLN 266 2HB GLN 266 8.612 11.056 -2.987 137 2HB GLN 266 1HB GLN 266 8.126 11.218 -1.305 138 1HG GLN 266 2HG GLN 266 9.278 9.075 -0.823 139 2HG GLN 266 1HG GLN 266 9.858 9.060 -2.488 140 1HE2 GLN 266 1HE2 GLN 266 10.764 9.722 0.541 141 2HE2 GLN 266 2HE2 GLN 266 11.961 10.929 0.250 142 H SER 267 H SER 267 6.457 10.496 -0.072 143 HA SER 267 HA SER 267 5.291 8.159 1.027 144 1HB SER 267 2HB SER 267 7.657 7.390 1.022 145 2HB SER 267 1HB SER 267 8.096 8.781 2.010 146 HG SER 267 HG SER 267 7.051 6.406 2.765 147 H SER 268 H SER 268 6.550 8.916 3.726 148 HA SER 268 HA SER 268 6.040 10.224 5.515 149 1HB SER 268 2HB SER 268 7.258 11.948 4.226 150 2HB SER 268 1HB SER 268 5.751 12.426 3.449 151 HG SER 268 HG SER 268 6.734 13.317 5.720 152 H GLY 269 H GLY 269 4.154 12.636 5.126 153 1HA GLY 269 2HA GLY 269 1.618 11.219 4.690 154 2HA GLY 269 1HA GLY 269 1.898 11.912 6.280 155 H SER 270 H SER 270 1.631 12.696 2.843 156 HA SER 270 HA SER 270 1.615 15.494 3.066 157 1HB SER 270 2HB SER 270 0.185 13.776 1.022 158 2HB SER 270 1HB SER 270 0.529 15.497 0.857 159 HG SER 270 HG SER 270 2.369 13.332 0.951 160 H ARG 271 H ARG 271 0.083 16.983 3.533 161 HA ARG 271 HA ARG 271 -2.171 16.265 5.049 162 1HB ARG 271 2HB ARG 271 -1.059 18.437 5.275 163 2HB ARG 271 1HB ARG 271 -1.578 18.884 3.656 164 1HG ARG 271 2HG ARG 271 -3.924 18.738 4.394 165 2HG ARG 271 1HG ARG 271 -3.365 18.370 6.026 166 1HD ARG 271 2HD ARG 271 -2.231 20.529 6.133 167 2HD ARG 271 1HD ARG 271 -2.752 20.893 4.488 168 HE ARG 271 HE ARG 271 -5.007 20.312 6.049 169 1HH1 ARG 271 1HH1 ARG 271 -2.592 22.763 5.710 170 2HH1 ARG 271 2HH1 ARG 271 -3.617 24.023 6.299 171 1HH2 ARG 271 1HH2 ARG 271 -6.337 21.948 6.810 172 2HH2 ARG 271 2HH2 ARG 271 -5.730 23.562 6.920 173 H ALA 272 H ALA 272 -1.860 17.129 1.630 174 HA ALA 272 HA ALA 272 -4.705 17.090 1.188 175 1HB ALA 272 1HB ALA 272 -2.349 17.879 -0.288 176 2HB ALA 272 2HB ALA 272 -4.015 18.439 -0.429 177 3HB ALA 272 3HB ALA 272 -3.493 16.995 -1.296 178 H SER 273 H SER 273 -3.645 14.564 2.219 179 HA SER 273 HA SER 273 -3.658 12.712 -0.017 180 1HB SER 273 2HB SER 273 -3.763 12.143 2.947 181 2HB SER 273 1HB SER 273 -3.554 10.944 1.674 182 HG SER 273 HG SER 273 -1.756 12.905 2.599 183 H LEU 274 H LEU 274 -5.829 13.956 -0.457 184 HA LEU 274 HA LEU 274 -7.923 12.077 0.401 185 1HB LEU 274 2HB LEU 274 -8.098 14.375 1.459 186 2HB LEU 274 1HB LEU 274 -8.400 15.004 -0.148 187 HG LEU 274 HG LEU 274 -10.425 13.597 -0.304 188 1HD1 LEU 274 1HD1 LEU 274 -9.272 12.325 1.961 189 2HD1 LEU 274 2HD1 LEU 274 -10.731 11.887 1.072 190 3HD1 LEU 274 3HD1 LEU 274 -10.830 13.001 2.435 191 1HD2 LEU 274 1HD2 LEU 274 -10.618 15.154 2.243 192 2HD2 LEU 274 2HD2 LEU 274 -11.769 15.037 0.911 193 3HD2 LEU 274 3HD2 LEU 274 -10.287 15.975 0.716 194 HA PRO 275 HA PRO 275 -7.389 12.819 -4.360 195 1HB PRO 275 2HB PRO 275 -6.362 10.031 -4.296 196 2HB PRO 275 1HB PRO 275 -5.812 11.416 -5.251 197 1HG PRO 275 2HG PRO 275 -4.351 10.651 -3.216 198 2HG PRO 275 1HG PRO 275 -4.711 12.383 -3.427 199 1HD PRO 275 2HD PRO 275 -6.088 10.404 -1.622 200 2HD PRO 275 1HD PRO 275 -5.383 11.986 -1.189 201 H LYS 276 H LYS 276 -9.605 12.775 -4.583 202 HA LYS 276 HA LYS 276 -10.803 10.438 -5.614 203 1HB LYS 276 2HB LYS 276 -12.620 10.202 -3.883 204 2HB LYS 276 1HB LYS 276 -11.035 9.649 -3.371 205 1HG LYS 276 2HG LYS 276 -11.796 10.785 -1.517 206 2HG LYS 276 1HG LYS 276 -10.807 12.002 -2.323 207 1HD LYS 276 2HD LYS 276 -13.265 12.413 -3.458 208 2HD LYS 276 1HD LYS 276 -13.689 11.955 -1.805 209 1HE LYS 276 2HE LYS 276 -13.412 14.372 -2.007 210 2HE LYS 276 1HE LYS 276 -12.193 13.677 -0.938 211 1HZ LYS 276 1HZ LYS 276 -11.468 15.371 -2.711 212 2HZ LYS 276 2HZ LYS 276 -11.611 14.081 -3.811 213 3HZ LYS 276 3HZ LYS 276 -10.528 13.973 -2.498 Start of MODEL 8 1 1H ALA 249 1HT ALA 249 2.290 -4.175 -14.553 2 2H ALA 249 2HT ALA 249 0.688 -3.675 -14.341 3 3H ALA 249 3HT ALA 249 1.131 -5.267 -13.974 4 HA ALA 249 HA ALA 249 2.726 -3.388 -12.552 5 1HB ALA 249 1HB ALA 249 1.230 -2.128 -11.431 6 2HB ALA 249 2HB ALA 249 -0.016 -3.375 -11.466 7 3HB ALA 249 3HB ALA 249 0.266 -2.371 -12.887 8 HA PRO 250 HA PRO 250 3.061 -6.994 -10.033 9 1HB PRO 250 2HB PRO 250 3.481 -5.224 -7.715 10 2HB PRO 250 1HB PRO 250 4.597 -6.357 -8.479 11 1HG PRO 250 2HG PRO 250 4.947 -3.735 -8.720 12 2HG PRO 250 1HG PRO 250 5.251 -4.823 -10.091 13 1HD PRO 250 2HD PRO 250 2.818 -3.162 -9.508 14 2HD PRO 250 1HD PRO 250 3.739 -3.301 -11.023 15 H ALA 251 H ALA 251 0.360 -6.433 -10.350 16 HA ALA 251 HA ALA 251 -1.717 -6.642 -9.427 17 1HB ALA 251 1HB ALA 251 -0.798 -8.382 -7.253 18 2HB ALA 251 2HB ALA 251 -0.221 -8.824 -8.860 19 3HB ALA 251 3HB ALA 251 -1.951 -8.690 -8.552 20 H ARG 252 H ARG 252 -1.406 -7.528 -6.318 21 HA ARG 252 HA ARG 252 -2.641 -5.300 -5.206 22 1HB ARG 252 2HB ARG 252 -2.010 -7.846 -4.374 23 2HB ARG 252 1HB ARG 252 -1.020 -6.851 -3.319 24 1HG ARG 252 2HG ARG 252 -3.998 -6.565 -3.669 25 2HG ARG 252 1HG ARG 252 -3.204 -7.414 -2.343 26 1HD ARG 252 2HD ARG 252 -2.084 -5.315 -1.704 27 2HD ARG 252 1HD ARG 252 -2.940 -4.482 -3.000 28 HE ARG 252 HE ARG 252 -4.814 -5.761 -1.355 29 1HH1 ARG 252 1HH1 ARG 252 -2.580 -3.130 -1.276 30 2HH1 ARG 252 2HH1 ARG 252 -3.481 -2.241 -0.103 31 1HH2 ARG 252 1HH2 ARG 252 -5.992 -4.596 0.175 32 2HH2 ARG 252 2HH2 ARG 252 -5.405 -3.064 0.712 33 H VAL 253 H VAL 253 0.793 -6.156 -5.290 34 HA VAL 253 HA VAL 253 1.732 -4.107 -3.594 35 HB VAL 253 HB VAL 253 3.210 -5.390 -5.902 36 1HG1 VAL 253 1HG1 VAL 253 5.194 -4.615 -4.993 37 2HG1 VAL 253 2HG1 VAL 253 4.479 -4.340 -3.405 38 3HG1 VAL 253 3HG1 VAL 253 4.106 -3.250 -4.740 39 1HG2 VAL 253 1HG2 VAL 253 4.172 -6.778 -3.939 40 2HG2 VAL 253 2HG2 VAL 253 2.595 -7.207 -4.601 41 3HG2 VAL 253 3HG2 VAL 253 2.701 -6.296 -3.096 42 H GLY 254 H GLY 254 1.316 -4.274 -7.104 43 1HA GLY 254 2HA GLY 254 2.329 -1.718 -7.739 44 2HA GLY 254 1HA GLY 254 1.195 -2.639 -8.718 45 H LEU 255 H LEU 255 -0.996 -2.797 -7.069 46 HA LEU 255 HA LEU 255 -2.236 -0.279 -7.426 47 1HB LEU 255 2HB LEU 255 -3.295 -2.606 -7.234 48 2HB LEU 255 1HB LEU 255 -3.204 -2.355 -5.499 49 HG LEU 255 HG LEU 255 -4.524 -0.276 -5.772 50 1HD1 LEU 255 1HD1 LEU 255 -4.085 0.380 -7.984 51 2HD1 LEU 255 2HD1 LEU 255 -5.785 -0.087 -7.960 52 3HD1 LEU 255 3HD1 LEU 255 -4.578 -1.184 -8.631 53 1HD2 LEU 255 1HD2 LEU 255 -5.891 -2.704 -6.913 54 2HD2 LEU 255 2HD2 LEU 255 -6.642 -1.369 -6.041 55 3HD2 LEU 255 3HD2 LEU 255 -5.549 -2.467 -5.200 56 H GLY 256 H GLY 256 -0.823 -1.870 -4.597 57 1HA GLY 256 2HA GLY 256 -1.582 0.034 -2.664 58 2HA GLY 256 1HA GLY 256 -0.219 -1.068 -2.534 59 H ILE 257 H ILE 257 1.551 -0.276 -4.410 60 HA ILE 257 HA ILE 257 2.594 2.101 -3.283 61 HB ILE 257 HB ILE 257 4.330 2.030 -5.022 62 1HG1 ILE 257 2HG1 ILE 257 4.126 -0.341 -6.328 63 2HG1 ILE 257 1HG1 ILE 257 2.434 0.142 -6.287 64 1HG2 ILE 257 1HG2 ILE 257 4.053 0.428 -2.914 65 2HG2 ILE 257 2HG2 ILE 257 5.443 0.351 -3.997 66 3HG2 ILE 257 3HG2 ILE 257 4.116 -0.796 -4.183 67 1HD1 ILE 257 1HD1 ILE 257 3.052 2.277 -7.347 68 2HD1 ILE 257 2HD1 ILE 257 3.456 0.876 -8.339 69 3HD1 ILE 257 3HD1 ILE 257 4.722 1.718 -7.445 70 H THR 258 H THR 258 0.695 1.521 -6.202 71 HA THR 258 HA THR 258 1.039 4.086 -7.360 72 HB THR 258 HB THR 258 -1.331 2.218 -7.619 73 HG1 THR 258 1HG THR 258 0.437 1.157 -8.414 74 1HG2 THR 258 1HG2 THR 258 -2.274 3.693 -9.001 75 2HG2 THR 258 2HG2 THR 258 -0.779 3.860 -9.922 76 3HG2 THR 258 3HG2 THR 258 -1.057 4.865 -8.499 77 H THR 259 H THR 259 -1.487 2.777 -5.207 78 HA THR 259 HA THR 259 -2.981 5.178 -5.061 79 HB THR 259 HB THR 259 -3.945 4.187 -2.941 80 HG1 THR 259 1HG THR 259 -2.533 1.836 -3.676 81 1HG2 THR 259 1HG2 THR 259 -4.003 2.238 -5.230 82 2HG2 THR 259 2HG2 THR 259 -4.777 3.820 -5.330 83 3HG2 THR 259 3HG2 THR 259 -5.299 2.658 -4.110 84 H VAL 260 H VAL 260 -0.460 3.815 -2.935 85 HA VAL 260 HA VAL 260 -0.511 5.848 -0.992 86 HB VAL 260 HB VAL 260 1.789 4.109 -1.900 87 1HG1 VAL 260 1HG1 VAL 260 2.277 6.363 -0.646 88 2HG1 VAL 260 2HG1 VAL 260 3.109 4.878 -0.187 89 3HG1 VAL 260 3HG1 VAL 260 1.737 5.448 0.762 90 1HG2 VAL 260 1HG2 VAL 260 -0.517 3.705 -0.198 91 2HG2 VAL 260 2HG2 VAL 260 0.991 3.406 0.664 92 3HG2 VAL 260 3HG2 VAL 260 0.640 2.531 -0.826 93 H LEU 261 H LEU 261 1.479 5.557 -3.950 94 HA LEU 261 HA LEU 261 2.883 7.989 -3.644 95 1HB LEU 261 2HB LEU 261 3.440 6.103 -5.214 96 2HB LEU 261 1HB LEU 261 2.150 6.681 -6.254 97 HG LEU 261 HG LEU 261 3.301 8.798 -6.573 98 1HD1 LEU 261 1HD1 LEU 261 4.339 8.920 -4.340 99 2HD1 LEU 261 2HD1 LEU 261 5.496 9.215 -5.638 100 3HD1 LEU 261 3HD1 LEU 261 5.472 7.655 -4.818 101 1HD2 LEU 261 1HD2 LEU 261 4.356 6.221 -7.330 102 2HD2 LEU 261 2HD2 LEU 261 5.627 7.442 -7.265 103 3HD2 LEU 261 3HD2 LEU 261 4.207 7.700 -8.278 104 H THR 262 H THR 262 -0.208 7.204 -5.153 105 HA THR 262 HA THR 262 -0.696 9.712 -6.373 106 HB THR 262 HB THR 262 -2.670 7.648 -5.365 107 HG1 THR 262 1HG THR 262 -1.418 6.771 -6.991 108 1HG2 THR 262 1HG2 THR 262 -4.054 9.462 -5.648 109 2HG2 THR 262 2HG2 THR 262 -4.046 8.808 -7.286 110 3HG2 THR 262 3HG2 THR 262 -3.027 10.189 -6.886 111 H MET 263 H MET 263 -1.746 8.376 -3.239 112 HA MET 263 HA MET 263 -3.122 10.709 -2.397 113 1HB MET 263 2HB MET 263 -1.965 8.440 -0.776 114 2HB MET 263 1HB MET 263 -3.037 9.678 -0.137 115 1HG MET 263 2HG MET 263 -4.776 8.956 -1.716 116 2HG MET 263 1HG MET 263 -3.702 7.681 -2.287 117 1HE MET 263 1HE MET 263 -2.236 6.777 0.134 118 2HE MET 263 2HE MET 263 -3.063 5.433 -0.652 119 3HE MET 263 3HE MET 263 -3.212 5.662 1.090 120 H THR 264 H THR 264 0.146 9.496 -1.519 121 HA THR 264 HA THR 264 0.798 12.258 -0.729 122 HB THR 264 HB THR 264 0.499 10.837 1.250 123 HG1 THR 264 1HG THR 264 1.988 12.135 2.014 124 1HG2 THR 264 1HG2 THR 264 2.995 9.332 0.663 125 2HG2 THR 264 2HG2 THR 264 1.492 8.784 -0.080 126 3HG2 THR 264 3HG2 THR 264 1.620 8.890 1.676 127 H THR 265 H THR 265 2.666 13.095 -1.477 128 HA THR 265 HA THR 265 4.113 11.618 -3.472 129 HB THR 265 HB THR 265 3.786 13.903 -3.990 130 HG1 THR 265 1HG THR 265 6.491 13.494 -3.177 131 1HG2 THR 265 1HG2 THR 265 3.698 15.529 -2.469 132 2HG2 THR 265 2HG2 THR 265 5.383 15.257 -2.024 133 3HG2 THR 265 3HG2 THR 265 4.103 14.343 -1.227 134 H GLN 266 H GLN 266 4.603 10.027 -1.607 135 HA GLN 266 HA GLN 266 6.670 10.571 0.244 136 1HB GLN 266 2HB GLN 266 5.087 8.669 0.405 137 2HB GLN 266 1HB GLN 266 5.882 7.918 -0.972 138 1HG GLN 266 2HG GLN 266 6.758 6.857 0.926 139 2HG GLN 266 1HG GLN 266 8.008 7.976 0.387 140 1HE2 GLN 266 1HE2 GLN 266 5.147 9.083 2.033 141 2HE2 GLN 266 2HE2 GLN 266 5.927 9.516 3.516 142 H SER 267 H SER 267 8.418 11.586 -0.775 143 HA SER 267 HA SER 267 9.699 10.398 -3.069 144 1HB SER 267 2HB SER 267 11.349 12.207 -2.825 145 2HB SER 267 1HB SER 267 9.702 12.832 -2.763 146 HG SER 267 HG SER 267 11.656 12.949 -0.893 147 H SER 268 H SER 268 9.607 8.463 -1.187 148 HA SER 268 HA SER 268 10.850 6.822 -0.239 149 1HB SER 268 2HB SER 268 12.337 7.028 -2.162 150 2HB SER 268 1HB SER 268 13.208 8.344 -1.376 151 HG SER 268 HG SER 268 12.986 5.881 -0.051 152 H GLY 269 H GLY 269 12.572 9.917 0.327 153 1HA GLY 269 2HA GLY 269 12.775 9.127 3.179 154 2HA GLY 269 1HA GLY 269 13.925 10.169 2.357 155 H SER 270 H SER 270 10.440 10.460 1.979 156 HA SER 270 HA SER 270 10.612 13.168 3.078 157 1HB SER 270 2HB SER 270 8.495 13.600 1.975 158 2HB SER 270 1HB SER 270 9.591 12.825 0.832 159 HG SER 270 HG SER 270 7.162 12.038 1.537 160 H ARG 271 H ARG 271 8.723 10.194 3.485 161 HA ARG 271 HA ARG 271 7.539 9.347 5.215 162 1HB ARG 271 2HB ARG 271 8.951 11.528 6.731 163 2HB ARG 271 1HB ARG 271 7.823 10.421 7.503 164 1HG ARG 271 2HG ARG 271 9.194 8.556 7.054 165 2HG ARG 271 1HG ARG 271 10.199 9.477 5.934 166 1HD ARG 271 2HD ARG 271 9.983 9.960 8.905 167 2HD ARG 271 1HD ARG 271 11.309 9.123 8.098 168 HE ARG 271 HE ARG 271 10.957 11.932 8.320 169 1HH1 ARG 271 1HH1 ARG 271 12.203 9.477 6.229 170 2HH1 ARG 271 2HH1 ARG 271 13.267 10.557 5.401 171 1HH2 ARG 271 1HH2 ARG 271 12.366 13.326 7.263 172 2HH2 ARG 271 2HH2 ARG 271 13.367 12.722 5.990 173 H ALA 272 H ALA 272 7.369 12.786 6.105 174 HA ALA 272 HA ALA 272 4.501 12.666 6.321 175 1HB ALA 272 1HB ALA 272 6.566 14.368 7.265 176 2HB ALA 272 2HB ALA 272 4.860 14.363 7.710 177 3HB ALA 272 3HB ALA 272 5.417 15.355 6.364 178 H SER 273 H SER 273 6.843 14.025 4.079 179 HA SER 273 HA SER 273 6.698 14.799 1.937 180 1HB SER 273 2HB SER 273 3.916 13.631 1.884 181 2HB SER 273 1HB SER 273 4.902 14.082 0.497 182 HG SER 273 HG SER 273 4.792 11.751 1.328 183 H LEU 274 H LEU 274 6.500 16.765 3.524 184 HA LEU 274 HA LEU 274 4.272 18.359 2.455 185 1HB LEU 274 2HB LEU 274 5.255 18.111 5.218 186 2HB LEU 274 1HB LEU 274 4.913 19.743 4.677 187 HG LEU 274 HG LEU 274 2.971 18.939 5.739 188 1HD1 LEU 274 1HD1 LEU 274 2.046 18.455 2.992 189 2HD1 LEU 274 2HD1 LEU 274 2.920 19.962 3.270 190 3HD1 LEU 274 3HD1 LEU 274 1.468 19.601 4.204 191 1HD2 LEU 274 1HD2 LEU 274 1.783 16.888 4.839 192 2HD2 LEU 274 2HD2 LEU 274 3.225 16.607 5.813 193 3HD2 LEU 274 3HD2 LEU 274 3.311 16.485 4.056 194 HA PRO 275 HA PRO 275 8.717 20.087 1.536 195 1HB PRO 275 2HB PRO 275 7.658 19.668 -1.223 196 2HB PRO 275 1HB PRO 275 9.308 19.486 -0.610 197 1HG PRO 275 2HG PRO 275 7.895 17.320 -1.060 198 2HG PRO 275 1HG PRO 275 8.815 17.462 0.455 199 1HD PRO 275 2HD PRO 275 5.873 17.890 0.007 200 2HD PRO 275 1HD PRO 275 6.682 16.963 1.295 201 H LYS 276 H LYS 276 5.652 20.517 -0.169 202 HA LYS 276 HA LYS 276 5.521 23.333 0.428 203 1HB LYS 276 2HB LYS 276 5.915 22.351 -2.400 204 2HB LYS 276 1HB LYS 276 5.113 23.874 -2.053 205 1HG LYS 276 2HG LYS 276 7.911 23.182 -1.191 206 2HG LYS 276 1HG LYS 276 7.500 24.121 -2.628 207 1HD LYS 276 2HD LYS 276 6.562 25.871 -1.308 208 2HD LYS 276 1HD LYS 276 6.642 24.890 0.157 209 1HE LYS 276 2HE LYS 276 9.028 25.821 -1.433 210 2HE LYS 276 1HE LYS 276 8.427 26.600 0.031 211 1HZ LYS 276 1HZ LYS 276 8.730 23.887 0.601 212 2HZ LYS 276 2HZ LYS 276 9.642 25.186 1.202 213 3HZ LYS 276 3HZ LYS 276 10.143 24.382 -0.198 Start of MODEL 9 1 1H ALA 249 1HT ALA 249 0.503 -12.455 -11.277 2 2H ALA 249 2HT ALA 249 0.365 -12.249 -9.603 3 3H ALA 249 3HT ALA 249 1.747 -12.976 -10.254 4 HA ALA 249 HA ALA 249 2.747 -11.055 -10.566 5 1HB ALA 249 1HB ALA 249 2.050 -10.217 -12.505 6 2HB ALA 249 2HB ALA 249 0.985 -9.174 -11.563 7 3HB ALA 249 3HB ALA 249 0.381 -10.703 -12.205 8 HA PRO 250 HA PRO 250 1.913 -8.759 -6.881 9 1HB PRO 250 2HB PRO 250 3.392 -6.505 -8.062 10 2HB PRO 250 1HB PRO 250 3.806 -7.510 -6.672 11 1HG PRO 250 2HG PRO 250 5.167 -7.697 -8.947 12 2HG PRO 250 1HG PRO 250 4.790 -9.144 -7.987 13 1HD PRO 250 2HD PRO 250 3.370 -8.064 -10.400 14 2HD PRO 250 1HD PRO 250 3.918 -9.725 -10.077 15 H ALA 251 H ALA 251 -0.372 -8.571 -8.326 16 HA ALA 251 HA ALA 251 -1.128 -6.055 -9.292 17 1HB ALA 251 1HB ALA 251 -2.384 -8.523 -8.856 18 2HB ALA 251 2HB ALA 251 -3.023 -7.127 -9.720 19 3HB ALA 251 3HB ALA 251 -3.354 -7.324 -8.001 20 H ARG 252 H ARG 252 -1.440 -7.393 -6.005 21 HA ARG 252 HA ARG 252 -2.675 -5.112 -4.883 22 1HB ARG 252 2HB ARG 252 -2.871 -7.159 -3.678 23 2HB ARG 252 1HB ARG 252 -1.130 -7.391 -3.650 24 1HG ARG 252 2HG ARG 252 -2.206 -6.679 -1.479 25 2HG ARG 252 1HG ARG 252 -0.826 -5.720 -2.015 26 1HD ARG 252 2HD ARG 252 -2.464 -4.112 -3.025 27 2HD ARG 252 1HD ARG 252 -3.745 -5.013 -2.217 28 HE ARG 252 HE ARG 252 -2.002 -4.385 -0.220 29 1HH1 ARG 252 1HH1 ARG 252 -3.691 -2.562 -2.622 30 2HH1 ARG 252 2HH1 ARG 252 -3.813 -1.147 -1.640 31 1HH2 ARG 252 1HH2 ARG 252 -2.152 -2.532 1.057 32 2HH2 ARG 252 2HH2 ARG 252 -2.936 -1.127 0.428 33 H VAL 253 H VAL 253 0.717 -6.123 -5.054 34 HA VAL 253 HA VAL 253 1.793 -4.018 -3.551 35 HB VAL 253 HB VAL 253 3.143 -5.440 -5.845 36 1HG1 VAL 253 1HG1 VAL 253 5.179 -4.983 -4.395 37 2HG1 VAL 253 2HG1 VAL 253 4.158 -3.858 -3.497 38 3HG1 VAL 253 3HG1 VAL 253 4.467 -3.593 -5.213 39 1HG2 VAL 253 1HG2 VAL 253 3.999 -6.602 -3.491 40 2HG2 VAL 253 2HG2 VAL 253 2.847 -7.295 -4.634 41 3HG2 VAL 253 3HG2 VAL 253 2.266 -6.386 -3.239 42 H GLY 254 H GLY 254 1.293 -4.313 -7.063 43 1HA GLY 254 2HA GLY 254 2.325 -1.781 -7.778 44 2HA GLY 254 1HA GLY 254 1.164 -2.711 -8.716 45 H LEU 255 H LEU 255 -1.027 -2.803 -7.117 46 HA LEU 255 HA LEU 255 -2.238 -0.273 -7.466 47 1HB LEU 255 2HB LEU 255 -3.335 -2.569 -7.282 48 2HB LEU 255 1HB LEU 255 -3.203 -2.359 -5.542 49 HG LEU 255 HG LEU 255 -4.494 -0.248 -5.754 50 1HD1 LEU 255 1HD1 LEU 255 -4.420 -1.041 -8.614 51 2HD1 LEU 255 2HD1 LEU 255 -4.324 0.559 -7.879 52 3HD1 LEU 255 3HD1 LEU 255 -5.878 -0.265 -7.995 53 1HD2 LEU 255 1HD2 LEU 255 -6.670 -1.368 -6.166 54 2HD2 LEU 255 2HD2 LEU 255 -5.618 -2.256 -5.062 55 3HD2 LEU 255 3HD2 LEU 255 -5.787 -2.784 -6.736 56 H GLY 256 H GLY 256 -0.790 -1.852 -4.658 57 1HA GLY 256 2HA GLY 256 -1.548 0.036 -2.709 58 2HA GLY 256 1HA GLY 256 -0.185 -1.064 -2.596 59 H ILE 257 H ILE 257 1.593 -0.262 -4.445 60 HA ILE 257 HA ILE 257 2.626 2.113 -3.310 61 HB ILE 257 HB ILE 257 4.352 2.066 -5.067 62 1HG1 ILE 257 2HG1 ILE 257 4.153 -0.299 -6.384 63 2HG1 ILE 257 1HG1 ILE 257 2.460 0.174 -6.331 64 1HG2 ILE 257 1HG2 ILE 257 4.161 -0.766 -4.246 65 2HG2 ILE 257 2HG2 ILE 257 4.098 0.446 -2.968 66 3HG2 ILE 257 3HG2 ILE 257 5.481 0.388 -4.060 67 1HD1 ILE 257 1HD1 ILE 257 3.265 1.007 -8.356 68 2HD1 ILE 257 2HD1 ILE 257 4.758 1.594 -7.625 69 3HD1 ILE 257 3HD1 ILE 257 3.231 2.407 -7.283 70 H THR 258 H THR 258 0.711 1.530 -6.208 71 HA THR 258 HA THR 258 0.995 4.091 -7.387 72 HB THR 258 HB THR 258 -1.361 2.197 -7.575 73 HG1 THR 258 1HG THR 258 0.431 1.143 -8.357 74 1HG2 THR 258 1HG2 THR 258 -0.535 4.564 -9.254 75 2HG2 THR 258 2HG2 THR 258 -2.044 4.343 -8.369 76 3HG2 THR 258 3HG2 THR 258 -1.700 3.351 -9.786 77 H THR 259 H THR 259 -1.484 2.777 -5.182 78 HA THR 259 HA THR 259 -3.002 5.168 -5.037 79 HB THR 259 HB THR 259 -3.956 4.167 -2.923 80 HG1 THR 259 1HG THR 259 -2.582 1.793 -3.620 81 1HG2 THR 259 1HG2 THR 259 -4.718 3.760 -5.355 82 2HG2 THR 259 2HG2 THR 259 -5.312 2.676 -4.097 83 3HG2 THR 259 3HG2 THR 259 -3.997 2.163 -5.155 84 H VAL 260 H VAL 260 -0.482 3.803 -2.928 85 HA VAL 260 HA VAL 260 -0.527 5.841 -0.994 86 HB VAL 260 HB VAL 260 1.742 4.050 -1.872 87 1HG1 VAL 260 1HG1 VAL 260 2.128 4.930 0.779 88 2HG1 VAL 260 2HG1 VAL 260 1.824 6.368 -0.196 89 3HG1 VAL 260 3HG1 VAL 260 3.130 5.267 -0.632 90 1HG2 VAL 260 1HG2 VAL 260 0.215 2.636 -0.911 91 2HG2 VAL 260 2HG2 VAL 260 -0.434 3.883 0.156 92 3HG2 VAL 260 3HG2 VAL 260 1.123 3.135 0.516 93 H LEU 261 H LEU 261 1.456 5.522 -3.965 94 HA LEU 261 HA LEU 261 2.907 7.919 -3.678 95 1HB LEU 261 2HB LEU 261 3.421 6.111 -5.309 96 2HB LEU 261 1HB LEU 261 2.035 6.620 -6.257 97 HG LEU 261 HG LEU 261 3.065 8.770 -6.698 98 1HD1 LEU 261 1HD1 LEU 261 4.245 9.272 -4.726 99 2HD1 LEU 261 2HD1 LEU 261 5.484 9.068 -5.963 100 3HD1 LEU 261 3HD1 LEU 261 5.176 7.776 -4.804 101 1HD2 LEU 261 1HD2 LEU 261 4.036 7.781 -8.426 102 2HD2 LEU 261 2HD2 LEU 261 4.091 6.257 -7.540 103 3HD2 LEU 261 3HD2 LEU 261 5.430 7.397 -7.417 104 H THR 262 H THR 262 -0.176 7.232 -5.301 105 HA THR 262 HA THR 262 -0.680 9.806 -6.320 106 HB THR 262 HB THR 262 -2.641 7.682 -5.424 107 HG1 THR 262 1HG THR 262 -1.432 6.872 -7.090 108 1HG2 THR 262 1HG2 THR 262 -3.113 10.013 -7.279 109 2HG2 THR 262 2HG2 THR 262 -3.658 9.936 -5.604 110 3HG2 THR 262 3HG2 THR 262 -4.289 8.792 -6.789 111 H MET 263 H MET 263 -1.633 8.312 -3.257 112 HA MET 263 HA MET 263 -3.084 10.525 -2.250 113 1HB MET 263 2HB MET 263 -3.444 8.286 -1.403 114 2HB MET 263 1HB MET 263 -1.783 8.190 -0.842 115 1HG MET 263 2HG MET 263 -2.262 10.037 0.734 116 2HG MET 263 1HG MET 263 -3.949 9.982 0.224 117 1HE MET 263 1HE MET 263 -1.208 7.517 0.745 118 2HE MET 263 2HE MET 263 -1.866 6.268 1.804 119 3HE MET 263 3HE MET 263 -1.208 7.753 2.493 120 H THR 264 H THR 264 0.310 9.494 -1.760 121 HA THR 264 HA THR 264 0.849 11.536 0.152 122 HB THR 264 HB THR 264 2.230 9.506 0.053 123 HG1 THR 264 1HG THR 264 3.276 12.095 -0.041 124 1HG2 THR 264 1HG2 THR 264 2.555 9.002 -2.207 125 2HG2 THR 264 2HG2 THR 264 4.131 9.591 -1.685 126 3HG2 THR 264 3HG2 THR 264 3.056 10.645 -2.599 127 H THR 265 H THR 265 0.949 11.544 -3.353 128 HA THR 265 HA THR 265 2.522 13.978 -3.422 129 HB THR 265 HB THR 265 2.786 12.365 -5.247 130 HG1 THR 265 1HG THR 265 3.132 13.961 -6.601 131 1HG2 THR 265 1HG2 THR 265 -0.138 12.809 -5.601 132 2HG2 THR 265 2HG2 THR 265 0.798 11.319 -5.716 133 3HG2 THR 265 3HG2 THR 265 0.854 12.499 -7.025 134 H GLN 266 H GLN 266 0.726 14.933 -5.756 135 HA GLN 266 HA GLN 266 -0.892 16.502 -6.086 136 1HB GLN 266 2HB GLN 266 -2.191 15.278 -3.641 137 2HB GLN 266 1HB GLN 266 -2.975 16.360 -4.783 138 1HG GLN 266 2HG GLN 266 -2.696 14.699 -6.551 139 2HG GLN 266 1HG GLN 266 -1.901 13.617 -5.411 140 1HE2 GLN 266 1HE2 GLN 266 -3.160 12.092 -4.623 141 2HE2 GLN 266 2HE2 GLN 266 -4.876 12.203 -4.404 142 H SER 267 H SER 267 1.421 17.116 -4.484 143 HA SER 267 HA SER 267 0.349 19.214 -2.717 144 1HB SER 267 2HB SER 267 1.764 17.618 -1.523 145 2HB SER 267 1HB SER 267 3.075 17.897 -2.668 146 HG SER 267 HG SER 267 3.215 19.099 -0.654 147 H SER 268 H SER 268 0.808 21.289 -3.091 148 HA SER 268 HA SER 268 1.713 22.145 -5.608 149 1HB SER 268 2HB SER 268 0.195 23.503 -4.325 150 2HB SER 268 1HB SER 268 1.360 23.649 -3.011 151 HG SER 268 HG SER 268 1.559 25.498 -4.144 152 H GLY 269 H GLY 269 3.377 21.962 -2.489 153 1HA GLY 269 2HA GLY 269 5.646 21.785 -2.072 154 2HA GLY 269 1HA GLY 269 5.938 21.866 -3.801 155 H SER 270 H SER 270 5.067 24.294 -4.566 156 HA SER 270 HA SER 270 7.089 26.052 -3.738 157 1HB SER 270 2HB SER 270 4.437 26.760 -5.030 158 2HB SER 270 1HB SER 270 5.866 27.789 -4.981 159 HG SER 270 HG SER 270 5.252 25.858 -6.730 160 H ARG 271 H ARG 271 7.335 27.148 -1.896 161 HA ARG 271 HA ARG 271 5.553 27.167 0.225 162 1HB ARG 271 2HB ARG 271 7.973 27.649 0.403 163 2HB ARG 271 1HB ARG 271 7.672 29.243 -0.283 164 1HG ARG 271 2HG ARG 271 7.768 29.529 2.063 165 2HG ARG 271 1HG ARG 271 6.068 29.633 1.597 166 1HD ARG 271 2HD ARG 271 5.826 27.226 2.197 167 2HD ARG 271 1HD ARG 271 7.465 27.275 2.841 168 HE ARG 271 HE ARG 271 6.634 28.278 4.709 169 1HH1 ARG 271 1HH1 ARG 271 4.329 28.726 2.149 170 2HH1 ARG 271 2HH1 ARG 271 3.155 29.453 3.186 171 1HH2 ARG 271 1HH2 ARG 271 5.091 29.219 6.044 172 2HH2 ARG 271 2HH2 ARG 271 3.584 29.733 5.375 173 H ALA 272 H ALA 272 5.993 29.703 -2.228 174 HA ALA 272 HA ALA 272 4.261 31.592 -1.064 175 1HB ALA 272 1HB ALA 272 5.581 32.501 -2.717 176 2HB ALA 272 2HB ALA 272 4.038 32.343 -3.557 177 3HB ALA 272 3HB ALA 272 5.314 31.153 -3.822 178 H SER 273 H SER 273 3.669 28.992 -3.386 179 HA SER 273 HA SER 273 0.789 29.533 -3.304 180 1HB SER 273 2HB SER 273 2.177 27.422 -4.942 181 2HB SER 273 1HB SER 273 0.569 28.104 -5.184 182 HG SER 273 HG SER 273 1.829 30.176 -5.450 183 H LEU 274 H LEU 274 1.533 28.724 -0.891 184 HA LEU 274 HA LEU 274 0.767 25.882 -0.823 185 1HB LEU 274 2HB LEU 274 2.590 27.484 0.898 186 2HB LEU 274 1HB LEU 274 1.702 26.164 1.631 187 HG LEU 274 HG LEU 274 3.717 25.997 -0.603 188 1HD1 LEU 274 1HD1 LEU 274 4.298 26.134 1.942 189 2HD1 LEU 274 2HD1 LEU 274 5.115 24.970 0.897 190 3HD1 LEU 274 3HD1 LEU 274 3.791 24.445 1.940 191 1HD2 LEU 274 1HD2 LEU 274 1.523 24.196 0.099 192 2HD2 LEU 274 2HD2 LEU 274 3.106 23.420 0.065 193 3HD2 LEU 274 3HD2 LEU 274 2.509 24.271 -1.360 194 HA PRO 275 HA PRO 275 -2.433 28.771 1.480 195 1HB PRO 275 2HB PRO 275 -4.177 27.887 -0.777 196 2HB PRO 275 1HB PRO 275 -4.153 29.432 0.091 197 1HG PRO 275 2HG PRO 275 -3.093 29.349 -2.300 198 2HG PRO 275 1HG PRO 275 -2.189 30.132 -0.985 199 1HD PRO 275 2HD PRO 275 -1.840 27.358 -2.096 200 2HD PRO 275 1HD PRO 275 -0.596 28.604 -1.822 201 H LYS 276 H LYS 276 -2.707 25.714 -0.253 202 HA LYS 276 HA LYS 276 -3.501 23.660 0.269 203 1HB LYS 276 2HB LYS 276 -1.971 24.328 2.317 204 2HB LYS 276 1HB LYS 276 -3.497 24.308 3.186 205 1HG LYS 276 2HG LYS 276 -2.547 21.981 1.541 206 2HG LYS 276 1HG LYS 276 -2.118 22.188 3.235 207 1HD LYS 276 2HD LYS 276 -4.972 22.153 2.282 208 2HD LYS 276 1HD LYS 276 -4.104 20.686 2.736 209 1HE LYS 276 2HE LYS 276 -5.322 21.366 4.655 210 2HE LYS 276 1HE LYS 276 -3.639 21.780 4.956 211 1HZ LYS 276 1HZ LYS 276 -5.317 23.859 3.752 212 2HZ LYS 276 2HZ LYS 276 -4.072 23.989 4.907 213 3HZ LYS 276 3HZ LYS 276 -5.611 23.473 5.384 Start of MODEL 10 1 1H ALA 249 1HT ALA 249 2.516 -10.812 -13.240 2 2H ALA 249 2HT ALA 249 0.919 -10.752 -12.680 3 3H ALA 249 3HT ALA 249 2.201 -10.744 -11.578 4 HA ALA 249 HA ALA 249 2.888 -8.625 -12.957 5 1HB ALA 249 1HB ALA 249 0.244 -7.669 -13.007 6 2HB ALA 249 2HB ALA 249 0.235 -9.219 -13.848 7 3HB ALA 249 3HB ALA 249 1.325 -7.937 -14.373 8 HA PRO 250 HA PRO 250 2.592 -6.972 -8.858 9 1HB PRO 250 2HB PRO 250 2.465 -4.274 -10.053 10 2HB PRO 250 1HB PRO 250 3.715 -4.986 -9.029 11 1HG PRO 250 2HG PRO 250 4.164 -4.539 -11.604 12 2HG PRO 250 1HG PRO 250 4.769 -6.014 -10.821 13 1HD PRO 250 2HD PRO 250 2.305 -5.643 -12.494 14 2HD PRO 250 1HD PRO 250 3.558 -6.897 -12.616 15 H ALA 251 H ALA 251 0.179 -7.831 -9.045 16 HA ALA 251 HA ALA 251 -1.900 -5.955 -9.467 17 1HB ALA 251 1HB ALA 251 -2.633 -8.083 -7.643 18 2HB ALA 251 2HB ALA 251 -1.745 -8.683 -9.044 19 3HB ALA 251 3HB ALA 251 -3.214 -7.735 -9.272 20 H ARG 252 H ARG 252 -1.224 -7.505 -6.315 21 HA ARG 252 HA ARG 252 -2.526 -5.474 -4.843 22 1HB ARG 252 2HB ARG 252 -1.842 -7.976 -4.254 23 2HB ARG 252 1HB ARG 252 -0.458 -7.174 -3.531 24 1HG ARG 252 2HG ARG 252 -3.348 -6.655 -2.853 25 2HG ARG 252 1HG ARG 252 -2.211 -7.600 -1.893 26 1HD ARG 252 2HD ARG 252 -0.820 -5.596 -1.601 27 2HD ARG 252 1HD ARG 252 -1.985 -4.660 -2.535 28 HE ARG 252 HE ARG 252 -3.202 -5.956 -0.310 29 1HH1 ARG 252 1HH1 ARG 252 -1.331 -3.213 -1.261 30 2HH1 ARG 252 2HH1 ARG 252 -1.799 -2.262 0.103 31 1HH2 ARG 252 1HH2 ARG 252 -3.816 -4.727 1.474 32 2HH2 ARG 252 2HH2 ARG 252 -3.204 -3.122 1.651 33 H VAL 253 H VAL 253 0.943 -6.191 -5.199 34 HA VAL 253 HA VAL 253 1.918 -4.083 -3.653 35 HB VAL 253 HB VAL 253 3.353 -5.888 -4.320 36 1HG1 VAL 253 1HG1 VAL 253 3.103 -4.889 -7.135 37 2HG1 VAL 253 2HG1 VAL 253 2.489 -6.414 -6.496 38 3HG1 VAL 253 3HG1 VAL 253 4.228 -6.134 -6.592 39 1HG2 VAL 253 1HG2 VAL 253 5.323 -4.583 -5.198 40 2HG2 VAL 253 2HG2 VAL 253 4.549 -3.932 -3.753 41 3HG2 VAL 253 3HG2 VAL 253 4.232 -3.203 -5.326 42 H GLY 254 H GLY 254 1.427 -4.249 -7.140 43 1HA GLY 254 2HA GLY 254 2.231 -1.656 -7.824 44 2HA GLY 254 1HA GLY 254 1.077 -2.620 -8.733 45 H LEU 255 H LEU 255 -1.048 -2.831 -7.024 46 HA LEU 255 HA LEU 255 -2.367 -0.367 -7.318 47 1HB LEU 255 2HB LEU 255 -2.937 -2.944 -6.019 48 2HB LEU 255 1HB LEU 255 -3.803 -1.568 -5.359 49 HG LEU 255 HG LEU 255 -3.841 -2.465 -8.236 50 1HD1 LEU 255 1HD1 LEU 255 -6.124 -2.414 -6.292 51 2HD1 LEU 255 2HD1 LEU 255 -5.073 -3.820 -6.459 52 3HD1 LEU 255 3HD1 LEU 255 -6.010 -3.251 -7.841 53 1HD2 LEU 255 1HD2 LEU 255 -4.233 0.089 -7.198 54 2HD2 LEU 255 2HD2 LEU 255 -5.855 -0.558 -7.441 55 3HD2 LEU 255 3HD2 LEU 255 -4.720 -0.497 -8.789 56 H GLY 256 H GLY 256 -0.858 -1.881 -4.498 57 1HA GLY 256 2HA GLY 256 -1.584 0.087 -2.629 58 2HA GLY 256 1HA GLY 256 -0.238 -1.029 -2.468 59 H ILE 257 H ILE 257 1.525 -0.297 -4.403 60 HA ILE 257 HA ILE 257 2.645 2.053 -3.316 61 HB ILE 257 HB ILE 257 4.329 1.954 -5.099 62 1HG1 ILE 257 2HG1 ILE 257 3.964 -0.439 -6.394 63 2HG1 ILE 257 1HG1 ILE 257 2.330 0.216 -6.371 64 1HG2 ILE 257 1HG2 ILE 257 5.408 0.366 -3.977 65 2HG2 ILE 257 2HG2 ILE 257 4.227 -0.871 -4.409 66 3HG2 ILE 257 3HG2 ILE 257 3.923 0.199 -3.040 67 1HD1 ILE 257 1HD1 ILE 257 3.257 2.315 -7.366 68 2HD1 ILE 257 2HD1 ILE 257 3.347 0.890 -8.401 69 3HD1 ILE 257 3HD1 ILE 257 4.789 1.464 -7.562 70 H THR 258 H THR 258 0.754 1.554 -6.287 71 HA THR 258 HA THR 258 1.139 4.176 -7.301 72 HB THR 258 HB THR 258 -0.992 3.751 -8.603 73 HG1 THR 258 1HG THR 258 -0.759 1.080 -7.679 74 1HG2 THR 258 1HG2 THR 258 1.133 3.300 -9.619 75 2HG2 THR 258 2HG2 THR 258 0.048 1.964 -10.002 76 3HG2 THR 258 3HG2 THR 258 1.277 1.770 -8.753 77 H THR 259 H THR 259 -1.466 2.789 -5.276 78 HA THR 259 HA THR 259 -2.983 5.187 -5.170 79 HB THR 259 HB THR 259 -4.015 4.192 -3.088 80 HG1 THR 259 1HG THR 259 -2.599 1.827 -3.749 81 1HG2 THR 259 1HG2 THR 259 -4.681 2.005 -4.548 82 2HG2 THR 259 2HG2 THR 259 -4.020 3.054 -5.801 83 3HG2 THR 259 3HG2 THR 259 -5.362 3.611 -4.802 84 H VAL 260 H VAL 260 -0.529 3.811 -2.980 85 HA VAL 260 HA VAL 260 -0.639 5.850 -1.039 86 HB VAL 260 HB VAL 260 1.642 4.034 -1.838 87 1HG1 VAL 260 1HG1 VAL 260 2.662 5.933 -0.820 88 2HG1 VAL 260 2HG1 VAL 260 2.604 4.653 0.393 89 3HG1 VAL 260 3HG1 VAL 260 1.442 5.978 0.455 90 1HG2 VAL 260 1HG2 VAL 260 -0.289 3.976 0.483 91 2HG2 VAL 260 2HG2 VAL 260 1.046 2.849 0.233 92 3HG2 VAL 260 3HG2 VAL 260 -0.297 2.893 -0.909 93 H LEU 261 H LEU 261 1.415 5.506 -3.937 94 HA LEU 261 HA LEU 261 2.912 7.868 -3.620 95 1HB LEU 261 2HB LEU 261 3.040 5.854 -5.349 96 2HB LEU 261 1HB LEU 261 2.106 6.949 -6.346 97 HG LEU 261 HG LEU 261 4.533 7.024 -6.818 98 1HD1 LEU 261 1HD1 LEU 261 3.604 8.979 -7.537 99 2HD1 LEU 261 2HD1 LEU 261 4.737 9.602 -6.337 100 3HD1 LEU 261 3HD1 LEU 261 3.029 9.428 -5.931 101 1HD2 LEU 261 1HD2 LEU 261 5.852 8.389 -5.036 102 2HD2 LEU 261 2HD2 LEU 261 5.658 6.646 -4.847 103 3HD2 LEU 261 3HD2 LEU 261 4.641 7.751 -3.924 104 H THR 262 H THR 262 -0.137 7.240 -5.310 105 HA THR 262 HA THR 262 -0.603 9.820 -6.326 106 HB THR 262 HB THR 262 -2.645 7.762 -5.447 107 HG1 THR 262 1HG THR 262 -1.385 6.827 -7.015 108 1HG2 THR 262 1HG2 THR 262 -4.268 9.054 -6.288 109 2HG2 THR 262 2HG2 THR 262 -3.305 9.496 -7.698 110 3HG2 THR 262 3HG2 THR 262 -3.101 10.372 -6.181 111 H MET 263 H MET 263 -1.746 8.289 -3.326 112 HA MET 263 HA MET 263 -3.148 10.512 -2.328 113 1HB MET 263 2HB MET 263 -3.440 8.204 -1.512 114 2HB MET 263 1HB MET 263 -1.837 8.262 -0.795 115 1HG MET 263 2HG MET 263 -2.570 10.076 0.678 116 2HG MET 263 1HG MET 263 -4.182 9.986 -0.029 117 1HE MET 263 1HE MET 263 -4.139 8.705 3.685 118 2HE MET 263 2HE MET 263 -5.503 9.145 2.657 119 3HE MET 263 3HE MET 263 -4.046 10.140 2.662 120 H THR 264 H THR 264 0.204 9.412 -1.652 121 HA THR 264 HA THR 264 0.731 11.481 0.205 122 HB THR 264 HB THR 264 2.108 9.432 0.109 123 HG1 THR 264 1HG THR 264 3.224 12.018 0.032 124 1HG2 THR 264 1HG2 THR 264 2.489 9.028 -2.188 125 2HG2 THR 264 2HG2 THR 264 4.056 9.503 -1.533 126 3HG2 THR 264 3HG2 THR 264 3.098 10.663 -2.454 127 H THR 265 H THR 265 1.169 11.389 -3.327 128 HA THR 265 HA THR 265 2.660 13.835 -3.352 129 HB THR 265 HB THR 265 2.849 12.214 -5.213 130 HG1 THR 265 1HG THR 265 3.232 14.587 -5.395 131 1HG2 THR 265 1HG2 THR 265 0.997 12.559 -7.024 132 2HG2 THR 265 2HG2 THR 265 -0.013 12.977 -5.638 133 3HG2 THR 265 3HG2 THR 265 0.749 11.388 -5.727 134 H GLN 266 H GLN 266 -0.760 13.034 -3.721 135 HA GLN 266 HA GLN 266 -1.553 15.707 -4.398 136 1HB GLN 266 2HB GLN 266 -2.885 13.749 -5.064 137 2HB GLN 266 1HB GLN 266 -3.214 13.406 -3.370 138 1HG GLN 266 2HG GLN 266 -5.107 14.505 -4.348 139 2HG GLN 266 1HG GLN 266 -4.347 15.579 -3.176 140 1HE2 GLN 266 1HE2 GLN 266 -4.035 17.586 -3.806 141 2HE2 GLN 266 2HE2 GLN 266 -3.953 18.135 -5.441 142 H SER 267 H SER 267 -1.455 13.786 -1.437 143 HA SER 267 HA SER 267 -1.587 14.331 0.764 144 1HB SER 267 2HB SER 267 0.165 15.985 0.174 145 2HB SER 267 1HB SER 267 -1.090 17.170 -0.182 146 HG SER 267 HG SER 267 0.031 16.631 2.155 147 H SER 268 H SER 268 -2.631 17.125 1.570 148 HA SER 268 HA SER 268 -5.379 16.327 1.810 149 1HB SER 268 2HB SER 268 -5.656 18.506 2.987 150 2HB SER 268 1HB SER 268 -4.331 17.538 3.631 151 HG SER 268 HG SER 268 -3.912 19.854 3.214 152 H GLY 269 H GLY 269 -3.699 18.908 0.029 153 1HA GLY 269 2HA GLY 269 -5.217 18.874 -2.247 154 2HA GLY 269 1HA GLY 269 -6.121 19.908 -1.153 155 H SER 270 H SER 270 -5.855 21.824 -2.205 156 HA SER 270 HA SER 270 -4.888 23.739 -2.949 157 1HB SER 270 2HB SER 270 -4.174 23.801 -0.561 158 2HB SER 270 1HB SER 270 -2.667 23.011 -1.018 159 HG SER 270 HG SER 270 -3.337 25.621 -1.166 160 H ARG 271 H ARG 271 -1.679 23.695 -2.729 161 HA ARG 271 HA ARG 271 -1.343 23.012 -5.529 162 1HB ARG 271 2HB ARG 271 -0.310 25.025 -4.351 163 2HB ARG 271 1HB ARG 271 0.824 23.889 -3.630 164 1HG ARG 271 2HG ARG 271 1.903 24.798 -5.518 165 2HG ARG 271 1HG ARG 271 1.405 23.164 -5.963 166 1HD ARG 271 2HD ARG 271 -0.664 24.210 -6.974 167 2HD ARG 271 1HD ARG 271 0.131 25.769 -6.762 168 HE ARG 271 HE ARG 271 0.603 23.915 -8.830 169 1HH1 ARG 271 1HH1 ARG 271 2.302 26.178 -6.812 170 2HH1 ARG 271 2HH1 ARG 271 3.649 26.303 -7.915 171 1HH2 ARG 271 1HH2 ARG 271 2.347 24.150 -10.237 172 2HH2 ARG 271 2HH2 ARG 271 3.656 25.203 -9.797 173 H ALA 272 H ALA 272 -1.566 21.041 -3.034 174 HA ALA 272 HA ALA 272 -0.773 18.996 -2.421 175 1HB ALA 272 1HB ALA 272 -1.563 18.206 -4.471 176 2HB ALA 272 2HB ALA 272 0.091 17.599 -4.390 177 3HB ALA 272 3HB ALA 272 -0.282 19.010 -5.382 178 H SER 273 H SER 273 1.608 17.775 -4.023 179 HA SER 273 HA SER 273 3.644 19.097 -2.362 180 1HB SER 273 2HB SER 273 5.007 17.052 -2.763 181 2HB SER 273 1HB SER 273 3.519 16.786 -1.856 182 HG SER 273 HG SER 273 2.572 15.905 -3.687 183 H LEU 274 H LEU 274 2.806 20.200 -4.862 184 HA LEU 274 HA LEU 274 5.442 20.128 -6.153 185 1HB LEU 274 2HB LEU 274 4.274 20.784 -8.295 186 2HB LEU 274 1HB LEU 274 4.065 19.126 -7.771 187 HG LEU 274 HG LEU 274 1.954 21.014 -6.914 188 1HD1 LEU 274 1HD1 LEU 274 1.480 20.042 -9.615 189 2HD1 LEU 274 2HD1 LEU 274 2.795 21.214 -9.530 190 3HD1 LEU 274 3HD1 LEU 274 1.196 21.637 -8.920 191 1HD2 LEU 274 1HD2 LEU 274 2.187 18.180 -7.846 192 2HD2 LEU 274 2HD2 LEU 274 0.621 18.991 -7.848 193 3HD2 LEU 274 3HD2 LEU 274 1.520 18.811 -6.340 194 HA PRO 275 HA PRO 275 3.918 24.451 -4.631 195 1HB PRO 275 2HB PRO 275 6.226 24.142 -2.780 196 2HB PRO 275 1HB PRO 275 4.623 24.833 -2.485 197 1HG PRO 275 2HG PRO 275 5.148 22.462 -1.508 198 2HG PRO 275 1HG PRO 275 3.612 22.722 -2.370 199 1HD PRO 275 2HD PRO 275 6.160 21.519 -3.435 200 2HD PRO 275 1HD PRO 275 4.512 20.818 -3.471 201 H LYS 276 H LYS 276 5.139 24.252 -6.972 202 HA LYS 276 HA LYS 276 7.239 26.264 -6.835 203 1HB LYS 276 2HB LYS 276 8.621 24.887 -8.517 204 2HB LYS 276 1HB LYS 276 8.703 24.454 -6.819 205 1HG LYS 276 2HG LYS 276 8.570 22.423 -7.994 206 2HG LYS 276 1HG LYS 276 6.968 22.681 -7.309 207 1HD LYS 276 2HD LYS 276 6.787 21.873 -9.590 208 2HD LYS 276 1HD LYS 276 6.196 23.533 -9.490 209 1HE LYS 276 2HE LYS 276 7.571 23.183 -11.483 210 2HE LYS 276 1HE LYS 276 8.308 24.353 -10.391 211 1HZ LYS 276 1HZ LYS 276 9.265 21.822 -9.707 212 2HZ LYS 276 2HZ LYS 276 10.128 23.116 -10.372 213 3HZ LYS 276 3HZ LYS 276 9.404 21.971 -11.387 Start of MODEL 11 1 1H ALA 249 1HT ALA 249 -2.787 -1.563 -12.854 2 2H ALA 249 2HT ALA 249 -2.223 -3.033 -13.480 3 3H ALA 249 3HT ALA 249 -1.605 -1.571 -14.066 4 HA ALA 249 HA ALA 249 -0.022 -1.576 -12.565 5 1HB ALA 249 1HB ALA 249 -0.462 -1.031 -10.378 6 2HB ALA 249 2HB ALA 249 -1.873 -2.084 -10.283 7 3HB ALA 249 3HB ALA 249 -1.968 -0.560 -11.167 8 HA PRO 250 HA PRO 250 1.177 -5.738 -11.910 9 1HB PRO 250 2HB PRO 250 3.221 -5.424 -10.179 10 2HB PRO 250 1HB PRO 250 3.307 -4.898 -11.862 11 1HG PRO 250 2HG PRO 250 2.727 -3.292 -9.409 12 2HG PRO 250 1HG PRO 250 3.825 -2.925 -10.755 13 1HD PRO 250 2HD PRO 250 1.348 -1.877 -10.583 14 2HD PRO 250 1HD PRO 250 2.110 -2.265 -12.138 15 H ALA 251 H ALA 251 -0.989 -6.020 -10.801 16 HA ALA 251 HA ALA 251 -2.251 -7.006 -9.212 17 1HB ALA 251 1HB ALA 251 -1.038 -8.435 -7.537 18 2HB ALA 251 2HB ALA 251 0.464 -7.855 -8.256 19 3HB ALA 251 3HB ALA 251 -0.688 -8.766 -9.233 20 H ARG 252 H ARG 252 -1.474 -7.423 -6.394 21 HA ARG 252 HA ARG 252 -2.650 -5.120 -5.306 22 1HB ARG 252 2HB ARG 252 -2.362 -7.623 -4.416 23 2HB ARG 252 1HB ARG 252 -1.044 -6.875 -3.527 24 1HG ARG 252 2HG ARG 252 -3.929 -6.003 -3.448 25 2HG ARG 252 1HG ARG 252 -3.104 -6.956 -2.216 26 1HD ARG 252 2HD ARG 252 -1.617 -5.129 -1.726 27 2HD ARG 252 1HD ARG 252 -2.268 -4.187 -3.064 28 HE ARG 252 HE ARG 252 -3.952 -3.515 -1.692 29 1HH1 ARG 252 1HH1 ARG 252 -2.575 -6.393 -0.358 30 2HH1 ARG 252 2HH1 ARG 252 -3.543 -6.335 1.070 31 1HH2 ARG 252 1HH2 ARG 252 -5.204 -3.444 0.174 32 2HH2 ARG 252 2HH2 ARG 252 -5.024 -4.680 1.366 33 H VAL 253 H VAL 253 0.755 -6.183 -5.242 34 HA VAL 253 HA VAL 253 1.753 -4.147 -3.627 35 HB VAL 253 HB VAL 253 3.080 -6.089 -4.283 36 1HG1 VAL 253 1HG1 VAL 253 3.526 -4.824 -6.957 37 2HG1 VAL 253 2HG1 VAL 253 2.372 -6.127 -6.673 38 3HG1 VAL 253 3HG1 VAL 253 4.092 -6.394 -6.389 39 1HG2 VAL 253 1HG2 VAL 253 5.233 -4.906 -4.707 40 2HG2 VAL 253 2HG2 VAL 253 4.284 -4.245 -3.375 41 3HG2 VAL 253 3HG2 VAL 253 4.302 -3.425 -4.937 42 H GLY 254 H GLY 254 1.387 -4.267 -7.119 43 1HA GLY 254 2HA GLY 254 2.377 -1.692 -7.713 44 2HA GLY 254 1HA GLY 254 1.261 -2.610 -8.716 45 H LEU 255 H LEU 255 -0.979 -2.796 -7.186 46 HA LEU 255 HA LEU 255 -2.212 -0.297 -7.512 47 1HB LEU 255 2HB LEU 255 -2.930 -2.886 -6.325 48 2HB LEU 255 1HB LEU 255 -3.802 -1.508 -5.678 49 HG LEU 255 HG LEU 255 -3.678 -2.324 -8.576 50 1HD1 LEU 255 1HD1 LEU 255 -5.381 -3.062 -6.378 51 2HD1 LEU 255 2HD1 LEU 255 -5.369 -3.660 -8.038 52 3HD1 LEU 255 3HD1 LEU 255 -6.303 -2.223 -7.625 53 1HD2 LEU 255 1HD2 LEU 255 -4.754 0.084 -7.172 54 2HD2 LEU 255 2HD2 LEU 255 -5.552 -0.515 -8.626 55 3HD2 LEU 255 3HD2 LEU 255 -3.859 -0.023 -8.687 56 H GLY 256 H GLY 256 -0.915 -1.887 -4.632 57 1HA GLY 256 2HA GLY 256 -1.743 0.029 -2.759 58 2HA GLY 256 1HA GLY 256 -0.399 -1.083 -2.556 59 H ILE 257 H ILE 257 1.482 -0.298 -4.336 60 HA ILE 257 HA ILE 257 2.507 2.054 -3.151 61 HB ILE 257 HB ILE 257 4.279 2.016 -4.858 62 1HG1 ILE 257 2HG1 ILE 257 4.056 -0.343 -6.214 63 2HG1 ILE 257 1HG1 ILE 257 2.386 0.216 -6.224 64 1HG2 ILE 257 1HG2 ILE 257 5.067 0.692 -3.248 65 2HG2 ILE 257 2HG2 ILE 257 4.738 -0.621 -4.379 66 3HG2 ILE 257 3HG2 ILE 257 3.564 -0.222 -3.124 67 1HD1 ILE 257 1HD1 ILE 257 3.748 2.471 -6.939 68 2HD1 ILE 257 2HD1 ILE 257 2.986 1.337 -8.055 69 3HD1 ILE 257 3HD1 ILE 257 4.706 1.195 -7.693 70 H THR 258 H THR 258 0.750 1.524 -6.173 71 HA THR 258 HA THR 258 1.068 4.115 -7.261 72 HB THR 258 HB THR 258 -1.319 2.280 -7.612 73 HG1 THR 258 1HG THR 258 0.465 1.137 -8.278 74 1HG2 THR 258 1HG2 THR 258 -0.697 4.885 -8.641 75 2HG2 THR 258 2HG2 THR 258 -2.133 3.897 -8.910 76 3HG2 THR 258 3HG2 THR 258 -0.728 3.716 -9.961 77 H THR 259 H THR 259 -1.366 2.711 -5.094 78 HA THR 259 HA THR 259 -3.039 4.984 -4.911 79 HB THR 259 HB THR 259 -2.604 2.855 -2.800 80 HG1 THR 259 1HG THR 259 -3.257 1.867 -4.723 81 1HG2 THR 259 1HG2 THR 259 -3.955 5.157 -2.464 82 2HG2 THR 259 2HG2 THR 259 -4.429 3.639 -1.700 83 3HG2 THR 259 3HG2 THR 259 -5.227 4.167 -3.181 84 H VAL 260 H VAL 260 -0.327 3.847 -2.904 85 HA VAL 260 HA VAL 260 -0.397 5.938 -1.015 86 HB VAL 260 HB VAL 260 1.967 4.291 -1.939 87 1HG1 VAL 260 1HG1 VAL 260 1.688 5.915 0.588 88 2HG1 VAL 260 2HG1 VAL 260 2.608 6.422 -0.829 89 3HG1 VAL 260 3HG1 VAL 260 3.093 4.984 0.070 90 1HG2 VAL 260 1HG2 VAL 260 1.543 3.016 0.137 91 2HG2 VAL 260 2HG2 VAL 260 0.208 2.918 -1.013 92 3HG2 VAL 260 3HG2 VAL 260 0.083 3.972 0.395 93 H LEU 261 H LEU 261 1.552 5.576 -3.997 94 HA LEU 261 HA LEU 261 2.938 8.002 -3.867 95 1HB LEU 261 2HB LEU 261 2.688 5.895 -5.682 96 2HB LEU 261 1HB LEU 261 2.168 7.308 -6.579 97 HG LEU 261 HG LEU 261 4.533 6.874 -6.934 98 1HD1 LEU 261 1HD1 LEU 261 4.148 9.128 -7.187 99 2HD1 LEU 261 2HD1 LEU 261 5.408 9.121 -5.953 100 3HD1 LEU 261 3HD1 LEU 261 3.724 9.354 -5.490 101 1HD2 LEU 261 1HD2 LEU 261 5.533 7.659 -4.352 102 2HD2 LEU 261 2HD2 LEU 261 5.917 6.235 -5.321 103 3HD2 LEU 261 3HD2 LEU 261 4.538 6.208 -4.225 104 H THR 262 H THR 262 -0.219 7.245 -5.273 105 HA THR 262 HA THR 262 -0.782 9.789 -6.360 106 HB THR 262 HB THR 262 -2.747 7.746 -5.292 107 HG1 THR 262 1HG THR 262 -1.593 6.742 -6.890 108 1HG2 THR 262 1HG2 THR 262 -3.485 10.183 -5.819 109 2HG2 THR 262 2HG2 THR 262 -4.435 8.835 -6.444 110 3HG2 THR 262 3HG2 THR 262 -3.308 9.684 -7.502 111 H MET 263 H MET 263 -1.733 8.318 -3.266 112 HA MET 263 HA MET 263 -3.105 10.519 -2.196 113 1HB MET 263 2HB MET 263 -3.269 8.249 -1.293 114 2HB MET 263 1HB MET 263 -1.596 8.328 -0.763 115 1HG MET 263 2HG MET 263 -2.193 10.185 0.744 116 2HG MET 263 1HG MET 263 -3.877 10.010 0.254 117 1HE MET 263 1HE MET 263 -1.009 7.713 0.842 118 2HE MET 263 2HE MET 263 -1.584 6.485 1.969 119 3HE MET 263 3HE MET 263 -0.986 8.030 2.577 120 H THR 264 H THR 264 0.326 9.562 -1.799 121 HA THR 264 HA THR 264 0.904 11.824 -0.118 122 HB THR 264 HB THR 264 2.232 9.764 0.074 123 HG1 THR 264 1HG THR 264 3.429 12.250 -0.496 124 1HG2 THR 264 1HG2 THR 264 2.575 8.866 -2.024 125 2HG2 THR 264 2HG2 THR 264 4.134 9.637 -1.730 126 3HG2 THR 264 3HG2 THR 264 2.937 10.432 -2.751 127 H THR 265 H THR 265 0.470 11.568 -3.425 128 HA THR 265 HA THR 265 1.214 12.676 -5.283 129 HB THR 265 HB THR 265 -0.660 13.934 -4.809 130 HG1 THR 265 1HG THR 265 1.522 15.757 -5.012 131 1HG2 THR 265 1HG2 THR 265 -0.832 15.654 -3.099 132 2HG2 THR 265 2HG2 THR 265 0.845 15.370 -2.629 133 3HG2 THR 265 3HG2 THR 265 -0.364 14.108 -2.391 134 H GLN 266 H GLN 266 3.505 11.997 -4.491 135 HA GLN 266 HA GLN 266 5.284 14.049 -3.649 136 1HB GLN 266 2HB GLN 266 5.741 11.357 -4.913 137 2HB GLN 266 1HB GLN 266 7.055 12.413 -4.413 138 1HG GLN 266 2HG GLN 266 4.900 11.371 -2.593 139 2HG GLN 266 1HG GLN 266 6.504 10.662 -2.765 140 1HE2 GLN 266 1HE2 GLN 266 7.826 11.199 -1.212 141 2HE2 GLN 266 2HE2 GLN 266 7.839 12.688 -0.339 142 H SER 267 H SER 267 4.097 13.091 -6.765 143 HA SER 267 HA SER 267 4.362 13.935 -8.858 144 1HB SER 267 2HB SER 267 5.728 16.252 -7.463 145 2HB SER 267 1HB SER 267 5.133 16.253 -9.122 146 HG SER 267 HG SER 267 3.255 15.485 -7.272 147 H SER 268 H SER 268 6.110 12.001 -8.254 148 HA SER 268 HA SER 268 8.018 10.980 -8.921 149 1HB SER 268 2HB SER 268 7.444 11.853 -11.133 150 2HB SER 268 1HB SER 268 8.274 13.365 -10.771 151 HG SER 268 HG SER 268 10.197 12.014 -10.463 152 H GLY 269 H GLY 269 8.158 12.688 -6.620 153 1HA GLY 269 2HA GLY 269 10.951 12.698 -6.197 154 2HA GLY 269 1HA GLY 269 10.415 14.337 -6.528 155 H SER 270 H SER 270 9.038 15.382 -5.052 156 HA SER 270 HA SER 270 7.992 14.202 -2.702 157 1HB SER 270 2HB SER 270 9.487 15.009 -1.009 158 2HB SER 270 1HB SER 270 10.480 14.143 -2.182 159 HG SER 270 HG SER 270 10.155 16.817 -2.745 160 H ARG 271 H ARG 271 6.513 15.598 -1.774 161 HA ARG 271 HA ARG 271 6.751 18.438 -2.521 162 1HB ARG 271 2HB ARG 271 5.105 17.227 -3.984 163 2HB ARG 271 1HB ARG 271 4.143 16.915 -2.545 164 1HG ARG 271 2HG ARG 271 4.070 19.401 -2.188 165 2HG ARG 271 1HG ARG 271 4.786 19.572 -3.789 166 1HD ARG 271 2HD ARG 271 2.200 18.140 -3.205 167 2HD ARG 271 1HD ARG 271 2.315 19.810 -3.749 168 HE ARG 271 HE ARG 271 3.534 17.785 -5.452 169 1HH1 ARG 271 1HH1 ARG 271 0.923 19.959 -4.816 170 2HH1 ARG 271 2HH1 ARG 271 0.194 19.762 -6.396 171 1HH2 ARG 271 1HH2 ARG 271 2.631 17.548 -7.518 172 2HH2 ARG 271 2HH2 ARG 271 1.185 18.437 -7.909 173 H ALA 272 H ALA 272 6.409 19.856 -0.915 174 HA ALA 272 HA ALA 272 5.779 18.831 1.731 175 1HB ALA 272 1HB ALA 272 7.613 20.278 1.765 176 2HB ALA 272 2HB ALA 272 6.282 21.270 2.364 177 3HB ALA 272 3HB ALA 272 6.830 21.443 0.697 178 H SER 273 H SER 273 4.791 21.776 2.259 179 HA SER 273 HA SER 273 1.991 21.110 2.101 180 1HB SER 273 2HB SER 273 1.633 23.334 3.143 181 2HB SER 273 1HB SER 273 2.741 22.304 4.048 182 HG SER 273 HG SER 273 3.384 24.487 2.354 183 H LEU 274 H LEU 274 2.455 20.926 -0.325 184 HA LEU 274 HA LEU 274 1.360 23.383 -1.512 185 1HB LEU 274 2HB LEU 274 3.782 23.008 -2.108 186 2HB LEU 274 1HB LEU 274 3.289 21.533 -2.917 187 HG LEU 274 HG LEU 274 1.861 22.880 -4.436 188 1HD1 LEU 274 1HD1 LEU 274 3.099 25.420 -4.006 189 2HD1 LEU 274 2HD1 LEU 274 2.312 24.888 -2.521 190 3HD1 LEU 274 3HD1 LEU 274 1.385 25.003 -4.016 191 1HD2 LEU 274 1HD2 LEU 274 4.384 24.228 -4.880 192 2HD2 LEU 274 2HD2 LEU 274 3.585 22.983 -5.840 193 3HD2 LEU 274 3HD2 LEU 274 4.610 22.526 -4.479 194 HA PRO 275 HA PRO 275 -1.076 19.186 -2.062 195 1HB PRO 275 2HB PRO 275 -3.131 21.078 -0.986 196 2HB PRO 275 1HB PRO 275 -2.980 19.330 -0.755 197 1HG PRO 275 2HG PRO 275 -2.211 20.932 1.177 198 2HG PRO 275 1HG PRO 275 -1.185 19.556 0.718 199 1HD PRO 275 2HD PRO 275 -0.846 22.459 0.078 200 2HD PRO 275 1HD PRO 275 0.385 21.255 0.530 201 H LYS 276 H LYS 276 -2.139 18.775 -3.919 202 HA LYS 276 HA LYS 276 -3.234 19.007 -5.892 203 1HB LYS 276 2HB LYS 276 -4.014 21.734 -4.848 204 2HB LYS 276 1HB LYS 276 -4.653 20.997 -6.310 205 1HG LYS 276 2HG LYS 276 -5.648 19.211 -5.003 206 2HG LYS 276 1HG LYS 276 -4.958 19.889 -3.525 207 1HD LYS 276 2HD LYS 276 -6.253 21.951 -3.895 208 2HD LYS 276 1HD LYS 276 -6.969 21.228 -5.336 209 1HE LYS 276 2HE LYS 276 -7.967 19.472 -3.975 210 2HE LYS 276 1HE LYS 276 -7.219 20.152 -2.529 211 1HZ LYS 276 1HZ LYS 276 -9.489 21.150 -4.093 212 2HZ LYS 276 2HZ LYS 276 -8.498 22.277 -3.311 213 3HZ LYS 276 3HZ LYS 276 -9.285 21.078 -2.414 Start of MODEL 12 1 1H ALA 249 1HT ALA 249 5.824 -7.850 -12.710 2 2H ALA 249 2HT ALA 249 4.169 -7.534 -12.875 3 3H ALA 249 3HT ALA 249 4.689 -9.047 -12.324 4 HA ALA 249 HA ALA 249 5.611 -8.036 -10.336 5 1HB ALA 249 1HB ALA 249 4.196 -5.496 -10.740 6 2HB ALA 249 2HB ALA 249 5.616 -5.734 -11.757 7 3HB ALA 249 3HB ALA 249 5.762 -5.821 -10.000 8 HA PRO 250 HA PRO 250 1.786 -9.185 -8.473 9 1HB PRO 250 2HB PRO 250 2.525 -7.465 -6.177 10 2HB PRO 250 1HB PRO 250 2.238 -9.206 -6.229 11 1HG PRO 250 2HG PRO 250 4.693 -8.269 -5.940 12 2HG PRO 250 1HG PRO 250 4.385 -9.662 -6.998 13 1HD PRO 250 2HD PRO 250 4.751 -6.779 -7.733 14 2HD PRO 250 1HD PRO 250 5.496 -8.222 -8.458 15 H ALA 251 H ALA 251 -0.248 -8.482 -8.656 16 HA ALA 251 HA ALA 251 -0.924 -5.903 -9.488 17 1HB ALA 251 1HB ALA 251 -2.331 -7.759 -10.023 18 2HB ALA 251 2HB ALA 251 -3.270 -6.611 -9.068 19 3HB ALA 251 3HB ALA 251 -2.643 -8.078 -8.317 20 H ARG 252 H ARG 252 -1.393 -7.399 -6.274 21 HA ARG 252 HA ARG 252 -2.613 -5.197 -5.058 22 1HB ARG 252 2HB ARG 252 -2.732 -7.282 -3.921 23 2HB ARG 252 1HB ARG 252 -0.983 -7.457 -3.908 24 1HG ARG 252 2HG ARG 252 -1.979 -6.856 -1.703 25 2HG ARG 252 1HG ARG 252 -0.741 -5.734 -2.274 26 1HD ARG 252 2HD ARG 252 -2.653 -4.347 -3.209 27 2HD ARG 252 1HD ARG 252 -3.723 -5.363 -2.248 28 HE ARG 252 HE ARG 252 -1.803 -4.427 -0.510 29 1HH1 ARG 252 1HH1 ARG 252 -4.224 -3.046 -2.559 30 2HH1 ARG 252 2HH1 ARG 252 -4.455 -1.639 -1.553 31 1HH2 ARG 252 1HH2 ARG 252 -2.082 -2.581 0.770 32 2HH2 ARG 252 2HH2 ARG 252 -3.217 -1.368 0.277 33 H VAL 253 H VAL 253 0.814 -6.109 -5.125 34 HA VAL 253 HA VAL 253 1.729 -3.967 -3.565 35 HB VAL 253 HB VAL 253 3.248 -5.447 -5.713 36 1HG1 VAL 253 1HG1 VAL 253 4.034 -3.170 -4.488 37 2HG1 VAL 253 2HG1 VAL 253 5.144 -4.432 -5.024 38 3HG1 VAL 253 3HG1 VAL 253 4.623 -4.372 -3.340 39 1HG2 VAL 253 1HG2 VAL 253 4.088 -6.755 -3.727 40 2HG2 VAL 253 2HG2 VAL 253 2.403 -7.037 -4.165 41 3HG2 VAL 253 3HG2 VAL 253 2.796 -6.005 -2.789 42 H GLY 254 H GLY 254 1.412 -4.297 -7.090 43 1HA GLY 254 2HA GLY 254 2.454 -1.759 -7.768 44 2HA GLY 254 1HA GLY 254 1.337 -2.698 -8.749 45 H LEU 255 H LEU 255 -0.899 -2.825 -7.203 46 HA LEU 255 HA LEU 255 -2.119 -0.325 -7.611 47 1HB LEU 255 2HB LEU 255 -2.866 -2.885 -6.374 48 2HB LEU 255 1HB LEU 255 -3.742 -1.486 -5.777 49 HG LEU 255 HG LEU 255 -3.573 -2.381 -8.649 50 1HD1 LEU 255 1HD1 LEU 255 -5.888 -2.338 -6.721 51 2HD1 LEU 255 2HD1 LEU 255 -4.988 -3.777 -7.201 52 3HD1 LEU 255 3HD1 LEU 255 -5.925 -2.884 -8.398 53 1HD2 LEU 255 1HD2 LEU 255 -5.598 -0.474 -8.277 54 2HD2 LEU 255 2HD2 LEU 255 -4.099 -0.290 -9.188 55 3HD2 LEU 255 3HD2 LEU 255 -4.161 0.178 -7.489 56 H GLY 256 H GLY 256 -1.032 -1.908 -4.610 57 1HA GLY 256 2HA GLY 256 -1.798 0.074 -2.813 58 2HA GLY 256 1HA GLY 256 -0.475 -1.054 -2.565 59 H ILE 257 H ILE 257 1.406 -0.307 -4.404 60 HA ILE 257 HA ILE 257 2.476 2.034 -3.226 61 HB ILE 257 HB ILE 257 4.246 1.973 -4.910 62 1HG1 ILE 257 2HG1 ILE 257 4.020 -0.327 -6.340 63 2HG1 ILE 257 1HG1 ILE 257 2.346 0.213 -6.327 64 1HG2 ILE 257 1HG2 ILE 257 5.299 0.118 -4.068 65 2HG2 ILE 257 2HG2 ILE 257 3.841 -0.875 -4.129 66 3HG2 ILE 257 3HG2 ILE 257 4.015 0.363 -2.883 67 1HD1 ILE 257 1HD1 ILE 257 4.308 2.288 -6.995 68 2HD1 ILE 257 2HD1 ILE 257 2.752 1.907 -7.735 69 3HD1 ILE 257 3HD1 ILE 257 4.182 0.963 -8.153 70 H THR 258 H THR 258 0.547 1.481 -6.112 71 HA THR 258 HA THR 258 0.896 4.040 -7.282 72 HB THR 258 HB THR 258 -1.511 2.206 -7.470 73 HG1 THR 258 1HG THR 258 0.320 1.191 -8.306 74 1HG2 THR 258 1HG2 THR 258 -2.405 3.559 -9.061 75 2HG2 THR 258 2HG2 THR 258 -0.829 4.092 -9.646 76 3HG2 THR 258 3HG2 THR 258 -1.511 4.799 -8.182 77 H THR 259 H THR 259 -1.596 2.788 -5.006 78 HA THR 259 HA THR 259 -3.033 5.224 -4.831 79 HB THR 259 HB THR 259 -3.129 3.802 -2.318 80 HG1 THR 259 1HG THR 259 -3.469 1.780 -2.937 81 1HG2 THR 259 1HG2 THR 259 -5.218 3.940 -4.480 82 2HG2 THR 259 2HG2 THR 259 -4.854 5.289 -3.403 83 3HG2 THR 259 3HG2 THR 259 -5.457 3.771 -2.741 84 H VAL 260 H VAL 260 -0.382 3.879 -2.886 85 HA VAL 260 HA VAL 260 -0.289 5.923 -0.945 86 HB VAL 260 HB VAL 260 1.893 4.110 -1.987 87 1HG1 VAL 260 1HG1 VAL 260 3.305 4.785 -0.243 88 2HG1 VAL 260 2HG1 VAL 260 2.008 5.636 0.596 89 3HG1 VAL 260 3HG1 VAL 260 2.669 6.293 -0.902 90 1HG2 VAL 260 1HG2 VAL 260 0.938 2.565 -0.711 91 2HG2 VAL 260 2HG2 VAL 260 -0.339 3.705 -0.286 92 3HG2 VAL 260 3HG2 VAL 260 1.119 3.606 0.701 93 H LEU 261 H LEU 261 1.499 5.557 -4.009 94 HA LEU 261 HA LEU 261 2.956 7.970 -3.829 95 1HB LEU 261 2HB LEU 261 2.460 5.913 -5.797 96 2HB LEU 261 1HB LEU 261 2.463 7.496 -6.546 97 HG LEU 261 HG LEU 261 4.663 6.465 -6.646 98 1HD1 LEU 261 1HD1 LEU 261 4.091 9.035 -5.881 99 2HD1 LEU 261 2HD1 LEU 261 5.668 8.444 -6.407 100 3HD1 LEU 261 3HD1 LEU 261 5.287 8.529 -4.687 101 1HD2 LEU 261 1HD2 LEU 261 5.497 6.721 -3.936 102 2HD2 LEU 261 2HD2 LEU 261 5.493 5.286 -4.961 103 3HD2 LEU 261 3HD2 LEU 261 4.073 5.683 -3.993 104 H THR 262 H THR 262 -0.176 7.175 -5.226 105 HA THR 262 HA THR 262 -0.728 9.670 -6.412 106 HB THR 262 HB THR 262 -2.696 7.639 -5.336 107 HG1 THR 262 1HG THR 262 -1.507 6.663 -6.930 108 1HG2 THR 262 1HG2 THR 262 -3.507 10.034 -5.830 109 2HG2 THR 262 2HG2 THR 262 -4.384 8.691 -6.562 110 3HG2 THR 262 3HG2 THR 262 -3.234 9.623 -7.523 111 H MET 263 H MET 263 -1.812 8.394 -3.215 112 HA MET 263 HA MET 263 -1.751 11.069 -2.146 113 1HB MET 263 2HB MET 263 -4.163 11.059 -1.527 114 2HB MET 263 1HB MET 263 -3.844 11.218 -3.247 115 1HG MET 263 2HG MET 263 -4.362 8.851 -3.558 116 2HG MET 263 1HG MET 263 -4.694 8.701 -1.833 117 1HE MET 263 1HE MET 263 -5.320 11.480 -4.331 118 2HE MET 263 2HE MET 263 -7.073 11.585 -4.492 119 3HE MET 263 3HE MET 263 -6.189 10.289 -5.299 120 H THR 264 H THR 264 -0.212 9.191 -1.070 121 HA THR 264 HA THR 264 -1.284 7.453 0.837 122 HB THR 264 HB THR 264 1.071 7.363 0.262 123 HG1 THR 264 1HG THR 264 1.900 7.350 2.513 124 1HG2 THR 264 1HG2 THR 264 2.189 9.404 1.891 125 2HG2 THR 264 2HG2 THR 264 1.013 10.156 0.814 126 3HG2 THR 264 3HG2 THR 264 2.332 9.195 0.145 127 H THR 265 H THR 265 -0.716 10.919 1.079 128 HA THR 265 HA THR 265 -1.098 11.124 3.893 129 HB THR 265 HB THR 265 0.125 12.846 2.683 130 HG1 THR 265 1HG THR 265 -2.199 13.515 4.133 131 1HG2 THR 265 1HG2 THR 265 -1.575 14.543 1.488 132 2HG2 THR 265 2HG2 THR 265 -2.403 13.023 1.149 133 3HG2 THR 265 3HG2 THR 265 -0.737 13.257 0.619 134 H GLN 266 H GLN 266 -3.352 10.398 1.531 135 HA GLN 266 HA GLN 266 -5.576 11.964 2.295 136 1HB GLN 266 2HB GLN 266 -5.627 10.762 0.213 137 2HB GLN 266 1HB GLN 266 -5.408 9.224 1.034 138 1HG GLN 266 2HG GLN 266 -7.629 9.670 2.165 139 2HG GLN 266 1HG GLN 266 -7.837 10.986 1.011 140 1HE2 GLN 266 1HE2 GLN 266 -9.188 10.382 -0.529 141 2HE2 GLN 266 2HE2 GLN 266 -9.211 8.842 -1.313 142 H SER 267 H SER 267 -6.781 11.929 4.081 143 HA SER 267 HA SER 267 -6.333 9.910 6.096 144 1HB SER 267 2HB SER 267 -7.867 11.285 7.475 145 2HB SER 267 1HB SER 267 -6.544 12.230 6.795 146 HG SER 267 HG SER 267 -9.263 12.194 6.052 147 H SER 268 H SER 268 -7.757 8.414 6.856 148 HA SER 268 HA SER 268 -10.487 8.264 5.990 149 1HB SER 268 2HB SER 268 -8.478 6.282 4.900 150 2HB SER 268 1HB SER 268 -10.214 5.973 4.941 151 HG SER 268 HG SER 268 -9.520 8.414 3.853 152 H GLY 269 H GLY 269 -11.714 6.937 7.309 153 1HA GLY 269 2HA GLY 269 -12.211 5.575 9.104 154 2HA GLY 269 1HA GLY 269 -10.575 4.939 9.006 155 H SER 270 H SER 270 -9.746 5.090 11.006 156 HA SER 270 HA SER 270 -9.242 7.673 12.139 157 1HB SER 270 2HB SER 270 -11.187 5.836 13.552 158 2HB SER 270 1HB SER 270 -10.333 7.147 14.362 159 HG SER 270 HG SER 270 -11.608 7.877 12.024 160 H ARG 271 H ARG 271 -7.388 7.624 13.245 161 HA ARG 271 HA ARG 271 -5.544 6.909 14.360 162 1HB ARG 271 2HB ARG 271 -7.125 5.903 15.942 163 2HB ARG 271 1HB ARG 271 -7.183 4.445 14.963 164 1HG ARG 271 2HG ARG 271 -4.784 4.092 15.393 165 2HG ARG 271 1HG ARG 271 -4.787 5.517 16.437 166 1HD ARG 271 2HD ARG 271 -5.000 3.433 17.721 167 2HD ARG 271 1HD ARG 271 -6.413 4.472 17.903 168 HE ARG 271 HE ARG 271 -6.841 2.645 15.806 169 1HH1 ARG 271 1HH1 ARG 271 -6.645 2.773 19.248 170 2HH1 ARG 271 2HH1 ARG 271 -7.680 1.411 19.473 171 1HH2 ARG 271 1HH2 ARG 271 -8.178 0.875 16.096 172 2HH2 ARG 271 2HH2 ARG 271 -8.535 0.334 17.699 173 H ALA 272 H ALA 272 -6.990 4.287 12.429 174 HA ALA 272 HA ALA 272 -4.425 3.939 11.066 175 1HB ALA 272 1HB ALA 272 -4.000 2.222 12.493 176 2HB ALA 272 2HB ALA 272 -4.988 1.349 11.321 177 3HB ALA 272 3HB ALA 272 -5.707 1.927 12.824 178 H SER 273 H SER 273 -5.786 1.256 10.187 179 HA SER 273 HA SER 273 -6.828 0.515 8.311 180 1HB SER 273 2HB SER 273 -9.126 1.346 7.903 181 2HB SER 273 1HB SER 273 -8.837 0.882 9.576 182 HG SER 273 HG SER 273 -8.277 3.510 9.180 183 H LEU 274 H LEU 274 -4.851 1.725 7.386 184 HA LEU 274 HA LEU 274 -5.893 3.412 5.211 185 1HB LEU 274 2HB LEU 274 -3.170 3.546 6.506 186 2HB LEU 274 1HB LEU 274 -3.646 4.451 5.084 187 HG LEU 274 HG LEU 274 -4.940 4.746 7.798 188 1HD1 LEU 274 1HD1 LEU 274 -3.405 6.988 6.752 189 2HD1 LEU 274 2HD1 LEU 274 -2.417 5.568 7.096 190 3HD1 LEU 274 3HD1 LEU 274 -3.417 6.274 8.365 191 1HD2 LEU 274 1HD2 LEU 274 -5.107 6.655 5.492 192 2HD2 LEU 274 2HD2 LEU 274 -6.145 6.537 6.912 193 3HD2 LEU 274 3HD2 LEU 274 -6.236 5.309 5.649 194 HA PRO 275 HA PRO 275 -3.577 -0.689 3.853 195 1HB PRO 275 2HB PRO 275 -6.273 -1.113 2.642 196 2HB PRO 275 1HB PRO 275 -5.128 -2.298 3.287 197 1HG PRO 275 2HG PRO 275 -7.216 -1.651 4.737 198 2HG PRO 275 1HG PRO 275 -5.614 -1.743 5.502 199 1HD PRO 275 2HD PRO 275 -7.154 0.683 4.643 200 2HD PRO 275 1HD PRO 275 -6.252 0.402 6.151 201 H LYS 276 H LYS 276 -6.101 1.077 2.082 202 HA LYS 276 HA LYS 276 -6.241 1.891 -0.042 203 1HB LYS 276 2HB LYS 276 -3.402 2.676 0.629 204 2HB LYS 276 1HB LYS 276 -4.357 3.367 -0.677 205 1HG LYS 276 2HG LYS 276 -5.989 4.184 0.959 206 2HG LYS 276 1HG LYS 276 -5.006 3.515 2.262 207 1HD LYS 276 2HD LYS 276 -3.157 4.985 1.620 208 2HD LYS 276 1HD LYS 276 -4.135 5.646 0.308 209 1HE LYS 276 2HE LYS 276 -5.793 6.394 1.998 210 2HE LYS 276 1HE LYS 276 -4.697 5.843 3.263 211 1HZ LYS 276 1HZ LYS 276 -3.047 7.418 2.486 212 2HZ LYS 276 2HZ LYS 276 -4.496 8.219 2.868 213 3HZ LYS 276 3HZ LYS 276 -4.082 7.934 1.243 Start of MODEL 13 1 1H ALA 249 1HT ALA 249 1.278 -12.122 -10.041 2 2H ALA 249 2HT ALA 249 2.229 -12.507 -11.389 3 3H ALA 249 3HT ALA 249 0.692 -11.833 -11.604 4 HA ALA 249 HA ALA 249 3.212 -10.565 -11.019 5 1HB ALA 249 1HB ALA 249 0.639 -9.814 -12.357 6 2HB ALA 249 2HB ALA 249 2.250 -9.984 -13.056 7 3HB ALA 249 3HB ALA 249 1.883 -8.610 -12.013 8 HA PRO 250 HA PRO 250 2.245 -8.639 -7.168 9 1HB PRO 250 2HB PRO 250 3.647 -6.235 -8.128 10 2HB PRO 250 1HB PRO 250 4.084 -7.339 -6.823 11 1HG PRO 250 2HG PRO 250 5.477 -7.278 -9.087 12 2HG PRO 250 1HG PRO 250 5.150 -8.813 -8.256 13 1HD PRO 250 2HD PRO 250 3.720 -7.594 -10.597 14 2HD PRO 250 1HD PRO 250 4.325 -9.254 -10.400 15 H ALA 251 H ALA 251 -0.038 -8.432 -8.562 16 HA ALA 251 HA ALA 251 -0.897 -5.890 -9.366 17 1HB ALA 251 1HB ALA 251 -3.216 -6.820 -8.801 18 2HB ALA 251 2HB ALA 251 -2.367 -8.305 -8.368 19 3HB ALA 251 3HB ALA 251 -2.255 -7.672 -10.011 20 H ARG 252 H ARG 252 -1.203 -7.457 -6.176 21 HA ARG 252 HA ARG 252 -2.571 -5.343 -4.906 22 1HB ARG 252 2HB ARG 252 -1.953 -7.859 -4.177 23 2HB ARG 252 1HB ARG 252 -0.697 -7.001 -3.300 24 1HG ARG 252 2HG ARG 252 -3.655 -6.487 -3.052 25 2HG ARG 252 1HG ARG 252 -2.676 -7.422 -1.922 26 1HD ARG 252 2HD ARG 252 -1.317 -5.425 -1.477 27 2HD ARG 252 1HD ARG 252 -2.333 -4.499 -2.579 28 HE ARG 252 HE ARG 252 -3.871 -5.735 -0.533 29 1HH1 ARG 252 1HH1 ARG 252 -1.809 -3.057 -1.228 30 2HH1 ARG 252 2HH1 ARG 252 -2.439 -2.077 0.046 31 1HH2 ARG 252 1HH2 ARG 252 -4.699 -4.463 1.138 32 2HH2 ARG 252 2HH2 ARG 252 -4.071 -2.874 1.386 33 H VAL 253 H VAL 253 0.868 -6.092 -5.226 34 HA VAL 253 HA VAL 253 1.859 -4.008 -3.601 35 HB VAL 253 HB VAL 253 3.224 -5.322 -5.957 36 1HG1 VAL 253 1HG1 VAL 253 4.050 -3.126 -4.518 37 2HG1 VAL 253 2HG1 VAL 253 5.090 -4.205 -5.450 38 3HG1 VAL 253 3HG1 VAL 253 4.877 -4.464 -3.719 39 1HG2 VAL 253 1HG2 VAL 253 3.473 -7.166 -4.746 40 2HG2 VAL 253 2HG2 VAL 253 2.362 -6.483 -3.561 41 3HG2 VAL 253 3HG2 VAL 253 4.100 -6.243 -3.380 42 H GLY 254 H GLY 254 1.396 -4.248 -7.120 43 1HA GLY 254 2HA GLY 254 2.293 -1.674 -7.808 44 2HA GLY 254 1HA GLY 254 1.147 -2.630 -8.739 45 H LEU 255 H LEU 255 -0.995 -2.813 -7.057 46 HA LEU 255 HA LEU 255 -2.306 -0.345 -7.391 47 1HB LEU 255 2HB LEU 255 -2.896 -2.914 -6.067 48 2HB LEU 255 1HB LEU 255 -3.796 -1.527 -5.480 49 HG LEU 255 HG LEU 255 -3.709 -2.490 -8.334 50 1HD1 LEU 255 1HD1 LEU 255 -5.303 -3.224 -6.062 51 2HD1 LEU 255 2HD1 LEU 255 -5.320 -3.882 -7.698 52 3HD1 LEU 255 3HD1 LEU 255 -6.311 -2.477 -7.300 53 1HD2 LEU 255 1HD2 LEU 255 -3.950 -0.144 -8.398 54 2HD2 LEU 255 2HD2 LEU 255 -5.032 -0.139 -7.005 55 3HD2 LEU 255 3HD2 LEU 255 -5.583 -0.794 -8.548 56 H GLY 256 H GLY 256 -0.852 -1.872 -4.553 57 1HA GLY 256 2HA GLY 256 -1.604 0.074 -2.681 58 2HA GLY 256 1HA GLY 256 -0.257 -1.041 -2.514 59 H ILE 257 H ILE 257 1.534 -0.272 -4.421 60 HA ILE 257 HA ILE 257 2.607 2.086 -3.288 61 HB ILE 257 HB ILE 257 4.319 2.029 -5.048 62 1HG1 ILE 257 2HG1 ILE 257 4.064 -0.325 -6.392 63 2HG1 ILE 257 1HG1 ILE 257 2.386 0.206 -6.337 64 1HG2 ILE 257 1HG2 ILE 257 3.704 -0.632 -3.781 65 2HG2 ILE 257 2HG2 ILE 257 4.625 0.694 -3.069 66 3HG2 ILE 257 3HG2 ILE 257 5.261 -0.170 -4.469 67 1HD1 ILE 257 1HD1 ILE 257 3.762 0.873 -8.362 68 2HD1 ILE 257 2HD1 ILE 257 4.590 2.003 -7.290 69 3HD1 ILE 257 3HD1 ILE 257 2.852 2.151 -7.555 70 H THR 258 H THR 258 0.722 1.539 -6.227 71 HA THR 258 HA THR 258 1.032 4.123 -7.342 72 HB THR 258 HB THR 258 -1.306 2.224 -7.645 73 HG1 THR 258 1HG THR 258 0.463 1.175 -8.429 74 1HG2 THR 258 1HG2 THR 258 -1.756 3.417 -9.726 75 2HG2 THR 258 2HG2 THR 258 -0.419 4.518 -9.399 76 3HG2 THR 258 3HG2 THR 258 -1.838 4.518 -8.350 77 H THR 259 H THR 259 -1.498 2.763 -5.222 78 HA THR 259 HA THR 259 -3.033 5.137 -5.079 79 HB THR 259 HB THR 259 -3.986 4.118 -2.961 80 HG1 THR 259 1HG THR 259 -2.579 1.775 -3.716 81 1HG2 THR 259 1HG2 THR 259 -4.099 2.068 -5.121 82 2HG2 THR 259 2HG2 THR 259 -4.657 3.704 -5.475 83 3HG2 THR 259 3HG2 THR 259 -5.403 2.781 -4.172 84 H VAL 260 H VAL 260 -0.494 3.807 -2.974 85 HA VAL 260 HA VAL 260 -0.580 5.849 -1.029 86 HB VAL 260 HB VAL 260 1.688 4.046 -1.885 87 1HG1 VAL 260 1HG1 VAL 260 2.365 4.796 0.612 88 2HG1 VAL 260 2HG1 VAL 260 1.634 6.290 0.026 89 3HG1 VAL 260 3HG1 VAL 260 2.988 5.571 -0.845 90 1HG2 VAL 260 1HG2 VAL 260 0.555 2.531 -0.718 91 2HG2 VAL 260 2HG2 VAL 260 -0.622 3.735 -0.194 92 3HG2 VAL 260 3HG2 VAL 260 0.865 3.495 0.726 93 H LEU 261 H LEU 261 1.477 5.473 -3.937 94 HA LEU 261 HA LEU 261 2.938 7.858 -3.694 95 1HB LEU 261 2HB LEU 261 3.398 5.996 -5.292 96 2HB LEU 261 1HB LEU 261 2.052 6.563 -6.264 97 HG LEU 261 HG LEU 261 3.186 8.675 -6.674 98 1HD1 LEU 261 1HD1 LEU 261 4.452 9.229 -4.844 99 2HD1 LEU 261 2HD1 LEU 261 5.709 8.633 -5.928 100 3HD1 LEU 261 3HD1 LEU 261 5.083 7.595 -4.646 101 1HD2 LEU 261 1HD2 LEU 261 4.278 7.763 -8.382 102 2HD2 LEU 261 2HD2 LEU 261 3.913 6.191 -7.668 103 3HD2 LEU 261 3HD2 LEU 261 5.446 6.988 -7.313 104 H THR 262 H THR 262 -0.180 7.209 -5.238 105 HA THR 262 HA THR 262 -0.618 9.773 -6.339 106 HB THR 262 HB THR 262 -2.650 7.750 -5.359 107 HG1 THR 262 1HG THR 262 -1.443 6.830 -6.993 108 1HG2 THR 262 1HG2 THR 262 -3.115 10.369 -6.081 109 2HG2 THR 262 2HG2 THR 262 -4.302 9.065 -6.088 110 3HG2 THR 262 3HG2 THR 262 -3.432 9.474 -7.567 111 H MET 263 H MET 263 -1.649 8.324 -3.270 112 HA MET 263 HA MET 263 -3.016 10.534 -2.213 113 1HB MET 263 2HB MET 263 -3.203 8.272 -1.302 114 2HB MET 263 1HB MET 263 -1.526 8.327 -0.778 115 1HG MET 263 2HG MET 263 -2.072 10.152 0.757 116 2HG MET 263 1HG MET 263 -3.757 10.069 0.243 117 1HE MET 263 1HE MET 263 -1.276 7.069 0.762 118 2HE MET 263 2HE MET 263 -1.606 6.619 2.435 119 3HE MET 263 3HE MET 263 -0.828 8.161 2.072 120 H THR 264 H THR 264 0.399 9.539 -1.766 121 HA THR 264 HA THR 264 0.960 11.888 -0.177 122 HB THR 264 HB THR 264 2.181 9.833 0.305 123 HG1 THR 264 1HG THR 264 3.778 11.984 -0.675 124 1HG2 THR 264 1HG2 THR 264 2.421 8.773 -1.808 125 2HG2 THR 264 2HG2 THR 264 4.052 9.169 -1.262 126 3HG2 THR 264 3HG2 THR 264 3.265 10.165 -2.487 127 H THR 265 H THR 265 -0.082 12.809 -2.515 128 HA THR 265 HA THR 265 1.729 13.431 -4.569 129 HB THR 265 HB THR 265 -0.579 13.798 -5.005 130 HG1 THR 265 1HG THR 265 1.160 15.530 -5.612 131 1HG2 THR 265 1HG2 THR 265 -0.958 14.442 -2.468 132 2HG2 THR 265 2HG2 THR 265 -2.069 14.980 -3.728 133 3HG2 THR 265 3HG2 THR 265 -0.836 16.081 -3.110 134 H GLN 266 H GLN 266 1.051 15.087 -1.528 135 HA GLN 266 HA GLN 266 2.998 17.169 -2.129 136 1HB GLN 266 2HB GLN 266 0.927 17.824 -1.007 137 2HB GLN 266 1HB GLN 266 1.263 16.701 0.304 138 1HG GLN 266 2HG GLN 266 3.245 17.991 0.905 139 2HG GLN 266 1HG GLN 266 2.913 19.112 -0.414 140 1HE2 GLN 266 1HE2 GLN 266 2.057 20.920 0.263 141 2HE2 GLN 266 2HE2 GLN 266 0.949 21.100 1.574 142 H SER 267 H SER 267 5.063 17.134 -1.425 143 HA SER 267 HA SER 267 5.879 15.767 0.950 144 1HB SER 267 2HB SER 267 5.634 13.851 -0.640 145 2HB SER 267 1HB SER 267 6.851 14.600 -1.672 146 HG SER 267 HG SER 267 7.295 12.963 0.279 147 H SER 268 H SER 268 8.193 16.004 1.372 148 HA SER 268 HA SER 268 9.155 18.567 0.725 149 1HB SER 268 2HB SER 268 9.864 17.513 2.775 150 2HB SER 268 1HB SER 268 10.586 16.170 1.889 151 HG SER 268 HG SER 268 12.327 17.316 1.622 152 H GLY 269 H GLY 269 9.868 15.404 -0.659 153 1HA GLY 269 2HA GLY 269 10.801 14.878 -2.716 154 2HA GLY 269 1HA GLY 269 10.915 16.598 -3.064 155 H SER 270 H SER 270 12.550 17.698 -1.430 156 HA SER 270 HA SER 270 15.050 16.149 -1.633 157 1HB SER 270 2HB SER 270 14.978 18.308 -2.879 158 2HB SER 270 1HB SER 270 14.713 19.150 -1.353 159 HG SER 270 HG SER 270 17.026 18.340 -2.453 160 H ARG 271 H ARG 271 16.410 18.041 0.156 161 HA ARG 271 HA ARG 271 16.948 18.357 2.340 162 1HB ARG 271 2HB ARG 271 14.020 18.030 2.528 163 2HB ARG 271 1HB ARG 271 14.912 17.715 4.008 164 1HG ARG 271 2HG ARG 271 14.249 19.986 4.044 165 2HG ARG 271 1HG ARG 271 15.986 19.956 3.743 166 1HD ARG 271 2HD ARG 271 14.907 21.590 2.312 167 2HD ARG 271 1HD ARG 271 15.562 20.267 1.348 168 HE ARG 271 HE ARG 271 12.934 19.600 1.862 169 1HH1 ARG 271 1HH1 ARG 271 14.616 22.185 0.302 170 2HH1 ARG 271 2HH1 ARG 271 13.342 22.495 -0.822 171 1HH2 ARG 271 1HH2 ARG 271 11.286 19.989 0.405 172 2HH2 ARG 271 2HH2 ARG 271 11.455 21.255 -0.760 173 H ALA 272 H ALA 272 14.913 15.440 2.024 174 HA ALA 272 HA ALA 272 15.181 13.296 2.751 175 1HB ALA 272 1HB ALA 272 18.064 13.380 3.189 176 2HB ALA 272 2HB ALA 272 17.578 13.995 1.609 177 3HB ALA 272 3HB ALA 272 17.110 12.367 2.105 178 H SER 273 H SER 273 14.507 15.139 4.701 179 HA SER 273 HA SER 273 16.145 14.882 7.035 180 1HB SER 273 2HB SER 273 13.252 15.726 6.936 181 2HB SER 273 1HB SER 273 14.426 16.064 8.206 182 HG SER 273 HG SER 273 15.426 17.506 6.927 183 H LEU 274 H LEU 274 16.080 12.432 6.492 184 HA LEU 274 HA LEU 274 14.114 11.279 8.351 185 1HB LEU 274 2HB LEU 274 14.475 9.144 6.944 186 2HB LEU 274 1HB LEU 274 13.402 10.392 6.345 187 HG LEU 274 HG LEU 274 15.691 11.170 5.155 188 1HD1 LEU 274 1HD1 LEU 274 15.917 8.211 5.590 189 2HD1 LEU 274 2HD1 LEU 274 17.130 9.465 5.856 190 3HD1 LEU 274 3HD1 LEU 274 16.667 9.020 4.215 191 1HD2 LEU 274 1HD2 LEU 274 14.138 10.975 3.574 192 2HD2 LEU 274 2HD2 LEU 274 13.336 9.644 4.409 193 3HD2 LEU 274 3HD2 LEU 274 14.719 9.324 3.362 194 HA PRO 275 HA PRO 275 18.804 10.414 9.363 195 1HB PRO 275 2HB PRO 275 18.056 12.047 11.743 196 2HB PRO 275 1HB PRO 275 19.594 11.966 10.870 197 1HG PRO 275 2HG PRO 275 18.053 14.051 10.496 198 2HG PRO 275 1HG PRO 275 18.783 13.245 9.089 199 1HD PRO 275 2HD PRO 275 15.991 12.988 10.158 200 2HD PRO 275 1HD PRO 275 16.519 13.261 8.480 201 H LYS 276 H LYS 276 15.942 10.692 11.427 202 HA LYS 276 HA LYS 276 15.061 9.434 13.083 203 1HB LYS 276 2HB LYS 276 14.693 8.090 11.044 204 2HB LYS 276 1HB LYS 276 16.173 7.207 11.388 205 1HG LYS 276 2HG LYS 276 15.040 6.681 13.651 206 2HG LYS 276 1HG LYS 276 13.554 7.130 12.802 207 1HD LYS 276 2HD LYS 276 13.636 4.907 12.309 208 2HD LYS 276 1HD LYS 276 14.539 5.572 10.948 209 1HE LYS 276 2HE LYS 276 15.697 4.347 13.453 210 2HE LYS 276 1HE LYS 276 15.717 3.652 11.835 211 1HZ LYS 276 1HZ LYS 276 17.836 4.614 12.235 212 2HZ LYS 276 2HZ LYS 276 17.167 6.082 12.777 213 3HZ LYS 276 3HZ LYS 276 17.042 5.633 11.140 Start of MODEL 14 1 1H ALA 249 1HT ALA 249 3.949 -7.041 -13.599 2 2H ALA 249 2HT ALA 249 3.001 -8.326 -13.037 3 3H ALA 249 3HT ALA 249 4.675 -8.522 -13.212 4 HA ALA 249 HA ALA 249 4.968 -7.916 -11.133 5 1HB ALA 249 1HB ALA 249 5.427 -5.749 -11.126 6 2HB ALA 249 2HB ALA 249 3.715 -5.396 -10.888 7 3HB ALA 249 3HB ALA 249 4.376 -5.502 -12.520 8 HA PRO 250 HA PRO 250 1.476 -9.065 -8.702 9 1HB PRO 250 2HB PRO 250 2.591 -7.395 -6.524 10 2HB PRO 250 1HB PRO 250 2.267 -9.130 -6.555 11 1HG PRO 250 2HG PRO 250 4.755 -8.242 -6.641 12 2HG PRO 250 1HG PRO 250 4.257 -9.606 -7.665 13 1HD PRO 250 2HD PRO 250 4.558 -6.712 -8.394 14 2HD PRO 250 1HD PRO 250 5.151 -8.150 -9.254 15 H ALA 251 H ALA 251 -0.531 -8.292 -8.834 16 HA ALA 251 HA ALA 251 -1.228 -5.640 -9.332 17 1HB ALA 251 1HB ALA 251 -2.590 -7.710 -9.790 18 2HB ALA 251 2HB ALA 251 -3.480 -6.322 -9.167 19 3HB ALA 251 3HB ALA 251 -3.074 -7.661 -8.095 20 H ARG 252 H ARG 252 -1.400 -7.448 -6.268 21 HA ARG 252 HA ARG 252 -2.570 -5.479 -4.683 22 1HB ARG 252 2HB ARG 252 -2.397 -7.678 -3.805 23 2HB ARG 252 1HB ARG 252 -0.655 -7.711 -4.031 24 1HG ARG 252 2HG ARG 252 -1.242 -7.483 -1.681 25 2HG ARG 252 1HG ARG 252 -0.379 -6.058 -2.262 26 1HD ARG 252 2HD ARG 252 -2.527 -4.897 -2.538 27 2HD ARG 252 1HD ARG 252 -3.360 -6.312 -1.897 28 HE ARG 252 HE ARG 252 -2.714 -5.696 0.220 29 1HH1 ARG 252 1HH1 ARG 252 -1.001 -3.776 -2.106 30 2HH1 ARG 252 2HH1 ARG 252 -0.275 -2.765 -0.903 31 1HH2 ARG 252 1HH2 ARG 252 -1.765 -4.378 1.772 32 2HH2 ARG 252 2HH2 ARG 252 -0.702 -3.110 1.278 33 H VAL 253 H VAL 253 0.863 -6.113 -5.260 34 HA VAL 253 HA VAL 253 1.796 -3.998 -3.619 35 HB VAL 253 HB VAL 253 3.260 -5.320 -5.904 36 1HG1 VAL 253 1HG1 VAL 253 3.969 -3.157 -4.299 37 2HG1 VAL 253 2HG1 VAL 253 5.041 -4.122 -5.315 38 3HG1 VAL 253 3HG1 VAL 253 4.831 -4.534 -3.612 39 1HG2 VAL 253 1HG2 VAL 253 3.734 -6.164 -3.113 40 2HG2 VAL 253 2HG2 VAL 253 3.726 -7.113 -4.600 41 3HG2 VAL 253 3HG2 VAL 253 2.203 -6.666 -3.831 42 H GLY 254 H GLY 254 1.267 -4.297 -7.118 43 1HA GLY 254 2HA GLY 254 2.214 -1.753 -7.872 44 2HA GLY 254 1HA GLY 254 1.014 -2.692 -8.751 45 H LEU 255 H LEU 255 -1.078 -2.819 -7.028 46 HA LEU 255 HA LEU 255 -2.338 -0.315 -7.312 47 1HB LEU 255 2HB LEU 255 -2.963 -2.888 -6.024 48 2HB LEU 255 1HB LEU 255 -3.800 -1.493 -5.366 49 HG LEU 255 HG LEU 255 -3.849 -2.384 -8.245 50 1HD1 LEU 255 1HD1 LEU 255 -5.752 -2.641 -5.947 51 2HD1 LEU 255 2HD1 LEU 255 -5.182 -3.885 -7.059 52 3HD1 LEU 255 3HD1 LEU 255 -6.320 -2.658 -7.617 53 1HD2 LEU 255 1HD2 LEU 255 -3.994 0.144 -7.586 54 2HD2 LEU 255 2HD2 LEU 255 -5.626 -0.291 -7.079 55 3HD2 LEU 255 3HD2 LEU 255 -5.126 -0.539 -8.753 56 H GLY 256 H GLY 256 -0.834 -1.897 -4.521 57 1HA GLY 256 2HA GLY 256 -1.523 0.047 -2.620 58 2HA GLY 256 1HA GLY 256 -0.170 -1.064 -2.496 59 H ILE 257 H ILE 257 1.574 -0.296 -4.428 60 HA ILE 257 HA ILE 257 2.666 2.062 -3.328 61 HB ILE 257 HB ILE 257 4.359 1.984 -5.105 62 1HG1 ILE 257 2HG1 ILE 257 4.040 -0.415 -6.394 63 2HG1 ILE 257 1HG1 ILE 257 2.393 0.204 -6.374 64 1HG2 ILE 257 1HG2 ILE 257 4.125 -0.845 -4.281 65 2HG2 ILE 257 2HG2 ILE 257 4.118 0.372 -3.004 66 3HG2 ILE 257 3HG2 ILE 257 5.476 0.280 -4.127 67 1HD1 ILE 257 1HD1 ILE 257 3.402 0.892 -8.405 68 2HD1 ILE 257 2HD1 ILE 257 4.826 1.506 -7.562 69 3HD1 ILE 257 3HD1 ILE 257 3.272 2.319 -7.375 70 H THR 258 H THR 258 0.790 1.546 -6.313 71 HA THR 258 HA THR 258 1.151 4.166 -7.332 72 HB THR 258 HB THR 258 -1.014 3.725 -8.591 73 HG1 THR 258 1HG THR 258 -0.714 1.051 -7.690 74 1HG2 THR 258 1HG2 THR 258 0.073 2.451 -10.194 75 2HG2 THR 258 2HG2 THR 258 0.915 1.472 -8.992 76 3HG2 THR 258 3HG2 THR 258 1.418 3.138 -9.283 77 H THR 259 H THR 259 -1.428 2.787 -5.282 78 HA THR 259 HA THR 259 -2.952 5.176 -5.167 79 HB THR 259 HB THR 259 -3.976 4.168 -3.087 80 HG1 THR 259 1HG THR 259 -2.535 1.822 -3.786 81 1HG2 THR 259 1HG2 THR 259 -4.414 3.629 -5.717 82 2HG2 THR 259 2HG2 THR 259 -5.417 3.035 -4.393 83 3HG2 THR 259 3HG2 THR 259 -4.151 2.009 -5.069 84 H VAL 260 H VAL 260 -0.503 3.804 -2.966 85 HA VAL 260 HA VAL 260 -0.643 5.821 -1.013 86 HB VAL 260 HB VAL 260 1.672 4.061 -1.833 87 1HG1 VAL 260 1HG1 VAL 260 2.775 4.692 0.223 88 2HG1 VAL 260 2HG1 VAL 260 1.450 5.779 0.636 89 3HG1 VAL 260 3HG1 VAL 260 2.478 6.131 -0.753 90 1HG2 VAL 260 1HG2 VAL 260 1.052 3.035 0.444 91 2HG2 VAL 260 2HG2 VAL 260 0.003 2.702 -0.934 92 3HG2 VAL 260 3HG2 VAL 260 -0.468 3.910 0.262 93 H LEU 261 H LEU 261 1.465 5.546 -3.889 94 HA LEU 261 HA LEU 261 2.848 7.971 -3.515 95 1HB LEU 261 2HB LEU 261 2.254 6.358 -5.977 96 2HB LEU 261 1HB LEU 261 3.219 7.822 -6.023 97 HG LEU 261 HG LEU 261 3.868 5.298 -4.503 98 1HD1 LEU 261 1HD1 LEU 261 4.805 6.510 -7.058 99 2HD1 LEU 261 2HD1 LEU 261 4.442 4.827 -6.673 100 3HD1 LEU 261 3HD1 LEU 261 5.930 5.566 -6.080 101 1HD2 LEU 261 1HD2 LEU 261 6.115 6.769 -4.388 102 2HD2 LEU 261 2HD2 LEU 261 4.892 6.758 -3.117 103 3HD2 LEU 261 3HD2 LEU 261 4.907 8.052 -4.315 104 H THR 262 H THR 262 -0.176 7.234 -5.202 105 HA THR 262 HA THR 262 -0.574 9.818 -6.322 106 HB THR 262 HB THR 262 -2.603 7.685 -5.615 107 HG1 THR 262 1HG THR 262 -1.278 6.851 -7.161 108 1HG2 THR 262 1HG2 THR 262 -3.583 9.950 -5.896 109 2HG2 THR 262 2HG2 THR 262 -4.116 8.798 -7.121 110 3HG2 THR 262 3HG2 THR 262 -2.895 10.007 -7.519 111 H MET 263 H MET 263 -1.800 8.271 -3.377 112 HA MET 263 HA MET 263 -3.389 10.416 -2.481 113 1HB MET 263 2HB MET 263 -3.568 8.067 -1.693 114 2HB MET 263 1HB MET 263 -2.063 8.278 -0.810 115 1HG MET 263 2HG MET 263 -3.941 8.493 0.681 116 2HG MET 263 1HG MET 263 -3.107 10.039 0.533 117 1HE MET 263 1HE MET 263 -6.257 11.610 1.099 118 2HE MET 263 2HE MET 263 -5.120 10.513 1.881 119 3HE MET 263 3HE MET 263 -6.722 9.939 1.420 120 H THR 264 H THR 264 0.002 9.566 -1.693 121 HA THR 264 HA THR 264 0.269 11.686 0.203 122 HB THR 264 HB THR 264 1.746 9.710 0.276 123 HG1 THR 264 1HG THR 264 3.784 11.221 0.255 124 1HG2 THR 264 1HG2 THR 264 2.230 9.264 -2.010 125 2HG2 THR 264 2HG2 THR 264 3.753 9.736 -1.256 126 3HG2 THR 264 3HG2 THR 264 2.871 10.888 -2.260 127 H THR 265 H THR 265 0.963 13.732 0.005 128 HA THR 265 HA THR 265 0.859 14.955 -2.573 129 HB THR 265 HB THR 265 -0.011 16.195 -0.706 130 HG1 THR 265 1HG THR 265 0.842 18.092 -1.300 131 1HG2 THR 265 1HG2 THR 265 1.108 16.724 1.242 132 2HG2 THR 265 2HG2 THR 265 2.699 16.566 0.497 133 3HG2 THR 265 3HG2 THR 265 1.763 15.125 0.893 134 H GLN 266 H GLN 266 2.442 15.845 -3.797 135 HA GLN 266 HA GLN 266 4.481 16.288 -4.674 136 1HB GLN 266 2HB GLN 266 5.367 16.009 -1.810 137 2HB GLN 266 1HB GLN 266 6.452 16.466 -3.116 138 1HG GLN 266 2HG GLN 266 5.091 18.437 -3.569 139 2HG GLN 266 1HG GLN 266 3.985 17.973 -2.275 140 1HE2 GLN 266 1HE2 GLN 266 4.272 19.215 -0.570 141 2HE2 GLN 266 2HE2 GLN 266 5.790 19.766 0.041 142 H SER 267 H SER 267 4.806 13.643 -2.312 143 HA SER 267 HA SER 267 5.815 11.608 -2.397 144 1HB SER 267 2HB SER 267 5.460 10.246 -4.369 145 2HB SER 267 1HB SER 267 4.026 11.227 -4.084 146 HG SER 267 HG SER 267 5.409 12.706 -5.655 147 H SER 268 H SER 268 7.728 13.197 -2.072 148 HA SER 268 HA SER 268 9.984 13.420 -2.198 149 1HB SER 268 2HB SER 268 9.801 11.341 -4.390 150 2HB SER 268 1HB SER 268 11.315 11.988 -3.762 151 HG SER 268 HG SER 268 10.760 10.041 -2.722 152 H GLY 269 H GLY 269 8.626 15.426 -3.199 153 1HA GLY 269 2HA GLY 269 9.126 17.349 -4.396 154 2HA GLY 269 1HA GLY 269 10.380 16.463 -5.243 155 H SER 270 H SER 270 9.095 14.489 -6.537 156 HA SER 270 HA SER 270 6.718 15.442 -7.868 157 1HB SER 270 2HB SER 270 7.702 15.594 -10.112 158 2HB SER 270 1HB SER 270 8.452 16.763 -9.026 159 HG SER 270 HG SER 270 10.292 15.690 -9.107 160 H ARG 271 H ARG 271 5.774 13.854 -9.267 161 HA ARG 271 HA ARG 271 6.485 11.171 -8.509 162 1HB ARG 271 2HB ARG 271 4.113 12.055 -8.800 163 2HB ARG 271 1HB ARG 271 4.383 11.907 -10.531 164 1HG ARG 271 2HG ARG 271 3.286 9.931 -9.921 165 2HG ARG 271 1HG ARG 271 4.983 9.480 -10.079 166 1HD ARG 271 2HD ARG 271 3.459 9.986 -7.525 167 2HD ARG 271 1HD ARG 271 4.081 8.443 -8.103 168 HE ARG 271 HE ARG 271 5.499 10.420 -6.625 169 1HH1 ARG 271 1HH1 ARG 271 5.940 8.032 -9.110 170 2HH1 ARG 271 2HH1 ARG 271 7.643 7.864 -8.813 171 1HH2 ARG 271 1HH2 ARG 271 7.700 10.193 -6.251 172 2HH2 ARG 271 2HH2 ARG 271 8.618 9.059 -7.188 173 H ALA 272 H ALA 272 8.651 12.060 -9.814 174 HA ALA 272 HA ALA 272 8.500 11.049 -12.566 175 1HB ALA 272 1HB ALA 272 11.096 12.011 -11.601 176 2HB ALA 272 2HB ALA 272 9.804 13.211 -11.544 177 3HB ALA 272 3HB ALA 272 10.204 12.418 -13.068 178 H SER 273 H SER 273 8.507 8.841 -12.466 179 HA SER 273 HA SER 273 9.259 6.696 -12.175 180 1HB SER 273 2HB SER 273 11.925 8.110 -11.904 181 2HB SER 273 1HB SER 273 11.719 6.372 -12.122 182 HG SER 273 HG SER 273 12.100 7.793 -14.056 183 H LEU 274 H LEU 274 11.550 5.915 -10.573 184 HA LEU 274 HA LEU 274 12.000 5.098 -8.527 185 1HB LEU 274 2HB LEU 274 10.640 7.618 -7.587 186 2HB LEU 274 1HB LEU 274 11.594 6.551 -6.577 187 HG LEU 274 HG LEU 274 12.641 8.114 -8.941 188 1HD1 LEU 274 1HD1 LEU 274 12.494 8.660 -6.030 189 2HD1 LEU 274 2HD1 LEU 274 12.433 9.771 -7.399 190 3HD1 LEU 274 3HD1 LEU 274 13.979 9.105 -6.873 191 1HD2 LEU 274 1HD2 LEU 274 13.720 5.863 -8.325 192 2HD2 LEU 274 2HD2 LEU 274 14.293 6.700 -6.881 193 3HD2 LEU 274 3HD2 LEU 274 14.761 7.278 -8.480 194 HA PRO 275 HA PRO 275 7.193 4.078 -7.899 195 1HB PRO 275 2HB PRO 275 8.025 1.679 -9.475 196 2HB PRO 275 1HB PRO 275 6.451 2.485 -9.396 197 1HG PRO 275 2HG PRO 275 7.963 2.898 -11.494 198 2HG PRO 275 1HG PRO 275 7.170 4.279 -10.706 199 1HD PRO 275 2HD PRO 275 10.028 3.395 -10.511 200 2HD PRO 275 1HD PRO 275 9.364 5.032 -10.705 201 H LYS 276 H LYS 276 10.169 2.196 -7.955 202 HA LYS 276 HA LYS 276 9.897 1.425 -5.216 203 1HB LYS 276 2HB LYS 276 8.998 -0.423 -7.255 204 2HB LYS 276 1HB LYS 276 10.356 -1.090 -6.359 205 1HG LYS 276 2HG LYS 276 7.820 -0.020 -5.147 206 2HG LYS 276 1HG LYS 276 8.211 -1.723 -5.380 207 1HD LYS 276 2HD LYS 276 9.961 0.116 -3.770 208 2HD LYS 276 1HD LYS 276 8.592 -0.733 -3.058 209 1HE LYS 276 2HE LYS 276 10.413 -2.116 -2.605 210 2HE LYS 276 1HE LYS 276 9.651 -2.858 -4.008 211 1HZ LYS 276 1HZ LYS 276 11.665 -0.936 -4.745 212 2HZ LYS 276 2HZ LYS 276 11.482 -2.560 -5.216 213 3HZ LYS 276 3HZ LYS 276 12.279 -2.189 -3.774 Start of MODEL 15 1 1H ALA 249 1HT ALA 249 1.150 -5.122 -13.866 2 2H ALA 249 2HT ALA 249 2.272 -3.974 -14.408 3 3H ALA 249 3HT ALA 249 0.703 -3.494 -13.993 4 HA ALA 249 HA ALA 249 2.958 -3.607 -12.364 5 1HB ALA 249 1HB ALA 249 0.632 -3.157 -10.816 6 2HB ALA 249 2HB ALA 249 0.364 -2.446 -12.408 7 3HB ALA 249 3HB ALA 249 1.771 -1.973 -11.458 8 HA PRO 250 HA PRO 250 2.694 -7.381 -10.093 9 1HB PRO 250 2HB PRO 250 3.608 -6.662 -7.668 10 2HB PRO 250 1HB PRO 250 4.643 -6.667 -9.100 11 1HG PRO 250 2HG PRO 250 3.212 -4.370 -7.816 12 2HG PRO 250 1HG PRO 250 4.906 -4.477 -8.339 13 1HD PRO 250 2HD PRO 250 3.017 -3.306 -9.851 14 2HD PRO 250 1HD PRO 250 4.367 -4.213 -10.564 15 H ALA 251 H ALA 251 0.131 -6.293 -10.289 16 HA ALA 251 HA ALA 251 -1.947 -6.242 -9.353 17 1HB ALA 251 1HB ALA 251 -2.419 -8.166 -7.837 18 2HB ALA 251 2HB ALA 251 -0.692 -8.523 -7.849 19 3HB ALA 251 3HB ALA 251 -1.617 -8.594 -9.349 20 H ARG 252 H ARG 252 -1.522 -7.484 -6.309 21 HA ARG 252 HA ARG 252 -2.589 -5.412 -4.868 22 1HB ARG 252 2HB ARG 252 -2.494 -7.616 -3.953 23 2HB ARG 252 1HB ARG 252 -0.741 -7.639 -4.024 24 1HG ARG 252 2HG ARG 252 -1.561 -7.389 -1.740 25 2HG ARG 252 1HG ARG 252 -0.622 -5.985 -2.251 26 1HD ARG 252 2HD ARG 252 -2.528 -4.651 -2.476 27 2HD ARG 252 1HD ARG 252 -3.611 -6.041 -2.480 28 HE ARG 252 HE ARG 252 -2.674 -4.613 -0.203 29 1HH1 ARG 252 1HH1 ARG 252 -3.622 -7.771 -1.264 30 2HH1 ARG 252 2HH1 ARG 252 -4.031 -8.315 0.323 31 1HH2 ARG 252 1HH2 ARG 252 -3.220 -5.337 1.872 32 2HH2 ARG 252 2HH2 ARG 252 -3.808 -6.948 2.086 33 H VAL 253 H VAL 253 0.871 -6.142 -5.206 34 HA VAL 253 HA VAL 253 1.776 -4.023 -3.584 35 HB VAL 253 HB VAL 253 3.305 -5.292 -5.855 36 1HG1 VAL 253 1HG1 VAL 253 5.268 -4.713 -4.546 37 2HG1 VAL 253 2HG1 VAL 253 4.246 -4.019 -3.287 38 3HG1 VAL 253 3HG1 VAL 253 4.309 -3.271 -4.883 39 1HG2 VAL 253 1HG2 VAL 253 4.186 -6.734 -3.887 40 2HG2 VAL 253 2HG2 VAL 253 2.642 -7.148 -4.631 41 3HG2 VAL 253 3HG2 VAL 253 2.675 -6.278 -3.098 42 H GLY 254 H GLY 254 1.303 -4.274 -7.085 43 1HA GLY 254 2HA GLY 254 2.302 -1.730 -7.787 44 2HA GLY 254 1HA GLY 254 1.145 -2.665 -8.726 45 H LEU 255 H LEU 255 -1.026 -2.794 -7.078 46 HA LEU 255 HA LEU 255 -2.257 -0.273 -7.421 47 1HB LEU 255 2HB LEU 255 -3.336 -2.581 -7.211 48 2HB LEU 255 1HB LEU 255 -3.204 -2.343 -5.475 49 HG LEU 255 HG LEU 255 -4.508 -0.247 -5.709 50 1HD1 LEU 255 1HD1 LEU 255 -5.806 -0.652 -8.148 51 2HD1 LEU 255 2HD1 LEU 255 -4.082 -0.789 -8.495 52 3HD1 LEU 255 3HD1 LEU 255 -4.712 0.663 -7.716 53 1HD2 LEU 255 1HD2 LEU 255 -6.028 -1.734 -5.014 54 2HD2 LEU 255 2HD2 LEU 255 -5.480 -2.963 -6.152 55 3HD2 LEU 255 3HD2 LEU 255 -6.601 -1.710 -6.681 56 H GLY 256 H GLY 256 -0.855 -1.863 -4.572 57 1HA GLY 256 2HA GLY 256 -1.579 0.066 -2.659 58 2HA GLY 256 1HA GLY 256 -0.219 -1.037 -2.527 59 H ILE 257 H ILE 257 1.559 -0.268 -4.391 60 HA ILE 257 HA ILE 257 2.611 2.116 -3.296 61 HB ILE 257 HB ILE 257 4.336 2.033 -5.044 62 1HG1 ILE 257 2HG1 ILE 257 4.116 -0.335 -6.350 63 2HG1 ILE 257 1HG1 ILE 257 2.427 0.154 -6.300 64 1HG2 ILE 257 1HG2 ILE 257 3.643 -0.298 -3.359 65 2HG2 ILE 257 2HG2 ILE 257 5.040 0.777 -3.297 66 3HG2 ILE 257 3HG2 ILE 257 4.958 -0.492 -4.520 67 1HD1 ILE 257 1HD1 ILE 257 2.749 1.900 -7.715 68 2HD1 ILE 257 2HD1 ILE 257 4.030 0.829 -8.283 69 3HD1 ILE 257 3HD1 ILE 257 4.414 2.162 -7.194 70 H THR 258 H THR 258 0.692 1.519 -6.200 71 HA THR 258 HA THR 258 1.030 4.078 -7.379 72 HB THR 258 HB THR 258 -1.329 2.194 -7.631 73 HG1 THR 258 1HG THR 258 0.464 1.146 -8.403 74 1HG2 THR 258 1HG2 THR 258 -0.653 4.774 -8.913 75 2HG2 THR 258 2HG2 THR 258 -2.226 4.029 -8.622 76 3HG2 THR 258 3HG2 THR 258 -1.237 3.497 -9.981 77 H THR 259 H THR 259 -1.483 2.785 -5.199 78 HA THR 259 HA THR 259 -2.983 5.195 -5.082 79 HB THR 259 HB THR 259 -3.976 4.210 -2.979 80 HG1 THR 259 1HG THR 259 -2.619 1.820 -3.648 81 1HG2 THR 259 1HG2 THR 259 -4.421 3.602 -5.614 82 2HG2 THR 259 2HG2 THR 259 -5.446 3.104 -4.267 83 3HG2 THR 259 3HG2 THR 259 -4.215 2.006 -4.890 84 H VAL 260 H VAL 260 -0.509 3.795 -2.924 85 HA VAL 260 HA VAL 260 -0.539 5.833 -0.988 86 HB VAL 260 HB VAL 260 1.725 4.032 -1.868 87 1HG1 VAL 260 1HG1 VAL 260 2.988 4.697 0.006 88 2HG1 VAL 260 2HG1 VAL 260 1.636 5.593 0.700 89 3HG1 VAL 260 3HG1 VAL 260 2.445 6.198 -0.746 90 1HG2 VAL 260 1HG2 VAL 260 1.161 3.001 0.413 91 2HG2 VAL 260 2HG2 VAL 260 0.053 2.700 -0.924 92 3HG2 VAL 260 3HG2 VAL 260 -0.348 3.907 0.298 93 H LEU 261 H LEU 261 1.424 5.503 -3.961 94 HA LEU 261 HA LEU 261 2.902 7.892 -3.665 95 1HB LEU 261 2HB LEU 261 3.399 6.054 -5.282 96 2HB LEU 261 1HB LEU 261 2.047 6.608 -6.254 97 HG LEU 261 HG LEU 261 3.147 8.742 -6.638 98 1HD1 LEU 261 1HD1 LEU 261 5.469 7.653 -5.055 99 2HD1 LEU 261 2HD1 LEU 261 4.305 8.824 -4.435 100 3HD1 LEU 261 3HD1 LEU 261 5.335 9.245 -5.803 101 1HD2 LEU 261 1HD2 LEU 261 3.819 6.371 -7.763 102 2HD2 LEU 261 2HD2 LEU 261 5.395 6.950 -7.222 103 3HD2 LEU 261 3HD2 LEU 261 4.417 7.939 -8.305 104 H THR 262 H THR 262 -0.179 7.208 -5.290 105 HA THR 262 HA THR 262 -0.657 9.771 -6.350 106 HB THR 262 HB THR 262 -2.655 7.694 -5.420 107 HG1 THR 262 1HG THR 262 -1.439 6.828 -7.062 108 1HG2 THR 262 1HG2 THR 262 -3.102 9.938 -7.381 109 2HG2 THR 262 2HG2 THR 262 -3.583 10.008 -5.686 110 3HG2 THR 262 3HG2 THR 262 -4.295 8.800 -6.756 111 H MET 263 H MET 263 -1.696 8.322 -3.270 112 HA MET 263 HA MET 263 -3.092 10.586 -2.324 113 1HB MET 263 2HB MET 263 -1.868 8.252 -0.862 114 2HB MET 263 1HB MET 263 -2.840 9.484 -0.068 115 1HG MET 263 2HG MET 263 -3.747 7.646 -2.271 116 2HG MET 263 1HG MET 263 -4.167 7.523 -0.564 117 1HE MET 263 1HE MET 263 -6.303 9.607 0.522 118 2HE MET 263 2HE MET 263 -5.718 11.124 -0.162 119 3HE MET 263 3HE MET 263 -4.575 9.964 0.512 120 H THR 264 H THR 264 0.299 9.556 -1.789 121 HA THR 264 HA THR 264 0.830 11.627 0.084 122 HB THR 264 HB THR 264 2.266 9.647 -0.001 123 HG1 THR 264 1HG THR 264 3.249 12.259 -0.190 124 1HG2 THR 264 1HG2 THR 264 4.157 9.887 -1.826 125 2HG2 THR 264 2HG2 THR 264 2.864 10.668 -2.737 126 3HG2 THR 264 3HG2 THR 264 2.668 9.009 -2.170 127 H THR 265 H THR 265 1.042 11.578 -3.450 128 HA THR 265 HA THR 265 2.443 14.127 -3.477 129 HB THR 265 HB THR 265 2.950 12.496 -5.242 130 HG1 THR 265 1HG THR 265 1.714 14.915 -6.113 131 1HG2 THR 265 1HG2 THR 265 0.765 12.851 -7.004 132 2HG2 THR 265 2HG2 THR 265 0.105 12.330 -5.454 133 3HG2 THR 265 3HG2 THR 265 1.332 11.355 -6.263 134 H GLN 266 H GLN 266 -0.138 14.093 -2.178 135 HA GLN 266 HA GLN 266 -2.025 15.413 -3.911 136 1HB GLN 266 2HB GLN 266 -2.633 13.936 -1.960 137 2HB GLN 266 1HB GLN 266 -2.090 15.225 -0.897 138 1HG GLN 266 2HG GLN 266 -3.786 16.714 -1.849 139 2HG GLN 266 1HG GLN 266 -4.337 15.406 -2.895 140 1HE2 GLN 266 1HE2 GLN 266 -3.455 13.885 -0.179 141 2HE2 GLN 266 2HE2 GLN 266 -4.949 13.906 0.685 142 H SER 267 H SER 267 0.055 16.915 -4.307 143 HA SER 267 HA SER 267 0.433 19.051 -2.432 144 1HB SER 267 2HB SER 267 1.226 18.871 -5.348 145 2HB SER 267 1HB SER 267 1.801 20.080 -4.203 146 HG SER 267 HG SER 267 3.342 18.580 -4.097 147 H SER 268 H SER 268 -2.168 19.137 -2.560 148 HA SER 268 HA SER 268 -2.736 21.699 -3.755 149 1HB SER 268 2HB SER 268 -4.629 20.974 -5.134 150 2HB SER 268 1HB SER 268 -3.137 20.215 -5.688 151 HG SER 268 HG SER 268 -4.267 18.654 -3.838 152 H GLY 269 H GLY 269 -4.413 22.744 -2.759 153 1HA GLY 269 2HA GLY 269 -5.312 21.704 -0.253 154 2HA GLY 269 1HA GLY 269 -5.786 23.231 -0.975 155 H SER 270 H SER 270 -6.342 19.734 -1.254 156 HA SER 270 HA SER 270 -8.739 19.912 -2.740 157 1HB SER 270 2HB SER 270 -9.071 17.550 -2.059 158 2HB SER 270 1HB SER 270 -7.433 17.853 -2.643 159 HG SER 270 HG SER 270 -7.018 16.826 -0.798 160 H ARG 271 H ARG 271 -8.270 19.252 0.743 161 HA ARG 271 HA ARG 271 -11.079 19.453 1.288 162 1HB ARG 271 2HB ARG 271 -9.424 18.011 2.552 163 2HB ARG 271 1HB ARG 271 -8.846 19.484 3.319 164 1HG ARG 271 2HG ARG 271 -11.087 19.885 4.223 165 2HG ARG 271 1HG ARG 271 -11.651 18.394 3.468 166 1HD ARG 271 2HD ARG 271 -11.191 17.968 5.787 167 2HD ARG 271 1HD ARG 271 -9.986 17.141 4.803 168 HE ARG 271 HE ARG 271 -8.921 19.608 5.484 169 1HH1 ARG 271 1HH1 ARG 271 -9.965 16.731 7.089 170 2HH1 ARG 271 2HH1 ARG 271 -8.888 16.940 8.446 171 1HH2 ARG 271 1HH2 ARG 271 -7.500 19.858 7.225 172 2HH2 ARG 271 2HH2 ARG 271 -7.493 18.673 8.487 173 H ALA 272 H ALA 272 -11.216 21.633 0.249 174 HA ALA 272 HA ALA 272 -10.124 23.962 1.344 175 1HB ALA 272 1HB ALA 272 -12.721 23.581 -0.133 176 2HB ALA 272 2HB ALA 272 -11.146 23.958 -0.834 177 3HB ALA 272 3HB ALA 272 -11.962 25.140 0.191 178 H SER 273 H SER 273 -12.897 22.088 2.406 179 HA SER 273 HA SER 273 -13.077 23.793 4.778 180 1HB SER 273 2HB SER 273 -15.491 23.135 3.079 181 2HB SER 273 1HB SER 273 -15.531 23.913 4.662 182 HG SER 273 HG SER 273 -13.817 25.251 3.137 183 H LEU 274 H LEU 274 -15.081 22.792 6.117 184 HA LEU 274 HA LEU 274 -15.638 21.143 7.561 185 1HB LEU 274 2HB LEU 274 -15.036 19.357 5.201 186 2HB LEU 274 1HB LEU 274 -15.821 18.830 6.677 187 HG LEU 274 HG LEU 274 -16.929 20.872 4.746 188 1HD1 LEU 274 1HD1 LEU 274 -18.518 19.172 4.122 189 2HD1 LEU 274 2HD1 LEU 274 -17.816 18.041 5.278 190 3HD1 LEU 274 3HD1 LEU 274 -16.884 18.559 3.872 191 1HD2 LEU 274 1HD2 LEU 274 -18.915 19.833 6.437 192 2HD2 LEU 274 2HD2 LEU 274 -18.280 21.478 6.400 193 3HD2 LEU 274 3HD2 LEU 274 -17.562 20.280 7.477 194 HA PRO 275 HA PRO 275 -10.791 20.228 7.779 195 1HB PRO 275 2HB PRO 275 -11.175 22.208 9.989 196 2HB PRO 275 1HB PRO 275 -9.757 21.916 8.971 197 1HG PRO 275 2HG PRO 275 -11.276 23.982 8.438 198 2HG PRO 275 1HG PRO 275 -10.734 22.934 7.108 199 1HD PRO 275 2HD PRO 275 -13.410 23.050 8.446 200 2HD PRO 275 1HD PRO 275 -13.025 22.887 6.716 201 H LYS 276 H LYS 276 -10.200 18.536 8.954 202 HA LYS 276 HA LYS 276 -11.227 18.108 11.656 203 1HB LYS 276 2HB LYS 276 -11.521 16.077 9.429 204 2HB LYS 276 1HB LYS 276 -11.785 15.733 11.131 205 1HG LYS 276 2HG LYS 276 -13.663 17.205 11.210 206 2HG LYS 276 1HG LYS 276 -13.333 17.792 9.579 207 1HD LYS 276 2HD LYS 276 -13.739 15.510 8.719 208 2HD LYS 276 1HD LYS 276 -14.159 14.997 10.354 209 1HE LYS 276 2HE LYS 276 -16.144 15.498 8.986 210 2HE LYS 276 1HE LYS 276 -16.019 16.543 10.402 211 1HZ LYS 276 1HZ LYS 276 -16.127 18.276 9.054 212 2HZ LYS 276 2HZ LYS 276 -16.165 17.277 7.692 213 3HZ LYS 276 3HZ LYS 276 -14.678 17.809 8.307 Start of MODEL 16 1 1H ALA 249 1HT ALA 249 5.399 -8.805 0.384 2 2H ALA 249 2HT ALA 249 5.549 -9.105 -1.274 3 3H ALA 249 3HT ALA 249 4.322 -9.861 -0.386 4 HA ALA 249 HA ALA 249 4.201 -7.038 -0.104 5 1HB ALA 249 1HB ALA 249 4.354 -8.172 -2.858 6 2HB ALA 249 2HB ALA 249 4.985 -6.651 -2.226 7 3HB ALA 249 3HB ALA 249 3.258 -6.832 -2.529 8 HA PRO 250 HA PRO 250 0.051 -8.271 0.761 9 1HB PRO 250 2HB PRO 250 -0.823 -5.595 -0.081 10 2HB PRO 250 1HB PRO 250 -0.832 -6.321 1.528 11 1HG PRO 250 2HG PRO 250 0.850 -4.347 0.914 12 2HG PRO 250 1HG PRO 250 1.352 -5.689 1.965 13 1HD PRO 250 2HD PRO 250 1.844 -5.309 -0.972 14 2HD PRO 250 1HD PRO 250 2.999 -5.746 0.308 15 H ALA 251 H ALA 251 0.691 -9.216 -1.744 16 HA ALA 251 HA ALA 251 -0.208 -9.998 -3.668 17 1HB ALA 251 1HB ALA 251 -2.123 -10.514 -2.264 18 2HB ALA 251 2HB ALA 251 -2.634 -10.061 -3.891 19 3HB ALA 251 3HB ALA 251 -2.790 -8.910 -2.563 20 H ARG 252 H ARG 252 -2.071 -6.970 -3.197 21 HA ARG 252 HA ARG 252 -1.547 -6.274 -5.973 22 1HB ARG 252 2HB ARG 252 -3.374 -5.156 -3.875 23 2HB ARG 252 1HB ARG 252 -3.045 -4.268 -5.359 24 1HG ARG 252 2HG ARG 252 -4.300 -6.985 -5.088 25 2HG ARG 252 1HG ARG 252 -5.043 -5.502 -5.696 26 1HD ARG 252 2HD ARG 252 -3.507 -5.501 -7.597 27 2HD ARG 252 1HD ARG 252 -2.727 -6.958 -6.979 28 HE ARG 252 HE ARG 252 -5.472 -7.456 -7.292 29 1HH1 ARG 252 1HH1 ARG 252 -2.649 -6.909 -9.213 30 2HH1 ARG 252 2HH1 ARG 252 -3.239 -7.825 -10.553 31 1HH2 ARG 252 1HH2 ARG 252 -6.231 -8.659 -9.035 32 2HH2 ARG 252 2HH2 ARG 252 -5.253 -8.818 -10.448 33 H VAL 253 H VAL 253 0.784 -6.201 -5.115 34 HA VAL 253 HA VAL 253 1.843 -4.122 -3.636 35 HB VAL 253 HB VAL 253 3.242 -5.913 -4.281 36 1HG1 VAL 253 1HG1 VAL 253 2.878 -6.934 -6.213 37 2HG1 VAL 253 2HG1 VAL 253 3.872 -5.681 -6.957 38 3HG1 VAL 253 3HG1 VAL 253 2.119 -5.500 -6.903 39 1HG2 VAL 253 1HG2 VAL 253 4.276 -3.587 -5.868 40 2HG2 VAL 253 2HG2 VAL 253 5.209 -4.818 -5.015 41 3HG2 VAL 253 3HG2 VAL 253 4.274 -3.632 -4.105 42 H GLY 254 H GLY 254 1.527 -4.228 -7.162 43 1HA GLY 254 2HA GLY 254 2.381 -1.634 -7.741 44 2HA GLY 254 1HA GLY 254 1.289 -2.570 -8.749 45 H LEU 255 H LEU 255 -0.935 -2.769 -7.140 46 HA LEU 255 HA LEU 255 -2.209 -0.290 -7.537 47 1HB LEU 255 2HB LEU 255 -2.912 -2.888 -6.371 48 2HB LEU 255 1HB LEU 255 -3.793 -1.528 -5.699 49 HG LEU 255 HG LEU 255 -3.682 -2.316 -8.606 50 1HD1 LEU 255 1HD1 LEU 255 -5.063 -3.716 -7.040 51 2HD1 LEU 255 2HD1 LEU 255 -5.956 -2.947 -8.352 52 3HD1 LEU 255 3HD1 LEU 255 -6.028 -2.274 -6.723 53 1HD2 LEU 255 1HD2 LEU 255 -3.819 0.025 -8.605 54 2HD2 LEU 255 2HD2 LEU 255 -4.874 0.051 -7.194 55 3HD2 LEU 255 3HD2 LEU 255 -5.491 -0.518 -8.744 56 H GLY 256 H GLY 256 -0.978 -1.869 -4.611 57 1HA GLY 256 2HA GLY 256 -1.815 0.098 -2.786 58 2HA GLY 256 1HA GLY 256 -0.512 -1.051 -2.527 59 H ILE 257 H ILE 257 1.402 -0.343 -4.333 60 HA ILE 257 HA ILE 257 2.507 1.970 -3.140 61 HB ILE 257 HB ILE 257 4.296 1.861 -4.813 62 1HG1 ILE 257 2HG1 ILE 257 4.015 -0.464 -6.202 63 2HG1 ILE 257 1HG1 ILE 257 2.360 0.136 -6.222 64 1HG2 ILE 257 1HG2 ILE 257 3.471 -0.329 -3.085 65 2HG2 ILE 257 2HG2 ILE 257 5.035 0.474 -3.240 66 3HG2 ILE 257 3HG2 ILE 257 4.594 -0.822 -4.353 67 1HD1 ILE 257 1HD1 ILE 257 2.988 1.282 -8.021 68 2HD1 ILE 257 2HD1 ILE 257 4.703 1.056 -7.677 69 3HD1 ILE 257 3HD1 ILE 257 3.811 2.360 -6.894 70 H THR 258 H THR 258 0.722 1.511 -6.160 71 HA THR 258 HA THR 258 1.160 4.118 -7.202 72 HB THR 258 HB THR 258 -1.217 2.295 -7.661 73 HG1 THR 258 1HG THR 258 0.560 1.228 -8.410 74 1HG2 THR 258 1HG2 THR 258 -0.207 4.655 -9.256 75 2HG2 THR 258 2HG2 THR 258 -1.704 4.590 -8.324 76 3HG2 THR 258 3HG2 THR 258 -1.507 3.570 -9.749 77 H THR 259 H THR 259 -1.325 2.735 -5.089 78 HA THR 259 HA THR 259 -2.964 5.035 -4.904 79 HB THR 259 HB THR 259 -2.580 2.876 -2.810 80 HG1 THR 259 1HG THR 259 -3.257 1.907 -4.719 81 1HG2 THR 259 1HG2 THR 259 -4.091 3.977 -1.598 82 2HG2 THR 259 2HG2 THR 259 -5.234 3.893 -2.938 83 3HG2 THR 259 3HG2 THR 259 -4.129 5.262 -2.805 84 H VAL 260 H VAL 260 -0.280 3.844 -2.885 85 HA VAL 260 HA VAL 260 -0.311 5.911 -0.975 86 HB VAL 260 HB VAL 260 2.029 4.264 -1.964 87 1HG1 VAL 260 1HG1 VAL 260 2.168 6.571 -0.467 88 2HG1 VAL 260 2HG1 VAL 260 3.390 5.300 -0.527 89 3HG1 VAL 260 3HG1 VAL 260 2.176 5.297 0.754 90 1HG2 VAL 260 1HG2 VAL 260 1.121 2.596 -0.811 91 2HG2 VAL 260 2HG2 VAL 260 -0.229 3.628 -0.338 92 3HG2 VAL 260 3HG2 VAL 260 1.227 3.570 0.655 93 H LEU 261 H LEU 261 1.525 5.584 -4.021 94 HA LEU 261 HA LEU 261 2.891 8.037 -3.891 95 1HB LEU 261 2HB LEU 261 2.390 5.977 -5.859 96 2HB LEU 261 1HB LEU 261 2.337 7.567 -6.595 97 HG LEU 261 HG LEU 261 4.559 6.577 -6.758 98 1HD1 LEU 261 1HD1 LEU 261 5.784 8.474 -6.158 99 2HD1 LEU 261 2HD1 LEU 261 4.738 8.825 -4.782 100 3HD1 LEU 261 3HD1 LEU 261 4.148 9.074 -6.425 101 1HD2 LEU 261 1HD2 LEU 261 5.053 5.207 -5.032 102 2HD2 LEU 261 2HD2 LEU 261 4.158 6.178 -3.862 103 3HD2 LEU 261 3HD2 LEU 261 5.774 6.671 -4.367 104 H THR 262 H THR 262 -0.240 7.185 -5.297 105 HA THR 262 HA THR 262 -0.909 9.659 -6.425 106 HB THR 262 HB THR 262 -2.758 7.588 -5.222 107 HG1 THR 262 1HG THR 262 -1.583 6.678 -6.894 108 1HG2 THR 262 1HG2 THR 262 -3.520 10.080 -5.846 109 2HG2 THR 262 2HG2 THR 262 -4.555 8.671 -6.084 110 3HG2 THR 262 3HG2 THR 262 -3.641 9.333 -7.441 111 H MET 263 H MET 263 -1.698 8.389 -3.175 112 HA MET 263 HA MET 263 -2.984 10.811 -2.379 113 1HB MET 263 2HB MET 263 -3.074 9.841 -0.138 114 2HB MET 263 1HB MET 263 -3.601 8.692 -1.357 115 1HG MET 263 2HG MET 263 -1.506 7.521 -1.230 116 2HG MET 263 1HG MET 263 -0.857 8.732 -0.125 117 1HE MET 263 1HE MET 263 -4.584 7.228 0.054 118 2HE MET 263 2HE MET 263 -4.206 5.735 0.914 119 3HE MET 263 3HE MET 263 -3.544 6.017 -0.697 120 H THR 264 H THR 264 0.346 9.617 -2.008 121 HA THR 264 HA THR 264 1.009 11.714 -0.142 122 HB THR 264 HB THR 264 2.192 9.535 -0.066 123 HG1 THR 264 1HG THR 264 3.461 12.035 -0.235 124 1HG2 THR 264 1HG2 THR 264 3.482 10.550 -2.603 125 2HG2 THR 264 2HG2 THR 264 2.510 9.089 -2.425 126 3HG2 THR 264 3HG2 THR 264 4.085 9.200 -1.640 127 H THR 265 H THR 265 0.907 11.639 -3.584 128 HA THR 265 HA THR 265 3.013 13.549 -3.979 129 HB THR 265 HB THR 265 2.449 12.055 -5.808 130 HG1 THR 265 1HG THR 265 1.648 14.533 -6.836 131 1HG2 THR 265 1HG2 THR 265 0.338 12.619 -7.149 132 2HG2 THR 265 2HG2 THR 265 -0.239 13.388 -5.671 133 3HG2 THR 265 3HG2 THR 265 0.141 11.667 -5.678 134 H GLN 266 H GLN 266 1.631 14.598 -2.027 135 HA GLN 266 HA GLN 266 -0.382 16.478 -2.832 136 1HB GLN 266 2HB GLN 266 1.281 16.327 -0.312 137 2HB GLN 266 1HB GLN 266 -0.146 17.328 -0.534 138 1HG GLN 266 2HG GLN 266 -1.535 15.374 -0.752 139 2HG GLN 266 1HG GLN 266 -0.119 14.324 -0.670 140 1HE2 GLN 266 1HE2 GLN 266 -2.621 15.506 1.067 141 2HE2 GLN 266 2HE2 GLN 266 -1.970 15.351 2.657 142 H SER 267 H SER 267 1.094 17.252 -4.647 143 HA SER 267 HA SER 267 2.283 18.935 -5.615 144 1HB SER 267 2HB SER 267 1.962 20.306 -2.931 145 2HB SER 267 1HB SER 267 2.519 21.083 -4.413 146 HG SER 267 HG SER 267 0.108 21.035 -3.688 147 H SER 268 H SER 268 3.701 16.794 -4.635 148 HA SER 268 HA SER 268 5.883 17.383 -2.984 149 1HB SER 268 2HB SER 268 5.717 15.356 -5.228 150 2HB SER 268 1HB SER 268 6.916 15.361 -3.935 151 HG SER 268 HG SER 268 5.140 15.135 -2.445 152 H GLY 269 H GLY 269 5.515 17.662 -6.490 153 1HA GLY 269 2HA GLY 269 8.235 18.410 -6.988 154 2HA GLY 269 1HA GLY 269 6.897 18.536 -8.118 155 H SER 270 H SER 270 7.852 20.058 -5.044 156 HA SER 270 HA SER 270 7.766 22.690 -6.309 157 1HB SER 270 2HB SER 270 6.303 23.615 -4.532 158 2HB SER 270 1HB SER 270 5.474 22.400 -5.506 159 HG SER 270 HG SER 270 5.364 21.098 -3.827 160 H ARG 271 H ARG 271 8.169 20.947 -3.229 161 HA ARG 271 HA ARG 271 10.796 22.057 -2.861 162 1HB ARG 271 2HB ARG 271 9.044 23.787 -1.986 163 2HB ARG 271 1HB ARG 271 8.870 22.672 -0.637 164 1HG ARG 271 2HG ARG 271 11.247 22.877 -0.142 165 2HG ARG 271 1HG ARG 271 11.445 23.969 -1.512 166 1HD ARG 271 2HD ARG 271 11.311 25.310 0.446 167 2HD ARG 271 1HD ARG 271 9.789 25.494 -0.424 168 HE ARG 271 HE ARG 271 9.414 23.462 1.415 169 1HH1 ARG 271 1HH1 ARG 271 10.157 26.838 1.458 170 2HH1 ARG 271 2HH1 ARG 271 9.421 27.109 2.997 171 1HH2 ARG 271 1HH2 ARG 271 8.452 23.814 3.424 172 2HH2 ARG 271 2HH2 ARG 271 8.460 25.402 4.104 173 H ALA 272 H ALA 272 10.071 19.478 -3.217 174 HA ALA 272 HA ALA 272 10.339 17.373 -2.425 175 1HB ALA 272 1HB ALA 272 11.950 19.016 -0.592 176 2HB ALA 272 2HB ALA 272 12.394 17.598 -1.543 177 3HB ALA 272 3HB ALA 272 11.538 17.401 -0.013 178 H SER 273 H SER 273 7.810 18.297 -2.054 179 HA SER 273 HA SER 273 6.936 17.902 0.675 180 1HB SER 273 2HB SER 273 5.189 17.961 -1.784 181 2HB SER 273 1HB SER 273 4.717 18.274 -0.114 182 HG SER 273 HG SER 273 5.299 20.091 -1.777 183 H LEU 274 H LEU 274 8.148 15.777 0.622 184 HA LEU 274 HA LEU 274 6.170 13.684 0.015 185 1HB LEU 274 2HB LEU 274 8.211 13.725 -1.512 186 2HB LEU 274 1HB LEU 274 9.150 13.256 -0.108 187 HG LEU 274 HG LEU 274 7.726 11.208 0.087 188 1HD1 LEU 274 1HD1 LEU 274 5.814 12.207 -1.217 189 2HD1 LEU 274 2HD1 LEU 274 6.263 10.559 -1.655 190 3HD1 LEU 274 3HD1 LEU 274 6.763 11.910 -2.674 191 1HD2 LEU 274 1HD2 LEU 274 8.661 10.563 -2.460 192 2HD2 LEU 274 2HD2 LEU 274 9.508 10.357 -0.928 193 3HD2 LEU 274 3HD2 LEU 274 9.741 11.827 -1.873 194 HA PRO 275 HA PRO 275 7.867 13.982 4.604 195 1HB PRO 275 2HB PRO 275 4.921 14.325 4.984 196 2HB PRO 275 1HB PRO 275 6.264 15.006 5.914 197 1HG PRO 275 2HG PRO 275 5.017 16.551 4.204 198 2HG PRO 275 1HG PRO 275 6.794 16.552 4.241 199 1HD PRO 275 2HD PRO 275 4.952 15.199 2.300 200 2HD PRO 275 1HD PRO 275 6.436 16.123 1.976 201 H LYS 276 H LYS 276 7.929 12.182 5.875 202 HA LYS 276 HA LYS 276 5.873 10.118 5.588 203 1HB LYS 276 2HB LYS 276 8.828 9.686 5.129 204 2HB LYS 276 1HB LYS 276 7.717 8.373 5.489 205 1HG LYS 276 2HG LYS 276 7.495 10.229 3.130 206 2HG LYS 276 1HG LYS 276 8.175 8.600 3.091 207 1HD LYS 276 2HD LYS 276 6.092 7.607 3.560 208 2HD LYS 276 1HD LYS 276 5.385 9.142 4.068 209 1HE LYS 276 2HE LYS 276 6.250 8.438 1.266 210 2HE LYS 276 1HE LYS 276 4.588 8.466 1.854 211 1HZ LYS 276 1HZ LYS 276 5.296 10.905 2.523 212 2HZ LYS 276 2HZ LYS 276 4.705 10.541 0.968 213 3HZ LYS 276 3HZ LYS 276 6.376 10.690 1.233 Start of MODEL 17 1 1H ALA 249 1HT ALA 249 2.084 -11.683 -12.650 2 2H ALA 249 2HT ALA 249 0.627 -11.201 -11.935 3 3H ALA 249 3HT ALA 249 1.804 -11.987 -11.010 4 HA ALA 249 HA ALA 249 3.329 -10.118 -11.398 5 1HB ALA 249 1HB ALA 249 2.787 -8.887 -13.190 6 2HB ALA 249 2HB ALA 249 1.776 -8.000 -12.050 7 3HB ALA 249 3HB ALA 249 1.068 -9.262 -13.059 8 HA PRO 250 HA PRO 250 2.011 -8.916 -7.359 9 1HB PRO 250 2HB PRO 250 3.543 -6.423 -7.710 10 2HB PRO 250 1HB PRO 250 3.826 -7.763 -6.596 11 1HG PRO 250 2HG PRO 250 5.446 -7.336 -8.658 12 2HG PRO 250 1HG PRO 250 5.006 -8.987 -8.172 13 1HD PRO 250 2HD PRO 250 3.840 -7.293 -10.359 14 2HD PRO 250 1HD PRO 250 4.400 -8.980 -10.433 15 H ALA 251 H ALA 251 -0.187 -8.454 -8.649 16 HA ALA 251 HA ALA 251 -1.005 -5.874 -9.298 17 1HB ALA 251 1HB ALA 251 -2.587 -8.198 -8.224 18 2HB ALA 251 2HB ALA 251 -2.384 -7.706 -9.907 19 3HB ALA 251 3HB ALA 251 -3.323 -6.703 -8.803 20 H ARG 252 H ARG 252 -1.211 -7.511 -6.140 21 HA ARG 252 HA ARG 252 -2.514 -5.470 -4.720 22 1HB ARG 252 2HB ARG 252 -2.401 -7.606 -3.708 23 2HB ARG 252 1HB ARG 252 -0.657 -7.690 -3.887 24 1HG ARG 252 2HG ARG 252 -1.348 -7.364 -1.559 25 2HG ARG 252 1HG ARG 252 -0.360 -6.030 -2.153 26 1HD ARG 252 2HD ARG 252 -2.207 -4.589 -2.307 27 2HD ARG 252 1HD ARG 252 -3.360 -5.916 -2.190 28 HE ARG 252 HE ARG 252 -2.198 -4.479 -0.032 29 1HH1 ARG 252 1HH1 ARG 252 -3.343 -7.610 -0.944 30 2HH1 ARG 252 2HH1 ARG 252 -3.658 -8.109 0.680 31 1HH2 ARG 252 1HH2 ARG 252 -2.608 -5.129 2.093 32 2HH2 ARG 252 2HH2 ARG 252 -3.244 -6.707 2.397 33 H VAL 253 H VAL 253 0.936 -6.105 -5.183 34 HA VAL 253 HA VAL 253 1.877 -3.959 -3.615 35 HB VAL 253 HB VAL 253 3.234 -5.365 -5.920 36 1HG1 VAL 253 1HG1 VAL 253 5.129 -4.488 -4.061 37 2HG1 VAL 253 2HG1 VAL 253 4.042 -3.119 -4.301 38 3HG1 VAL 253 3HG1 VAL 253 4.855 -3.855 -5.683 39 1HG2 VAL 253 1HG2 VAL 253 3.855 -5.900 -3.061 40 2HG2 VAL 253 2HG2 VAL 253 3.951 -6.971 -4.458 41 3HG2 VAL 253 3HG2 VAL 253 2.383 -6.593 -3.744 42 H GLY 254 H GLY 254 1.364 -4.277 -7.128 43 1HA GLY 254 2HA GLY 254 2.215 -1.710 -7.887 44 2HA GLY 254 1HA GLY 254 1.032 -2.676 -8.759 45 H LEU 255 H LEU 255 -1.061 -2.834 -7.044 46 HA LEU 255 HA LEU 255 -2.372 -0.363 -7.338 47 1HB LEU 255 2HB LEU 255 -2.929 -2.925 -5.993 48 2HB LEU 255 1HB LEU 255 -3.805 -1.535 -5.378 49 HG LEU 255 HG LEU 255 -3.814 -2.505 -8.230 50 1HD1 LEU 255 1HD1 LEU 255 -5.057 -3.984 -6.803 51 2HD1 LEU 255 2HD1 LEU 255 -6.192 -2.996 -7.723 52 3HD1 LEU 255 3HD1 LEU 255 -5.867 -2.622 -6.029 53 1HD2 LEU 255 1HD2 LEU 255 -4.265 -0.325 -8.609 54 2HD2 LEU 255 2HD2 LEU 255 -4.710 -0.018 -6.930 55 3HD2 LEU 255 3HD2 LEU 255 -5.869 -0.770 -8.025 56 H GLY 256 H GLY 256 -0.886 -1.889 -4.506 57 1HA GLY 256 2HA GLY 256 -1.579 0.084 -2.645 58 2HA GLY 256 1HA GLY 256 -0.238 -1.038 -2.491 59 H ILE 257 H ILE 257 1.539 -0.298 -4.414 60 HA ILE 257 HA ILE 257 2.636 2.052 -3.300 61 HB ILE 257 HB ILE 257 4.338 1.981 -5.068 62 1HG1 ILE 257 2HG1 ILE 257 4.020 -0.414 -6.371 63 2HG1 ILE 257 1HG1 ILE 257 2.376 0.216 -6.364 64 1HG2 ILE 257 1HG2 ILE 257 3.640 -0.435 -3.477 65 2HG2 ILE 257 2HG2 ILE 257 4.972 0.705 -3.280 66 3HG2 ILE 257 3HG2 ILE 257 5.020 -0.493 -4.574 67 1HD1 ILE 257 1HD1 ILE 257 3.317 2.344 -7.325 68 2HD1 ILE 257 2HD1 ILE 257 3.376 0.929 -8.377 69 3HD1 ILE 257 3HD1 ILE 257 4.834 1.473 -7.546 70 H THR 258 H THR 258 0.783 1.554 -6.300 71 HA THR 258 HA THR 258 1.149 4.190 -7.282 72 HB THR 258 HB THR 258 -0.964 3.766 -8.606 73 HG1 THR 258 1HG THR 258 -0.741 1.087 -7.700 74 1HG2 THR 258 1HG2 THR 258 1.364 1.862 -8.727 75 2HG2 THR 258 2HG2 THR 258 1.102 3.326 -9.673 76 3HG2 THR 258 3HG2 THR 258 0.099 1.903 -9.955 77 H THR 259 H THR 259 -1.446 2.763 -5.277 78 HA THR 259 HA THR 259 -2.996 5.131 -5.151 79 HB THR 259 HB THR 259 -3.994 4.108 -3.061 80 HG1 THR 259 1HG THR 259 -2.535 1.780 -3.780 81 1HG2 THR 259 1HG2 THR 259 -4.423 3.557 -5.703 82 2HG2 THR 259 2HG2 THR 259 -5.437 2.995 -4.375 83 3HG2 THR 259 3HG2 THR 259 -4.180 1.945 -5.029 84 H VAL 260 H VAL 260 -0.480 3.807 -3.006 85 HA VAL 260 HA VAL 260 -0.635 5.835 -1.049 86 HB VAL 260 HB VAL 260 1.678 4.073 -1.868 87 1HG1 VAL 260 1HG1 VAL 260 2.836 5.781 -0.846 88 2HG1 VAL 260 2HG1 VAL 260 2.451 4.755 0.537 89 3HG1 VAL 260 3HG1 VAL 260 1.492 6.201 0.215 90 1HG2 VAL 260 1HG2 VAL 260 -0.488 3.930 0.183 91 2HG2 VAL 260 2HG2 VAL 260 1.062 3.147 0.492 92 3HG2 VAL 260 3HG2 VAL 260 0.104 2.683 -0.913 93 H LEU 261 H LEU 261 1.544 5.519 -3.883 94 HA LEU 261 HA LEU 261 2.894 7.954 -3.568 95 1HB LEU 261 2HB LEU 261 2.260 6.349 -6.029 96 2HB LEU 261 1HB LEU 261 3.253 7.794 -6.069 97 HG LEU 261 HG LEU 261 3.859 5.241 -4.579 98 1HD1 LEU 261 1HD1 LEU 261 5.119 4.639 -6.310 99 2HD1 LEU 261 2HD1 LEU 261 5.801 6.256 -6.482 100 3HD1 LEU 261 3HD1 LEU 261 4.250 5.870 -7.227 101 1HD2 LEU 261 1HD2 LEU 261 5.783 7.505 -4.803 102 2HD2 LEU 261 2HD2 LEU 261 5.675 6.231 -3.588 103 3HD2 LEU 261 3HD2 LEU 261 4.527 7.569 -3.566 104 H THR 262 H THR 262 -0.180 7.214 -5.147 105 HA THR 262 HA THR 262 -0.607 9.765 -6.324 106 HB THR 262 HB THR 262 -2.635 7.699 -5.429 107 HG1 THR 262 1HG THR 262 -1.322 6.837 -7.020 108 1HG2 THR 262 1HG2 THR 262 -3.061 9.837 -7.500 109 2HG2 THR 262 2HG2 THR 262 -3.472 10.078 -5.801 110 3HG2 THR 262 3HG2 THR 262 -4.260 8.800 -6.726 111 H MET 263 H MET 263 -1.743 8.319 -3.281 112 HA MET 263 HA MET 263 -3.184 10.540 -2.340 113 1HB MET 263 2HB MET 263 -3.397 8.256 -1.433 114 2HB MET 263 1HB MET 263 -1.788 8.389 -0.741 115 1HG MET 263 2HG MET 263 -2.552 10.226 0.678 116 2HG MET 263 1HG MET 263 -4.166 10.082 -0.014 117 1HE MET 263 1HE MET 263 -3.539 10.018 3.115 118 2HE MET 263 2HE MET 263 -4.596 8.709 3.639 119 3HE MET 263 3HE MET 263 -5.168 9.881 2.453 120 H THR 264 H THR 264 0.181 9.525 -1.574 121 HA THR 264 HA THR 264 0.591 12.126 -0.278 122 HB THR 264 HB THR 264 1.407 10.177 0.954 123 HG1 THR 264 1HG THR 264 3.498 11.861 -0.041 124 1HG2 THR 264 1HG2 THR 264 3.532 9.778 -1.133 125 2HG2 THR 264 2HG2 THR 264 2.012 8.882 -1.177 126 3HG2 THR 264 3HG2 THR 264 3.089 8.724 0.210 127 H THR 265 H THR 265 0.211 12.295 -3.017 128 HA THR 265 HA THR 265 2.546 12.300 -4.578 129 HB THR 265 HB THR 265 0.430 12.414 -5.689 130 HG1 THR 265 1HG THR 265 2.347 14.334 -6.087 131 1HG2 THR 265 1HG2 THR 265 -1.263 13.815 -5.196 132 2HG2 THR 265 2HG2 THR 265 -0.196 15.210 -5.036 133 3HG2 THR 265 3HG2 THR 265 -0.383 14.084 -3.692 134 H GLN 266 H GLN 266 1.308 14.699 -2.352 135 HA GLN 266 HA GLN 266 3.071 16.792 -3.244 136 1HB GLN 266 2HB GLN 266 1.321 16.555 -0.796 137 2HB GLN 266 1HB GLN 266 2.219 17.999 -1.236 138 1HG GLN 266 2HG GLN 266 0.180 16.728 -3.036 139 2HG GLN 266 1HG GLN 266 -0.216 17.973 -1.853 140 1HE2 GLN 266 1HE2 GLN 266 -0.315 19.928 -2.664 141 2HE2 GLN 266 2HE2 GLN 266 0.587 20.523 -4.011 142 H SER 267 H SER 267 4.836 14.899 -2.890 143 HA SER 267 HA SER 267 6.784 14.316 -1.865 144 1HB SER 267 2HB SER 267 7.103 16.783 -1.761 145 2HB SER 267 1HB SER 267 6.351 16.790 -0.167 146 HG SER 267 HG SER 267 8.872 16.465 -0.667 147 H SER 268 H SER 268 6.795 15.419 1.218 148 HA SER 268 HA SER 268 5.035 13.495 2.455 149 1HB SER 268 2HB SER 268 8.024 13.045 2.487 150 2HB SER 268 1HB SER 268 6.927 12.315 3.659 151 HG SER 268 HG SER 268 6.270 12.026 0.968 152 H GLY 269 H GLY 269 4.835 13.758 4.713 153 1HA GLY 269 2HA GLY 269 6.507 15.507 6.217 154 2HA GLY 269 1HA GLY 269 5.048 16.338 5.702 155 H SER 270 H SER 270 3.870 16.531 7.526 156 HA SER 270 HA SER 270 3.810 14.571 9.596 157 1HB SER 270 2HB SER 270 3.447 16.899 10.144 158 2HB SER 270 1HB SER 270 2.033 16.967 9.092 159 HG SER 270 HG SER 270 1.421 15.048 10.639 160 H ARG 271 H ARG 271 2.196 14.700 6.634 161 HA ARG 271 HA ARG 271 0.554 13.461 5.669 162 1HB ARG 271 2HB ARG 271 1.213 11.800 8.058 163 2HB ARG 271 1HB ARG 271 -0.262 11.426 7.182 164 1HG ARG 271 2HG ARG 271 1.430 10.015 6.334 165 2HG ARG 271 1HG ARG 271 1.125 11.241 5.104 166 1HD ARG 271 2HD ARG 271 3.095 12.491 5.922 167 2HD ARG 271 1HD ARG 271 3.412 11.193 7.071 168 HE ARG 271 HE ARG 271 4.375 10.014 5.376 169 1HH1 ARG 271 1HH1 ARG 271 2.338 12.432 3.966 170 2HH1 ARG 271 2HH1 ARG 271 2.747 11.994 2.336 171 1HH2 ARG 271 1HH2 ARG 271 4.897 9.469 3.238 172 2HH2 ARG 271 2HH2 ARG 271 4.171 10.354 1.939 173 H ALA 272 H ALA 272 -1.487 12.001 7.390 174 HA ALA 272 HA ALA 272 -3.627 12.349 8.061 175 1HB ALA 272 1HB ALA 272 -2.446 14.719 9.496 176 2HB ALA 272 2HB ALA 272 -2.413 13.055 10.079 177 3HB ALA 272 3HB ALA 272 -3.953 13.893 9.887 178 H SER 273 H SER 273 -3.078 13.427 5.505 179 HA SER 273 HA SER 273 -5.348 15.128 5.155 180 1HB SER 273 2HB SER 273 -2.608 16.377 4.851 181 2HB SER 273 1HB SER 273 -4.052 17.021 4.071 182 HG SER 273 HG SER 273 -4.181 16.517 6.817 183 H LEU 274 H LEU 274 -4.799 16.275 2.775 184 HA LEU 274 HA LEU 274 -4.823 15.892 0.551 185 1HB LEU 274 2HB LEU 274 -2.907 13.657 1.216 186 2HB LEU 274 1HB LEU 274 -3.232 14.265 -0.395 187 HG LEU 274 HG LEU 274 -1.984 15.864 1.842 188 1HD1 LEU 274 1HD1 LEU 274 -0.008 15.734 0.176 189 2HD1 LEU 274 2HD1 LEU 274 -0.845 14.311 -0.443 190 3HD1 LEU 274 3HD1 LEU 274 -0.328 14.365 1.242 191 1HD2 LEU 274 1HD2 LEU 274 -3.168 16.613 -0.680 192 2HD2 LEU 274 2HD2 LEU 274 -1.457 17.035 -0.629 193 3HD2 LEU 274 3HD2 LEU 274 -2.550 17.633 0.619 194 HA PRO 275 HA PRO 275 -7.522 11.890 1.583 195 1HB PRO 275 2HB PRO 275 -9.645 13.994 1.398 196 2HB PRO 275 1HB PRO 275 -9.613 12.508 2.359 197 1HG PRO 275 2HG PRO 275 -9.129 14.789 3.557 198 2HG PRO 275 1HG PRO 275 -8.087 13.388 3.891 199 1HD PRO 275 2HD PRO 275 -7.545 15.764 2.148 200 2HD PRO 275 1HD PRO 275 -6.461 14.935 3.291 201 H LYS 276 H LYS 276 -7.931 10.748 -0.223 202 HA LYS 276 HA LYS 276 -9.310 11.916 -2.473 203 1HB LYS 276 2HB LYS 276 -7.041 12.625 -2.976 204 2HB LYS 276 1HB LYS 276 -6.443 10.987 -2.747 205 1HG LYS 276 2HG LYS 276 -6.625 11.572 -5.109 206 2HG LYS 276 1HG LYS 276 -7.689 10.231 -4.683 207 1HD LYS 276 2HD LYS 276 -9.424 12.190 -4.316 208 2HD LYS 276 1HD LYS 276 -8.362 13.028 -5.448 209 1HE LYS 276 2HE LYS 276 -10.170 11.917 -6.635 210 2HE LYS 276 1HE LYS 276 -8.619 11.184 -7.041 211 1HZ LYS 276 1HZ LYS 276 -9.299 9.233 -6.262 212 2HZ LYS 276 2HZ LYS 276 -10.857 9.878 -6.143 213 3HZ LYS 276 3HZ LYS 276 -9.828 9.896 -4.787 Start of MODEL 18 1 1H ALA 249 1HT ALA 249 5.184 -10.864 0.465 2 2H ALA 249 2HT ALA 249 5.231 -9.965 1.896 3 3H ALA 249 3HT ALA 249 6.634 -10.153 0.970 4 HA ALA 249 HA ALA 249 5.558 -7.945 0.752 5 1HB ALA 249 1HB ALA 249 5.496 -9.301 -1.905 6 2HB ALA 249 2HB ALA 249 7.011 -9.199 -1.007 7 3HB ALA 249 3HB ALA 249 6.152 -7.726 -1.460 8 HA PRO 250 HA PRO 250 1.186 -7.678 0.265 9 1HB PRO 250 2HB PRO 250 1.654 -5.385 -1.550 10 2HB PRO 250 1HB PRO 250 0.792 -5.439 -0.010 11 1HG PRO 250 2HG PRO 250 3.155 -4.263 -0.172 12 2HG PRO 250 1HG PRO 250 2.751 -5.272 1.234 13 1HD PRO 250 2HD PRO 250 4.367 -5.979 -1.193 14 2HD PRO 250 1HD PRO 250 4.743 -6.260 0.521 15 H ALA 251 H ALA 251 -0.235 -8.735 -1.008 16 HA ALA 251 HA ALA 251 0.424 -9.886 -3.459 17 1HB ALA 251 1HB ALA 251 -1.392 -11.017 -2.848 18 2HB ALA 251 2HB ALA 251 -2.351 -9.680 -3.482 19 3HB ALA 251 3HB ALA 251 -1.915 -9.721 -1.773 20 H ARG 252 H ARG 252 -1.544 -6.982 -2.823 21 HA ARG 252 HA ARG 252 -1.493 -6.362 -5.673 22 1HB ARG 252 2HB ARG 252 -3.085 -5.280 -3.371 23 2HB ARG 252 1HB ARG 252 -2.996 -4.414 -4.902 24 1HG ARG 252 2HG ARG 252 -4.136 -7.136 -4.365 25 2HG ARG 252 1HG ARG 252 -4.943 -5.714 -5.035 26 1HD ARG 252 2HD ARG 252 -3.530 -5.860 -7.035 27 2HD ARG 252 1HD ARG 252 -2.732 -7.282 -6.367 28 HE ARG 252 HE ARG 252 -5.534 -7.682 -6.502 29 1HH1 ARG 252 1HH1 ARG 252 -2.689 -7.585 -8.460 30 2HH1 ARG 252 2HH1 ARG 252 -3.348 -8.610 -9.683 31 1HH2 ARG 252 1HH2 ARG 252 -6.391 -9.026 -8.091 32 2HH2 ARG 252 2HH2 ARG 252 -5.436 -9.425 -9.474 33 H VAL 253 H VAL 253 0.947 -6.216 -4.937 34 HA VAL 253 HA VAL 253 2.065 -4.051 -3.682 35 HB VAL 253 HB VAL 253 3.444 -5.826 -4.394 36 1HG1 VAL 253 1HG1 VAL 253 3.914 -5.902 -7.011 37 2HG1 VAL 253 2HG1 VAL 253 2.236 -5.361 -7.037 38 3HG1 VAL 253 3HG1 VAL 253 2.662 -6.871 -6.231 39 1HG2 VAL 253 1HG2 VAL 253 4.026 -3.152 -5.459 40 2HG2 VAL 253 2HG2 VAL 253 5.025 -4.462 -6.084 41 3HG2 VAL 253 3HG2 VAL 253 4.956 -4.157 -4.348 42 H GLY 254 H GLY 254 1.460 -4.257 -7.170 43 1HA GLY 254 2HA GLY 254 2.202 -1.665 -7.881 44 2HA GLY 254 1HA GLY 254 1.035 -2.637 -8.762 45 H LEU 255 H LEU 255 -1.043 -2.835 -7.009 46 HA LEU 255 HA LEU 255 -2.393 -0.394 -7.306 47 1HB LEU 255 2HB LEU 255 -2.905 -2.967 -5.974 48 2HB LEU 255 1HB LEU 255 -3.788 -1.596 -5.326 49 HG LEU 255 HG LEU 255 -3.834 -2.537 -8.189 50 1HD1 LEU 255 1HD1 LEU 255 -5.823 -3.549 -7.755 51 2HD1 LEU 255 2HD1 LEU 255 -6.232 -2.433 -6.452 52 3HD1 LEU 255 3HD1 LEU 255 -5.075 -3.733 -6.168 53 1HD2 LEU 255 1HD2 LEU 255 -4.468 -0.461 -8.678 54 2HD2 LEU 255 2HD2 LEU 255 -4.493 -0.005 -6.974 55 3HD2 LEU 255 3HD2 LEU 255 -5.914 -0.748 -7.710 56 H GLY 256 H GLY 256 -0.863 -1.877 -4.471 57 1HA GLY 256 2HA GLY 256 -1.578 0.132 -2.639 58 2HA GLY 256 1HA GLY 256 -0.249 -0.998 -2.452 59 H ILE 257 H ILE 257 1.512 -0.304 -4.429 60 HA ILE 257 HA ILE 257 2.675 2.026 -3.342 61 HB ILE 257 HB ILE 257 4.341 1.913 -5.143 62 1HG1 ILE 257 2HG1 ILE 257 3.944 -0.479 -6.428 63 2HG1 ILE 257 1HG1 ILE 257 2.315 0.190 -6.392 64 1HG2 ILE 257 1HG2 ILE 257 4.416 -0.869 -4.556 65 2HG2 ILE 257 2HG2 ILE 257 3.795 -0.002 -3.151 66 3HG2 ILE 257 3HG2 ILE 257 5.353 0.444 -3.844 67 1HD1 ILE 257 1HD1 ILE 257 3.489 0.772 -8.443 68 2HD1 ILE 257 2HD1 ILE 257 4.751 1.565 -7.502 69 3HD1 ILE 257 3HD1 ILE 257 3.108 2.207 -7.493 70 H THR 258 H THR 258 0.753 1.572 -6.307 71 HA THR 258 HA THR 258 1.162 4.224 -7.264 72 HB THR 258 HB THR 258 -0.920 3.825 -8.633 73 HG1 THR 258 1HG THR 258 -0.744 1.136 -7.756 74 1HG2 THR 258 1HG2 THR 258 1.493 3.209 -9.262 75 2HG2 THR 258 2HG2 THR 258 0.186 2.466 -10.183 76 3HG2 THR 258 3HG2 THR 258 1.012 1.545 -8.925 77 H THR 259 H THR 259 -1.434 2.762 -5.286 78 HA THR 259 HA THR 259 -3.020 5.111 -5.163 79 HB THR 259 HB THR 259 -3.995 4.074 -3.058 80 HG1 THR 259 1HG THR 259 -2.554 1.750 -3.817 81 1HG2 THR 259 1HG2 THR 259 -4.294 1.890 -4.927 82 2HG2 THR 259 2HG2 THR 259 -4.343 3.446 -5.754 83 3HG2 THR 259 3HG2 THR 259 -5.464 3.114 -4.434 84 H VAL 260 H VAL 260 -0.516 3.803 -2.999 85 HA VAL 260 HA VAL 260 -0.687 5.842 -1.053 86 HB VAL 260 HB VAL 260 1.619 4.053 -1.831 87 1HG1 VAL 260 1HG1 VAL 260 2.700 4.719 0.246 88 2HG1 VAL 260 2HG1 VAL 260 1.403 5.868 0.568 89 3HG1 VAL 260 3HG1 VAL 260 2.475 6.114 -0.810 90 1HG2 VAL 260 1HG2 VAL 260 0.340 2.560 -0.765 91 2HG2 VAL 260 2HG2 VAL 260 -0.720 3.808 -0.109 92 3HG2 VAL 260 3HG2 VAL 260 0.792 3.414 0.709 93 H LEU 261 H LEU 261 1.475 5.502 -3.887 94 HA LEU 261 HA LEU 261 2.913 7.882 -3.590 95 1HB LEU 261 2HB LEU 261 2.560 5.875 -5.590 96 2HB LEU 261 1HB LEU 261 2.445 7.444 -6.361 97 HG LEU 261 HG LEU 261 4.722 6.557 -6.438 98 1HD1 LEU 261 1HD1 LEU 261 5.013 8.783 -4.517 99 2HD1 LEU 261 2HD1 LEU 261 4.018 9.086 -5.941 100 3HD1 LEU 261 3HD1 LEU 261 5.694 8.574 -6.130 101 1HD2 LEU 261 1HD2 LEU 261 4.564 5.273 -4.306 102 2HD2 LEU 261 2HD2 LEU 261 4.733 6.797 -3.434 103 3HD2 LEU 261 3HD2 LEU 261 6.040 6.224 -4.471 104 H THR 262 H THR 262 -0.128 7.254 -5.286 105 HA THR 262 HA THR 262 -0.561 9.836 -6.324 106 HB THR 262 HB THR 262 -2.589 7.753 -5.478 107 HG1 THR 262 1HG THR 262 -1.312 6.927 -7.101 108 1HG2 THR 262 1HG2 THR 262 -3.316 10.235 -5.843 109 2HG2 THR 262 2HG2 THR 262 -4.250 8.925 -6.565 110 3HG2 THR 262 3HG2 THR 262 -3.109 9.840 -7.550 111 H MET 263 H MET 263 -1.647 8.324 -3.303 112 HA MET 263 HA MET 263 -3.094 10.515 -2.292 113 1HB MET 263 2HB MET 263 -3.297 8.219 -1.436 114 2HB MET 263 1HB MET 263 -1.665 8.314 -0.792 115 1HG MET 263 2HG MET 263 -2.380 10.138 0.692 116 2HG MET 263 1HG MET 263 -4.023 9.969 0.074 117 1HE MET 263 1HE MET 263 -3.668 10.150 2.791 118 2HE MET 263 2HE MET 263 -3.749 8.706 3.799 119 3HE MET 263 3HE MET 263 -5.137 9.175 2.816 120 H THR 264 H THR 264 0.243 9.443 -1.483 121 HA THR 264 HA THR 264 0.700 11.970 -0.103 122 HB THR 264 HB THR 264 1.615 9.953 0.930 123 HG1 THR 264 1HG THR 264 3.601 11.751 -0.060 124 1HG2 THR 264 1HG2 THR 264 2.337 8.377 -0.519 125 2HG2 THR 264 2HG2 THR 264 3.872 9.234 -0.388 126 3HG2 THR 264 3HG2 THR 264 2.792 9.562 -1.743 127 H THR 265 H THR 265 0.187 12.267 -2.846 128 HA THR 265 HA THR 265 2.524 12.528 -4.415 129 HB THR 265 HB THR 265 0.358 12.464 -5.493 130 HG1 THR 265 1HG THR 265 2.204 14.403 -5.945 131 1HG2 THR 265 1HG2 THR 265 -0.278 15.238 -4.563 132 2HG2 THR 265 2HG2 THR 265 -0.717 13.849 -3.569 133 3HG2 THR 265 3HG2 THR 265 -1.355 13.997 -5.205 134 H GLN 266 H GLN 266 1.070 14.589 -2.031 135 HA GLN 266 HA GLN 266 1.624 16.589 -1.122 136 1HB GLN 266 2HB GLN 266 4.366 15.749 -2.068 137 2HB GLN 266 1HB GLN 266 4.059 17.071 -0.950 138 1HG GLN 266 2HG GLN 266 3.090 15.525 0.649 139 2HG GLN 266 1HG GLN 266 3.323 14.191 -0.478 140 1HE2 GLN 266 1HE2 GLN 266 4.543 15.602 2.186 141 2HE2 GLN 266 2HE2 GLN 266 6.187 15.090 2.064 142 H SER 267 H SER 267 4.314 17.397 -3.041 143 HA SER 267 HA SER 267 2.910 18.755 -5.141 144 1HB SER 267 2HB SER 267 4.041 20.369 -2.845 145 2HB SER 267 1HB SER 267 3.699 21.058 -4.432 146 HG SER 267 HG SER 267 1.653 19.589 -3.240 147 H SER 268 H SER 268 4.228 19.222 -6.828 148 HA SER 268 HA SER 268 6.927 18.235 -6.735 149 1HB SER 268 2HB SER 268 6.955 18.914 -9.150 150 2HB SER 268 1HB SER 268 5.632 17.832 -8.720 151 HG SER 268 HG SER 268 4.527 19.342 -9.752 152 H GLY 269 H GLY 269 6.864 20.319 -4.942 153 1HA GLY 269 2HA GLY 269 9.071 21.805 -5.458 154 2HA GLY 269 1HA GLY 269 7.801 22.742 -6.225 155 H SER 270 H SER 270 8.126 24.483 -4.835 156 HA SER 270 HA SER 270 7.706 24.086 -1.977 157 1HB SER 270 2HB SER 270 9.510 25.588 -2.634 158 2HB SER 270 1HB SER 270 8.378 26.584 -3.550 159 HG SER 270 HG SER 270 7.335 26.484 -1.188 160 H ARG 271 H ARG 271 5.952 25.133 -4.756 161 HA ARG 271 HA ARG 271 4.023 26.771 -3.504 162 1HB ARG 271 2HB ARG 271 4.303 26.873 -5.888 163 2HB ARG 271 1HB ARG 271 3.925 25.164 -6.059 164 1HG ARG 271 2HG ARG 271 1.631 25.617 -5.284 165 2HG ARG 271 1HG ARG 271 2.024 27.334 -5.189 166 1HD ARG 271 2HD ARG 271 2.196 25.668 -7.696 167 2HD ARG 271 1HD ARG 271 0.827 26.693 -7.268 168 HE ARG 271 HE ARG 271 3.309 27.530 -8.384 169 1HH1 ARG 271 1HH1 ARG 271 0.703 28.525 -6.344 170 2HH1 ARG 271 2HH1 ARG 271 1.003 30.210 -6.580 171 1HH2 ARG 271 1HH2 ARG 271 3.700 29.711 -8.688 172 2HH2 ARG 271 2HH2 ARG 271 2.694 30.878 -7.907 173 H ALA 272 H ALA 272 2.240 26.331 -2.378 174 HA ALA 272 HA ALA 272 1.702 23.695 -1.454 175 1HB ALA 272 1HB ALA 272 1.242 26.055 -0.372 176 2HB ALA 272 2HB ALA 272 0.229 24.661 0.007 177 3HB ALA 272 3HB ALA 272 -0.321 25.858 -1.165 178 H SER 273 H SER 273 0.238 22.221 -2.115 179 HA SER 273 HA SER 273 -1.285 21.117 -3.402 180 1HB SER 273 2HB SER 273 -2.430 23.842 -4.022 181 2HB SER 273 1HB SER 273 -3.219 22.286 -4.273 182 HG SER 273 HG SER 273 -3.927 23.245 -2.335 183 H LEU 274 H LEU 274 1.030 21.266 -4.521 184 HA LEU 274 HA LEU 274 0.384 21.784 -7.352 185 1HB LEU 274 2HB LEU 274 2.109 23.345 -6.410 186 2HB LEU 274 1HB LEU 274 3.129 21.954 -6.100 187 HG LEU 274 HG LEU 274 3.169 21.479 -8.535 188 1HD1 LEU 274 1HD1 LEU 274 1.414 23.892 -8.585 189 2HD1 LEU 274 2HD1 LEU 274 1.263 22.374 -9.471 190 3HD1 LEU 274 3HD1 LEU 274 2.485 23.554 -9.944 191 1HD2 LEU 274 1HD2 LEU 274 5.067 22.598 -7.865 192 2HD2 LEU 274 2HD2 LEU 274 4.179 24.050 -7.402 193 3HD2 LEU 274 3HD2 LEU 274 4.440 23.681 -9.108 194 HA PRO 275 HA PRO 275 1.389 17.187 -6.086 195 1HB PRO 275 2HB PRO 275 -1.083 17.012 -7.771 196 2HB PRO 275 1HB PRO 275 -0.564 15.978 -6.432 197 1HG PRO 275 2HG PRO 275 -2.397 17.797 -5.973 198 2HG PRO 275 1HG PRO 275 -1.054 17.608 -4.825 199 1HD PRO 275 2HD PRO 275 -1.480 19.716 -6.903 200 2HD PRO 275 1HD PRO 275 -0.843 19.884 -5.250 201 H LYS 276 H LYS 276 0.151 18.532 -9.135 202 HA LYS 276 HA LYS 276 1.942 16.779 -10.652 203 1HB LYS 276 2HB LYS 276 -0.422 16.909 -11.355 204 2HB LYS 276 1HB LYS 276 -0.233 18.635 -11.638 205 1HG LYS 276 2HG LYS 276 1.719 17.833 -13.205 206 2HG LYS 276 1HG LYS 276 0.795 16.330 -13.209 207 1HD LYS 276 2HD LYS 276 0.161 17.756 -15.086 208 2HD LYS 276 1HD LYS 276 -1.187 17.551 -13.964 209 1HE LYS 276 2HE LYS 276 -0.877 19.891 -14.790 210 2HE LYS 276 1HE LYS 276 -0.839 19.726 -13.035 211 1HZ LYS 276 1HZ LYS 276 1.672 19.669 -14.575 212 2HZ LYS 276 2HZ LYS 276 1.426 20.105 -12.946 213 3HZ LYS 276 3HZ LYS 276 0.943 21.151 -14.200 Start of MODEL 19 1 1H ALA 249 1HT ALA 249 1.986 -12.477 -11.134 2 2H ALA 249 2HT ALA 249 0.973 -11.773 -12.290 3 3H ALA 249 3HT ALA 249 0.524 -11.769 -10.658 4 HA ALA 249 HA ALA 249 3.082 -10.571 -11.112 5 1HB ALA 249 1HB ALA 249 0.652 -9.333 -12.393 6 2HB ALA 249 2HB ALA 249 2.125 -9.874 -13.201 7 3HB ALA 249 3HB ALA 249 2.177 -8.494 -12.105 8 HA PRO 250 HA PRO 250 1.941 -8.855 -7.211 9 1HB PRO 250 2HB PRO 250 3.466 -6.647 -7.121 10 2HB PRO 250 1HB PRO 250 4.172 -8.268 -7.110 11 1HG PRO 250 2HG PRO 250 3.819 -6.384 -9.412 12 2HG PRO 250 1HG PRO 250 5.269 -7.284 -8.920 13 1HD PRO 250 2HD PRO 250 3.641 -8.158 -10.873 14 2HD PRO 250 1HD PRO 250 4.475 -9.273 -9.772 15 H ALA 251 H ALA 251 -0.202 -8.393 -8.747 16 HA ALA 251 HA ALA 251 -0.891 -5.787 -9.441 17 1HB ALA 251 1HB ALA 251 -3.243 -6.993 -8.498 18 2HB ALA 251 2HB ALA 251 -2.236 -8.296 -9.132 19 3HB ALA 251 3HB ALA 251 -2.652 -6.924 -10.159 20 H ARG 252 H ARG 252 -1.354 -7.430 -6.314 21 HA ARG 252 HA ARG 252 -2.698 -5.324 -5.007 22 1HB ARG 252 2HB ARG 252 -2.132 -7.875 -4.350 23 2HB ARG 252 1HB ARG 252 -0.888 -7.064 -3.414 24 1HG ARG 252 2HG ARG 252 -3.805 -6.356 -3.226 25 2HG ARG 252 1HG ARG 252 -3.035 -7.570 -2.205 26 1HD ARG 252 2HD ARG 252 -1.451 -5.834 -1.418 27 2HD ARG 252 1HD ARG 252 -2.327 -4.641 -2.373 28 HE ARG 252 HE ARG 252 -3.862 -4.527 -0.696 29 1HH1 ARG 252 1HH1 ARG 252 -2.185 -7.542 -0.375 30 2HH1 ARG 252 2HH1 ARG 252 -3.038 -8.005 1.053 31 1HH2 ARG 252 1HH2 ARG 252 -4.974 -5.141 1.167 32 2HH2 ARG 252 2HH2 ARG 252 -4.612 -6.653 1.921 33 H VAL 253 H VAL 253 0.735 -6.124 -5.286 34 HA VAL 253 HA VAL 253 1.718 -4.085 -3.590 35 HB VAL 253 HB VAL 253 3.125 -5.398 -5.923 36 1HG1 VAL 253 1HG1 VAL 253 5.164 -4.870 -4.488 37 2HG1 VAL 253 2HG1 VAL 253 4.111 -3.765 -3.602 38 3HG1 VAL 253 3HG1 VAL 253 4.399 -3.518 -5.325 39 1HG2 VAL 253 1HG2 VAL 253 2.198 -6.539 -3.517 40 2HG2 VAL 253 2HG2 VAL 253 3.950 -6.388 -3.373 41 3HG2 VAL 253 3HG2 VAL 253 3.249 -7.266 -4.733 42 H GLY 254 H GLY 254 1.354 -4.275 -7.123 43 1HA GLY 254 2HA GLY 254 2.318 -1.710 -7.756 44 2HA GLY 254 1HA GLY 254 1.184 -2.635 -8.731 45 H LEU 255 H LEU 255 -1.018 -2.791 -7.115 46 HA LEU 255 HA LEU 255 -2.253 -0.272 -7.461 47 1HB LEU 255 2HB LEU 255 -3.340 -2.569 -7.294 48 2HB LEU 255 1HB LEU 255 -3.206 -2.376 -5.554 49 HG LEU 255 HG LEU 255 -4.504 -0.271 -5.732 50 1HD1 LEU 255 1HD1 LEU 255 -5.795 0.072 -7.838 51 2HD1 LEU 255 2HD1 LEU 255 -4.748 -1.123 -8.606 52 3HD1 LEU 255 3HD1 LEU 255 -4.065 0.377 -7.978 53 1HD2 LEU 255 1HD2 LEU 255 -6.564 -1.334 -5.716 54 2HD2 LEU 255 2HD2 LEU 255 -5.445 -2.649 -5.348 55 3HD2 LEU 255 3HD2 LEU 255 -6.095 -2.472 -6.978 56 H GLY 256 H GLY 256 -0.894 -1.884 -4.607 57 1HA GLY 256 2HA GLY 256 -1.648 0.051 -2.707 58 2HA GLY 256 1HA GLY 256 -0.309 -1.075 -2.543 59 H ILE 257 H ILE 257 1.512 -0.323 -4.392 60 HA ILE 257 HA ILE 257 2.606 2.006 -3.239 61 HB ILE 257 HB ILE 257 4.342 1.933 -4.975 62 1HG1 ILE 257 2HG1 ILE 257 4.036 -0.436 -6.311 63 2HG1 ILE 257 1HG1 ILE 257 2.390 0.188 -6.319 64 1HG2 ILE 257 1HG2 ILE 257 5.286 0.492 -3.595 65 2HG2 ILE 257 2HG2 ILE 257 4.497 -0.833 -4.452 66 3HG2 ILE 257 3HG2 ILE 257 3.701 -0.078 -3.070 67 1HD1 ILE 257 1HD1 ILE 257 3.229 1.052 -8.267 68 2HD1 ILE 257 2HD1 ILE 257 4.843 1.288 -7.597 69 3HD1 ILE 257 3HD1 ILE 257 3.533 2.379 -7.145 70 H THR 258 H THR 258 0.797 1.562 -6.274 71 HA THR 258 HA THR 258 1.194 4.220 -7.207 72 HB THR 258 HB THR 258 -0.909 3.817 -8.569 73 HG1 THR 258 1HG THR 258 -0.658 1.117 -7.736 74 1HG2 THR 258 1HG2 THR 258 0.196 2.017 -9.959 75 2HG2 THR 258 2HG2 THR 258 1.439 1.937 -8.710 76 3HG2 THR 258 3HG2 THR 258 1.186 3.433 -9.609 77 H THR 259 H THR 259 -1.262 2.739 -5.136 78 HA THR 259 HA THR 259 -2.974 4.998 -4.970 79 HB THR 259 HB THR 259 -2.569 2.802 -2.921 80 HG1 THR 259 1HG THR 259 -3.274 1.873 -4.822 81 1HG2 THR 259 1HG2 THR 259 -4.340 3.593 -1.752 82 2HG2 THR 259 2HG2 THR 259 -5.176 4.159 -3.199 83 3HG2 THR 259 3HG2 THR 259 -3.880 5.125 -2.495 84 H VAL 260 H VAL 260 -0.334 3.811 -2.892 85 HA VAL 260 HA VAL 260 -0.435 5.862 -0.968 86 HB VAL 260 HB VAL 260 1.929 4.216 -1.895 87 1HG1 VAL 260 1HG1 VAL 260 2.649 4.866 0.563 88 2HG1 VAL 260 2HG1 VAL 260 1.669 6.291 0.220 89 3HG1 VAL 260 3HG1 VAL 260 3.042 5.896 -0.813 90 1HG2 VAL 260 1HG2 VAL 260 0.822 2.585 -0.849 91 2HG2 VAL 260 2HG2 VAL 260 -0.338 3.713 -0.147 92 3HG2 VAL 260 3HG2 VAL 260 1.211 3.430 0.649 93 H LEU 261 H LEU 261 1.504 5.585 -3.957 94 HA LEU 261 HA LEU 261 2.852 8.039 -3.725 95 1HB LEU 261 2HB LEU 261 2.071 6.422 -6.136 96 2HB LEU 261 1HB LEU 261 3.051 7.873 -6.239 97 HG LEU 261 HG LEU 261 3.766 5.323 -4.791 98 1HD1 LEU 261 1HD1 LEU 261 3.904 5.665 -7.400 99 2HD1 LEU 261 2HD1 LEU 261 5.177 4.833 -6.507 100 3HD1 LEU 261 3HD1 LEU 261 5.383 6.523 -6.970 101 1HD2 LEU 261 1HD2 LEU 261 4.491 7.652 -3.823 102 2HD2 LEU 261 2HD2 LEU 261 5.658 7.597 -5.144 103 3HD2 LEU 261 3HD2 LEU 261 5.643 6.320 -3.927 104 H THR 262 H THR 262 -0.199 7.232 -5.369 105 HA THR 262 HA THR 262 -0.815 9.762 -6.414 106 HB THR 262 HB THR 262 -2.695 7.600 -5.433 107 HG1 THR 262 1HG THR 262 -1.498 6.774 -7.096 108 1HG2 THR 262 1HG2 THR 262 -3.553 9.412 -7.582 109 2HG2 THR 262 2HG2 THR 262 -3.428 10.145 -5.983 110 3HG2 THR 262 3HG2 THR 262 -4.463 8.740 -6.229 111 H MET 263 H MET 263 -1.614 8.303 -3.296 112 HA MET 263 HA MET 263 -3.164 10.460 -2.311 113 1HB MET 263 2HB MET 263 -3.262 8.137 -1.443 114 2HB MET 263 1HB MET 263 -1.664 8.357 -0.743 115 1HG MET 263 2HG MET 263 -3.384 8.615 0.936 116 2HG MET 263 1HG MET 263 -2.527 10.136 0.684 117 1HE MET 263 1HE MET 263 -6.143 11.345 1.537 118 2HE MET 263 2HE MET 263 -4.446 11.344 2.009 119 3HE MET 263 3HE MET 263 -5.411 9.879 2.184 120 H THR 264 H THR 264 0.275 9.571 -1.758 121 HA THR 264 HA THR 264 0.740 11.776 -0.011 122 HB THR 264 HB THR 264 2.190 9.807 0.087 123 HG1 THR 264 1HG THR 264 3.206 12.386 -0.313 124 1HG2 THR 264 1HG2 THR 264 4.114 9.971 -1.761 125 2HG2 THR 264 2HG2 THR 264 2.755 10.546 -2.727 126 3HG2 THR 264 3HG2 THR 264 2.685 8.958 -1.963 127 H THR 265 H THR 265 1.239 11.369 -3.503 128 HA THR 265 HA THR 265 1.533 14.271 -3.690 129 HB THR 265 HB THR 265 3.784 13.191 -3.707 130 HG1 THR 265 1HG THR 265 4.224 14.257 -5.952 131 1HG2 THR 265 1HG2 THR 265 4.405 12.209 -6.010 132 2HG2 THR 265 2HG2 THR 265 2.674 11.906 -6.174 133 3HG2 THR 265 3HG2 THR 265 3.576 11.173 -4.847 134 H GLN 266 H GLN 266 0.565 15.182 -5.446 135 HA GLN 266 HA GLN 266 -0.176 13.673 -7.767 136 1HB GLN 266 2HB GLN 266 -1.891 12.895 -6.176 137 2HB GLN 266 1HB GLN 266 -2.376 14.559 -5.891 138 1HG GLN 266 2HG GLN 266 -3.106 14.769 -8.194 139 2HG GLN 266 1HG GLN 266 -2.555 13.130 -8.535 140 1HE2 GLN 266 1HE2 GLN 266 -3.677 12.993 -5.487 141 2HE2 GLN 266 2HE2 GLN 266 -5.315 12.531 -5.793 142 H SER 267 H SER 267 -0.978 16.543 -5.845 143 HA SER 267 HA SER 267 -1.347 18.717 -6.378 144 1HB SER 267 2HB SER 267 0.253 19.748 -7.964 145 2HB SER 267 1HB SER 267 1.046 18.694 -6.797 146 HG SER 267 HG SER 267 0.425 17.206 -8.902 147 H SER 268 H SER 268 -3.390 17.316 -7.323 148 HA SER 268 HA SER 268 -4.241 18.868 -9.597 149 1HB SER 268 2HB SER 268 -3.931 15.867 -9.843 150 2HB SER 268 1HB SER 268 -4.909 16.840 -10.940 151 HG SER 268 HG SER 268 -2.348 17.792 -10.573 152 H GLY 269 H GLY 269 -6.405 17.034 -10.278 153 1HA GLY 269 2HA GLY 269 -7.904 16.129 -8.139 154 2HA GLY 269 1HA GLY 269 -8.275 17.839 -8.287 155 H SER 270 H SER 270 -10.254 17.915 -9.099 156 HA SER 270 HA SER 270 -11.980 17.826 -10.561 157 1HB SER 270 2HB SER 270 -9.936 16.727 -12.504 158 2HB SER 270 1HB SER 270 -11.558 17.268 -12.931 159 HG SER 270 HG SER 270 -9.316 18.721 -12.561 160 H ARG 271 H ARG 271 -10.055 14.861 -11.128 161 HA ARG 271 HA ARG 271 -12.531 13.292 -11.134 162 1HB ARG 271 2HB ARG 271 -10.793 12.960 -12.907 163 2HB ARG 271 1HB ARG 271 -9.717 12.339 -11.657 164 1HG ARG 271 2HG ARG 271 -10.692 10.455 -12.686 165 2HG ARG 271 1HG ARG 271 -11.494 10.653 -11.126 166 1HD ARG 271 2HD ARG 271 -13.190 12.071 -12.554 167 2HD ARG 271 1HD ARG 271 -12.556 11.085 -13.871 168 HE ARG 271 HE ARG 271 -14.342 10.252 -11.826 169 1HH1 ARG 271 1HH1 ARG 271 -11.833 9.115 -13.928 170 2HH1 ARG 271 2HH1 ARG 271 -12.258 7.435 -13.727 171 1HH2 ARG 271 1HH2 ARG 271 -14.886 8.100 -11.580 172 2HH2 ARG 271 2HH2 ARG 271 -13.959 6.863 -12.392 173 H ALA 272 H ALA 272 -9.377 13.295 -9.498 174 HA ALA 272 HA ALA 272 -8.692 12.663 -7.438 175 1HB ALA 272 1HB ALA 272 -11.368 12.126 -6.331 176 2HB ALA 272 2HB ALA 272 -11.077 13.761 -6.924 177 3HB ALA 272 3HB ALA 272 -10.032 13.075 -5.678 178 H SER 273 H SER 273 -11.478 10.634 -8.375 179 HA SER 273 HA SER 273 -10.419 8.310 -7.054 180 1HB SER 273 2HB SER 273 -12.244 7.090 -8.194 181 2HB SER 273 1HB SER 273 -12.817 8.512 -7.322 182 HG SER 273 HG SER 273 -12.182 8.563 -10.083 183 H LEU 274 H LEU 274 -8.670 7.383 -7.715 184 HA LEU 274 HA LEU 274 -7.927 7.292 -10.497 185 1HB LEU 274 2HB LEU 274 -5.852 6.334 -9.769 186 2HB LEU 274 1HB LEU 274 -6.239 7.737 -8.796 187 HG LEU 274 HG LEU 274 -6.857 4.968 -7.804 188 1HD1 LEU 274 1HD1 LEU 274 -4.661 4.527 -7.917 189 2HD1 LEU 274 2HD1 LEU 274 -4.533 5.638 -6.552 190 3HD1 LEU 274 3HD1 LEU 274 -4.237 6.217 -8.192 191 1HD2 LEU 274 1HD2 LEU 274 -7.635 7.251 -6.761 192 2HD2 LEU 274 2HD2 LEU 274 -5.984 7.284 -6.139 193 3HD2 LEU 274 3HD2 LEU 274 -7.053 5.941 -5.731 194 HA PRO 275 HA PRO 275 -8.833 2.520 -9.407 195 1HB PRO 275 2HB PRO 275 -11.722 3.034 -8.900 196 2HB PRO 275 1HB PRO 275 -10.655 1.801 -8.212 197 1HG PRO 275 2HG PRO 275 -11.287 3.864 -6.729 198 2HG PRO 275 1HG PRO 275 -9.587 3.343 -6.810 199 1HD PRO 275 2HD PRO 275 -10.933 5.587 -8.299 200 2HD PRO 275 1HD PRO 275 -9.425 5.629 -7.362 201 H LYS 276 H LYS 276 -11.291 4.690 -10.788 202 HA LYS 276 HA LYS 276 -10.893 3.758 -13.440 203 1HB LYS 276 2HB LYS 276 -12.126 1.807 -12.465 204 2HB LYS 276 1HB LYS 276 -13.489 2.874 -12.164 205 1HG LYS 276 2HG LYS 276 -13.812 1.559 -14.185 206 2HG LYS 276 1HG LYS 276 -13.722 3.283 -14.547 207 1HD LYS 276 2HD LYS 276 -12.461 1.892 -16.155 208 2HD LYS 276 1HD LYS 276 -11.441 3.051 -15.304 209 1HE LYS 276 2HE LYS 276 -10.375 0.848 -15.491 210 2HE LYS 276 1HE LYS 276 -10.656 1.303 -13.811 211 1HZ LYS 276 1HZ LYS 276 -11.375 -1.048 -14.944 212 2HZ LYS 276 2HZ LYS 276 -12.826 -0.181 -14.969 213 3HZ LYS 276 3HZ LYS 276 -12.010 -0.422 -13.507 Start of MODEL 20 1 1H ALA 249 1HT ALA 249 5.334 -11.580 -2.474 2 2H ALA 249 2HT ALA 249 4.170 -11.671 -1.247 3 3H ALA 249 3HT ALA 249 5.745 -11.160 -0.885 4 HA ALA 249 HA ALA 249 5.334 -9.071 -1.439 5 1HB ALA 249 1HB ALA 249 3.892 -10.177 -3.841 6 2HB ALA 249 2HB ALA 249 5.538 -9.548 -3.779 7 3HB ALA 249 3HB ALA 249 4.169 -8.462 -3.544 8 HA PRO 250 HA PRO 250 1.451 -8.262 0.514 9 1HB PRO 250 2HB PRO 250 1.137 -5.643 0.058 10 2HB PRO 250 1HB PRO 250 2.466 -6.251 1.052 11 1HG PRO 250 2HG PRO 250 2.484 -5.454 -1.838 12 2HG PRO 250 1HG PRO 250 3.609 -4.984 -0.547 13 1HD PRO 250 2HD PRO 250 4.155 -6.977 -2.282 14 2HD PRO 250 1HD PRO 250 4.710 -7.005 -0.597 15 H ALA 251 H ALA 251 0.940 -9.575 -1.851 16 HA ALA 251 HA ALA 251 -0.636 -9.977 -3.430 17 1HB ALA 251 1HB ALA 251 -2.261 -9.973 -1.773 18 2HB ALA 251 2HB ALA 251 -2.906 -8.849 -2.968 19 3HB ALA 251 3HB ALA 251 -2.132 -8.234 -1.509 20 H ARG 252 H ARG 252 -2.189 -6.913 -3.186 21 HA ARG 252 HA ARG 252 -1.497 -6.311 -5.909 22 1HB ARG 252 2HB ARG 252 -3.381 -5.119 -3.919 23 2HB ARG 252 1HB ARG 252 -2.982 -4.247 -5.395 24 1HG ARG 252 2HG ARG 252 -4.232 -6.972 -5.175 25 2HG ARG 252 1HG ARG 252 -4.984 -5.488 -5.769 26 1HD ARG 252 2HD ARG 252 -3.400 -5.423 -7.630 27 2HD ARG 252 1HD ARG 252 -2.623 -6.886 -7.029 28 HE ARG 252 HE ARG 252 -4.241 -8.085 -8.078 29 1HH1 ARG 252 1HH1 ARG 252 -5.466 -4.895 -7.570 30 2HH1 ARG 252 2HH1 ARG 252 -6.977 -5.223 -8.337 31 1HH2 ARG 252 1HH2 ARG 252 -6.203 -8.512 -9.088 32 2HH2 ARG 252 2HH2 ARG 252 -7.392 -7.265 -9.198 33 H VAL 253 H VAL 253 0.819 -6.187 -5.016 34 HA VAL 253 HA VAL 253 1.863 -4.047 -3.623 35 HB VAL 253 HB VAL 253 3.265 -5.860 -4.240 36 1HG1 VAL 253 1HG1 VAL 253 3.683 -6.685 -6.324 37 2HG1 VAL 253 2HG1 VAL 253 3.381 -5.138 -7.113 38 3HG1 VAL 253 3HG1 VAL 253 2.030 -6.105 -6.525 39 1HG2 VAL 253 1HG2 VAL 253 4.170 -3.340 -5.601 40 2HG2 VAL 253 2HG2 VAL 253 5.221 -4.705 -5.229 41 3HG2 VAL 253 3HG2 VAL 253 4.455 -3.801 -3.924 42 H GLY 254 H GLY 254 1.471 -4.244 -7.136 43 1HA GLY 254 2HA GLY 254 2.340 -1.686 -7.824 44 2HA GLY 254 1HA GLY 254 1.186 -2.625 -8.758 45 H LEU 255 H LEU 255 -1.002 -2.728 -7.147 46 HA LEU 255 HA LEU 255 -2.174 -0.183 -7.488 47 1HB LEU 255 2HB LEU 255 -3.007 -2.801 -6.584 48 2HB LEU 255 1HB LEU 255 -3.730 -1.534 -5.610 49 HG LEU 255 HG LEU 255 -3.948 -1.857 -8.599 50 1HD1 LEU 255 1HD1 LEU 255 -5.607 -3.208 -7.954 51 2HD1 LEU 255 2HD1 LEU 255 -6.461 -1.714 -7.569 52 3HD1 LEU 255 3HD1 LEU 255 -5.602 -2.590 -6.302 53 1HD2 LEU 255 1HD2 LEU 255 -4.541 0.431 -6.797 54 2HD2 LEU 255 2HD2 LEU 255 -5.666 0.091 -8.110 55 3HD2 LEU 255 3HD2 LEU 255 -3.972 0.423 -8.466 56 H GLY 256 H GLY 256 -0.896 -1.867 -4.645 57 1HA GLY 256 2HA GLY 256 -1.687 0.010 -2.708 58 2HA GLY 256 1HA GLY 256 -0.339 -1.105 -2.556 59 H ILE 257 H ILE 257 1.477 -0.291 -4.388 60 HA ILE 257 HA ILE 257 2.537 2.045 -3.189 61 HB ILE 257 HB ILE 257 4.301 1.987 -4.900 62 1HG1 ILE 257 2HG1 ILE 257 4.065 -0.354 -6.269 63 2HG1 ILE 257 1HG1 ILE 257 2.391 0.191 -6.259 64 1HG2 ILE 257 1HG2 ILE 257 4.219 -0.848 -4.270 65 2HG2 ILE 257 2HG2 ILE 257 3.814 0.177 -2.893 66 3HG2 ILE 257 3HG2 ILE 257 5.344 0.403 -3.741 67 1HD1 ILE 257 1HD1 ILE 257 3.578 0.911 -8.263 68 2HD1 ILE 257 2HD1 ILE 257 4.741 1.781 -7.263 69 3HD1 ILE 257 3HD1 ILE 257 3.052 2.285 -7.294 70 H THR 258 H THR 258 0.730 1.536 -6.189 71 HA THR 258 HA THR 258 1.087 4.152 -7.235 72 HB THR 258 HB THR 258 -1.234 2.256 -7.679 73 HG1 THR 258 1HG THR 258 0.593 1.253 -8.416 74 1HG2 THR 258 1HG2 THR 258 -1.068 4.915 -8.401 75 2HG2 THR 258 2HG2 THR 258 -2.093 3.701 -9.164 76 3HG2 THR 258 3HG2 THR 258 -0.508 4.071 -9.843 77 H THR 259 H THR 259 -1.345 2.724 -5.081 78 HA THR 259 HA THR 259 -3.026 5.004 -4.923 79 HB THR 259 HB THR 259 -2.630 2.848 -2.828 80 HG1 THR 259 1HG THR 259 -3.309 1.869 -4.720 81 1HG2 THR 259 1HG2 THR 259 -5.238 4.188 -3.177 82 2HG2 THR 259 2HG2 THR 259 -3.955 5.176 -2.481 83 3HG2 THR 259 3HG2 THR 259 -4.420 3.664 -1.705 84 H VAL 260 H VAL 260 -0.388 3.818 -2.835 85 HA VAL 260 HA VAL 260 -0.452 5.932 -0.974 86 HB VAL 260 HB VAL 260 1.892 4.220 -1.830 87 1HG1 VAL 260 1HG1 VAL 260 3.126 5.007 -0.037 88 2HG1 VAL 260 2HG1 VAL 260 1.705 5.636 0.796 89 3HG1 VAL 260 3HG1 VAL 260 2.338 6.472 -0.621 90 1HG2 VAL 260 1HG2 VAL 260 -0.191 3.131 -0.825 91 2HG2 VAL 260 2HG2 VAL 260 0.258 3.943 0.674 92 3HG2 VAL 260 3HG2 VAL 260 1.357 2.777 -0.060 93 H LEU 261 H LEU 261 1.452 5.512 -3.965 94 HA LEU 261 HA LEU 261 2.910 7.916 -3.822 95 1HB LEU 261 2HB LEU 261 3.323 5.981 -5.371 96 2HB LEU 261 1HB LEU 261 1.983 6.561 -6.344 97 HG LEU 261 HG LEU 261 3.162 8.645 -6.788 98 1HD1 LEU 261 1HD1 LEU 261 4.510 8.139 -4.464 99 2HD1 LEU 261 2HD1 LEU 261 4.955 9.360 -5.654 100 3HD1 LEU 261 3HD1 LEU 261 5.728 7.776 -5.688 101 1HD2 LEU 261 1HD2 LEU 261 3.549 6.880 -8.345 102 2HD2 LEU 261 2HD2 LEU 261 4.757 6.142 -7.290 103 3HD2 LEU 261 3HD2 LEU 261 5.084 7.698 -8.054 104 H THR 262 H THR 262 -0.242 7.180 -5.271 105 HA THR 262 HA THR 262 -0.716 9.718 -6.424 106 HB THR 262 HB THR 262 -2.704 7.667 -5.422 107 HG1 THR 262 1HG THR 262 -1.534 6.753 -7.063 108 1HG2 THR 262 1HG2 THR 262 -4.408 8.868 -6.288 109 2HG2 THR 262 2HG2 THR 262 -3.429 9.509 -7.607 110 3HG2 THR 262 3HG2 THR 262 -3.320 10.226 -5.999 111 H MET 263 H MET 263 -1.660 8.321 -3.310 112 HA MET 263 HA MET 263 -3.103 10.524 -2.325 113 1HB MET 263 2HB MET 263 -3.178 8.200 -1.422 114 2HB MET 263 1HB MET 263 -1.589 8.462 -0.719 115 1HG MET 263 2HG MET 263 -3.270 8.753 0.966 116 2HG MET 263 1HG MET 263 -2.510 10.305 0.623 117 1HE MET 263 1HE MET 263 -6.042 8.253 0.166 118 2HE MET 263 2HE MET 263 -5.018 8.189 -1.268 119 3HE MET 263 3HE MET 263 -6.509 9.129 -1.292 120 H THR 264 H THR 264 0.342 9.638 -1.879 121 HA THR 264 HA THR 264 0.887 11.828 -0.142 122 HB THR 264 HB THR 264 2.380 9.895 -0.154 123 HG1 THR 264 1HG THR 264 4.075 11.141 0.279 124 1HG2 THR 264 1HG2 THR 264 3.927 9.457 -1.946 125 2HG2 THR 264 2HG2 THR 264 3.339 10.851 -2.852 126 3HG2 THR 264 3HG2 THR 264 2.293 9.454 -2.607 127 H THR 265 H THR 265 1.862 13.796 -0.503 128 HA THR 265 HA THR 265 1.146 15.147 -2.867 129 HB THR 265 HB THR 265 1.337 16.364 -0.781 130 HG1 THR 265 1HG THR 265 3.120 17.154 -2.861 131 1HG2 THR 265 1HG2 THR 265 3.921 16.940 -0.270 132 2HG2 THR 265 2HG2 THR 265 4.081 15.274 -0.823 133 3HG2 THR 265 3HG2 THR 265 3.033 15.654 0.544 134 H GLN 266 H GLN 266 3.858 13.186 -2.242 135 HA GLN 266 HA GLN 266 5.880 14.431 -3.696 136 1HB GLN 266 2HB GLN 266 5.341 11.485 -3.358 137 2HB GLN 266 1HB GLN 266 6.839 12.163 -3.980 138 1HG GLN 266 2HG GLN 266 5.721 12.783 -1.262 139 2HG GLN 266 1HG GLN 266 6.887 11.504 -1.577 140 1HE2 GLN 266 1HE2 GLN 266 7.796 13.714 -3.724 141 2HE2 GLN 266 2HE2 GLN 266 8.901 14.643 -2.778 142 H SER 267 H SER 267 3.343 12.223 -4.866 143 HA SER 267 HA SER 267 4.292 12.463 -7.603 144 1HB SER 267 2HB SER 267 3.334 10.327 -6.840 145 2HB SER 267 1HB SER 267 1.796 11.126 -6.523 146 HG SER 267 HG SER 267 1.667 11.598 -8.759 147 H SER 268 H SER 268 3.814 14.955 -6.727 148 HA SER 268 HA SER 268 2.762 16.913 -7.197 149 1HB SER 268 2HB SER 268 1.466 15.297 -9.408 150 2HB SER 268 1HB SER 268 1.424 17.052 -9.279 151 HG SER 268 HG SER 268 3.305 15.531 -10.370 152 H GLY 269 H GLY 269 1.653 15.404 -5.140 153 1HA GLY 269 2HA GLY 269 -1.167 15.114 -5.340 154 2HA GLY 269 1HA GLY 269 -0.243 15.180 -3.848 155 H SER 270 H SER 270 0.860 17.724 -4.044 156 HA SER 270 HA SER 270 -1.406 19.353 -3.313 157 1HB SER 270 2HB SER 270 1.517 20.073 -3.518 158 2HB SER 270 1HB SER 270 0.263 21.049 -2.755 159 HG SER 270 HG SER 270 1.427 18.626 -1.894 160 H ARG 271 H ARG 271 -1.767 18.726 -5.865 161 HA ARG 271 HA ARG 271 -2.419 19.588 -7.863 162 1HB ARG 271 2HB ARG 271 -3.068 21.582 -6.498 163 2HB ARG 271 1HB ARG 271 -1.490 22.274 -6.842 164 1HG ARG 271 2HG ARG 271 -2.021 22.203 -9.252 165 2HG ARG 271 1HG ARG 271 -3.635 21.612 -8.848 166 1HD ARG 271 2HD ARG 271 -3.594 24.041 -9.258 167 2HD ARG 271 1HD ARG 271 -4.107 23.641 -7.618 168 HE ARG 271 HE ARG 271 -1.396 24.037 -7.462 169 1HH1 ARG 271 1HH1 ARG 271 -4.121 25.939 -8.451 170 2HH1 ARG 271 2HH1 ARG 271 -3.365 27.444 -7.996 171 1HH2 ARG 271 1HH2 ARG 271 -0.472 25.986 -6.873 172 2HH2 ARG 271 2HH2 ARG 271 -1.351 27.459 -7.131 173 H ALA 272 H ALA 272 -1.458 19.502 -9.823 174 HA ALA 272 HA ALA 272 1.400 19.400 -9.952 175 1HB ALA 272 1HB ALA 272 0.847 19.102 -12.481 176 2HB ALA 272 2HB ALA 272 -0.809 18.934 -11.900 177 3HB ALA 272 3HB ALA 272 0.441 17.832 -11.328 178 H SER 273 H SER 273 0.992 21.916 -9.140 179 HA SER 273 HA SER 273 2.326 23.478 -11.096 180 1HB SER 273 2HB SER 273 0.634 25.239 -11.441 181 2HB SER 273 1HB SER 273 0.169 23.704 -12.166 182 HG SER 273 HG SER 273 -0.759 24.782 -9.706 183 H LEU 274 H LEU 274 3.677 24.467 -9.952 184 HA LEU 274 HA LEU 274 3.406 25.128 -7.218 185 1HB LEU 274 2HB LEU 274 5.540 24.595 -8.308 186 2HB LEU 274 1HB LEU 274 5.417 26.060 -9.259 187 HG LEU 274 HG LEU 274 5.542 27.390 -7.161 188 1HD1 LEU 274 1HD1 LEU 274 6.244 24.773 -5.848 189 2HD1 LEU 274 2HD1 LEU 274 4.694 25.593 -5.665 190 3HD1 LEU 274 3HD1 LEU 274 6.172 26.365 -5.093 191 1HD2 LEU 274 1HD2 LEU 274 7.950 25.705 -7.034 192 2HD2 LEU 274 2HD2 LEU 274 7.788 27.442 -7.282 193 3HD2 LEU 274 3HD2 LEU 274 7.537 26.332 -8.629 194 HA PRO 275 HA PRO 275 2.921 29.698 -9.092 195 1HB PRO 275 2HB PRO 275 0.781 29.024 -11.048 196 2HB PRO 275 1HB PRO 275 2.072 30.230 -11.155 197 1HG PRO 275 2HG PRO 275 2.294 28.023 -12.558 198 2HG PRO 275 1HG PRO 275 3.695 28.625 -11.642 199 1HD PRO 275 2HD PRO 275 1.761 26.441 -10.882 200 2HD PRO 275 1HD PRO 275 3.537 26.398 -10.874 201 H LYS 276 H LYS 276 0.579 31.020 -9.331 202 HA LYS 276 HA LYS 276 -0.780 30.415 -6.889 203 1HB LYS 276 2HB LYS 276 -0.515 32.719 -7.564 204 2HB LYS 276 1HB LYS 276 -1.393 32.425 -9.060 205 1HG LYS 276 2HG LYS 276 -3.297 31.684 -7.390 206 2HG LYS 276 1HG LYS 276 -2.411 32.739 -6.288 207 1HD LYS 276 2HD LYS 276 -4.202 33.934 -7.480 208 2HD LYS 276 1HD LYS 276 -2.604 34.581 -7.854 209 1HE LYS 276 2HE LYS 276 -4.060 34.342 -9.845 210 2HE LYS 276 1HE LYS 276 -2.564 33.415 -9.956 211 1HZ LYS 276 1HZ LYS 276 -3.662 31.418 -9.709 212 2HZ LYS 276 2HZ LYS 276 -4.804 32.321 -10.594 213 3HZ LYS 276 3HZ LYS 276 -4.998 32.125 -8.927
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